id category name description xref provided_by synonym exact_synonym broad_synonym narrow_synonym related_synonym deprecated iri same_as subsets
APO:0000017 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000017
APO:0000045 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000045
APO:0000082 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000082
APO:0000083 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000083
APO:0000097 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000097
APO:0000148 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000148
APO:0000152 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000152
APO:0000276 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000276
APO:0000330 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000330
APO:0000336 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000336
APO:0000337 biolink:NamedThing Graph http://purl.obolibrary.org/obo/APO_0000337
BFO:0000001 biolink:NamedThing entity Graph http://purl.obolibrary.org/obo/BFO_0000001
BFO:0000002 biolink:NamedThing continuant Graph http://purl.obolibrary.org/obo/BFO_0000002
BFO:0000003 biolink:NamedThing occurrent Graph http://purl.obolibrary.org/obo/BFO_0000003
BFO:0000004 biolink:NamedThing independent continuant Graph http://purl.obolibrary.org/obo/BFO_0000004
BFO:0000006 biolink:NamedThing spatial region Graph http://purl.obolibrary.org/obo/BFO_0000006
BFO:0000015 biolink:NamedThing process Graph http://purl.obolibrary.org/obo/BFO_0000015
BFO:0000017 biolink:NamedThing realizable entity Graph http://purl.obolibrary.org/obo/BFO_0000017
BFO:0000019 biolink:NamedThing quality Graph http://purl.obolibrary.org/obo/BFO_0000019
BFO:0000020 biolink:NamedThing specifically dependent continuant Graph http://purl.obolibrary.org/obo/BFO_0000020
BFO:0000023 biolink:NamedThing role Graph http://purl.obolibrary.org/obo/BFO_0000023
BFO:0000027 biolink:NamedThing object aggregate Graph http://purl.obolibrary.org/obo/BFO_0000027
BFO:0000031 biolink:NamedThing generically dependent continuant Graph http://purl.obolibrary.org/obo/BFO_0000031
BFO:0000040 biolink:NamedThing material entity Graph http://purl.obolibrary.org/obo/BFO_0000040
BFO:0000141 biolink:NamedThing immaterial entity Graph http://purl.obolibrary.org/obo/BFO_0000141
BSPO:0000000 biolink:NamedThing left side The side of an organism that is left of the sagittal plane. Graph left left http://purl.obolibrary.org/obo/BSPO_0000000
BSPO:0000001 biolink:NamedThing upper side Graph upper upper http://purl.obolibrary.org/obo/BSPO_0000001
BSPO:0000004 biolink:NamedThing superficial side Graph superficial superficial http://purl.obolibrary.org/obo/BSPO_0000004
BSPO:0000005 biolink:NamedThing anatomical surface A 2D surface of an anatomical continuant. FMA:24137 Graph surface surface http://purl.obolibrary.org/obo/BSPO_0000005
BSPO:0000006 biolink:NamedThing anatomical margin Fiat anatomical region extending a short distance from the boundary of an object inwards. Graph edge|margin edge|margin http://purl.obolibrary.org/obo/BSPO_0000006
BSPO:0000007 biolink:NamedThing right side The side of an organism that is right of the sagittal plane. Graph right right http://purl.obolibrary.org/obo/BSPO_0000007
BSPO:0000009 biolink:NamedThing midsagittal plane Sagittal plane that divides bilateral body into equal left and right parts. FMA:74563 Graph median plane|median sagittal plane|midline plane|midsagittal section median sagittal plane|midline plane|midsagittal section median plane http://purl.obolibrary.org/obo/BSPO_0000009
BSPO:0000010 biolink:NamedThing anatomical axis A straight line through space, intersecting an anatomical entity. http://upload.wikimedia.org/wikipedia/commons/3/34/Anatomical_Directions_and_Axes.JPG Graph http://purl.obolibrary.org/obo/BSPO_0000010
BSPO:0000011 biolink:NamedThing upper-lower axis An anatomical axis determined by gravity. Graph superior-inferior axis superior-inferior axis http://purl.obolibrary.org/obo/BSPO_0000011
BSPO:0000012 biolink:NamedThing deep-superficial axis An axis that extends from an internal position to a more external position in the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000012
BSPO:0000013 biolink:NamedThing anterior-posterior axis An axis that extends through an organism from head end to opposite end of body or tail. Graph A-P axis|AP axis|anteroposterior axis|cephalocaudal axis|craniocaudal axis|longitudinal axis|rostral/caudal|rostrocaudal axis A-P axis|AP axis|anteroposterior axis cephalocaudal axis|craniocaudal axis|rostral/caudal|rostrocaudal axis longitudinal axis http://purl.obolibrary.org/obo/BSPO_0000013
BSPO:0000014 biolink:NamedThing apical-basal axis relative to substrate An axis that extends through an organism or organism part from the part of the organism or organism part attached to a substrate (basal) to the furthest from the attachment (apical). Note that the apical-basal axis is often used for organismal parts where there is attachment via a basal lamina or other structure. Graph apical/basal|longitudinal axis apical/basal longitudinal axis http://purl.obolibrary.org/obo/BSPO_0000014
BSPO:0000015 biolink:NamedThing proximal-distal axis An axis that extends from the point of attachment of a structure (proximal) to the point furthest away from the plane of attachment (distal). Graph proximal/distal|proximodistal proximal/distal|proximodistal http://purl.obolibrary.org/obo/BSPO_0000015
BSPO:0000016 biolink:NamedThing dorsal-ventral axis An axis that is approximately perpendicular to the anterior-posterior axis and that extends through the horizontal plane of the body. Graph D-V axis|DV axis|anterior-posterior axis|dorsoventral axis D-V axis|DV axis|dorsoventral axis anterior-posterior axis http://purl.obolibrary.org/obo/BSPO_0000016
BSPO:0000017 biolink:NamedThing left-right axis An axis that bisects an organism from left to right sides of body, through a sagittal plane. Graph L-R axis|LR axis|R-L axis|RL axis|dextro-sinister axis|left to right axis|right to left axis|right-left axis L-R axis|LR axis|R-L axis|RL axis|dextro-sinister axis|left to right axis|right to left axis|right-left axis http://purl.obolibrary.org/obo/BSPO_0000017
BSPO:0000018 biolink:NamedThing transverse plane Anatomical plane that divides body into anterior and posterior parts. FMA:12247 Graph axial plane|axial section|cross-section|transverse section axial plane|axial section|transverse section cross-section http://purl.obolibrary.org/obo/BSPO_0000018
BSPO:0000019 biolink:NamedThing horizontal plane Anatomical plane that divides bilateral body into dorsal and ventral parts. FMA:52810 Graph coronal section|frontal plane|frontal section|horizontal anatomical plane|horizontal section frontal plane|horizontal anatomical plane|horizontal section coronal section|frontal section http://purl.obolibrary.org/obo/BSPO_0000019
BSPO:0000026 biolink:NamedThing antero-dorsal region Anatomical region that overlaps the anterior and dorsal regions of a body or body part. Graph anterodorsal region anterodorsal region http://purl.obolibrary.org/obo/BSPO_0000026
BSPO:0000027 biolink:NamedThing antero-ventral region Anatomical region that overlaps the anterior and ventral regions of a body or body part. Graph anteroventral region anteroventral region http://purl.obolibrary.org/obo/BSPO_0000027
BSPO:0000028 biolink:NamedThing postero-lateral region Anatomical region that overlaps the posterior and lateral regions of the body or body part. Graph posterolateral region posterolateral region http://purl.obolibrary.org/obo/BSPO_0000028
BSPO:0000029 biolink:NamedThing antero-lateral region Anatomical region that overlaps the anterior and lateral regions of a body or body part. Graph anterolateral region anterolateral region http://purl.obolibrary.org/obo/BSPO_0000029
BSPO:0000030 biolink:NamedThing postero-dorsal region Anatomical region that overlaps the posterior and dorsal regions of the body or body part. Graph posterodorsal region posterodorsal region http://purl.obolibrary.org/obo/BSPO_0000030
BSPO:0000031 biolink:NamedThing upper region Graph http://purl.obolibrary.org/obo/BSPO_0000031
BSPO:0000034 biolink:NamedThing superficial region Anatomical region superficially located on the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000034
BSPO:0000035 biolink:NamedThing postero-ventral region Anatomical region that overlaps the posterior and ventral regions of a body or body part. Graph posteroventral region posteroventral region http://purl.obolibrary.org/obo/BSPO_0000035
BSPO:0000036 biolink:NamedThing anterior-most region Graph anterior-most|anteriormost anterior-most|anteriormost http://purl.obolibrary.org/obo/BSPO_0000036
BSPO:0000037 biolink:NamedThing posterior-most region Graph posterior-most|posteriormost posterior-most|posteriormost http://purl.obolibrary.org/obo/BSPO_0000037
BSPO:0000038 biolink:NamedThing dorsal-most region Graph dorsal-most|dorsalmost dorsal-most|dorsalmost http://purl.obolibrary.org/obo/BSPO_0000038
BSPO:0000039 biolink:NamedThing ventral-most region Graph ventral-most|ventralmost ventral-most|ventralmost http://purl.obolibrary.org/obo/BSPO_0000039
BSPO:0000040 biolink:NamedThing upper/lower compartment boundary Graph http://purl.obolibrary.org/obo/BSPO_0000040
BSPO:0000041 biolink:NamedThing deep/superficial compartment boundary Graph http://purl.obolibrary.org/obo/BSPO_0000041
BSPO:0000042 biolink:NamedThing antero-medial margin Anatomical margin that is located on the antero-medial region of the body or body part. Graph anteromedial margin anteromedial margin http://purl.obolibrary.org/obo/BSPO_0000042
BSPO:0000043 biolink:NamedThing apical/basal compartment boundary Graph http://purl.obolibrary.org/obo/BSPO_0000043
BSPO:0000044 biolink:NamedThing proximal/distal compartment boundary Graph http://purl.obolibrary.org/obo/BSPO_0000044
BSPO:0000045 biolink:NamedThing antero-lateral margin Anatomical margin that is located on the antero-lateral region of the body or body part. Graph anterolateral margin anterolateral margin http://purl.obolibrary.org/obo/BSPO_0000045
BSPO:0000046 biolink:NamedThing postero-medial margin Anatomical margin that is located on the postero-medial region of the body or body part. Graph posteromedial margin posteromedial margin http://purl.obolibrary.org/obo/BSPO_0000046
BSPO:0000047 biolink:NamedThing postero-lateral margin Anatomical margin that is located on the postero-lateral region of the body or body part. Graph posterolateral margin posterolateral margin http://purl.obolibrary.org/obo/BSPO_0000047
BSPO:0000048 biolink:NamedThing dorso-medial margin Anatomical margin that is located on the dorso-medial region of the body or body part. Graph dorso-medial margin dorso-medial margin http://purl.obolibrary.org/obo/BSPO_0000048
BSPO:0000049 biolink:NamedThing ventro-medial margin Anatomical margin that is located on the ventro-medial region of the body or body part. Graph ventromedial margin ventromedial margin http://purl.obolibrary.org/obo/BSPO_0000049
BSPO:0000050 biolink:NamedThing antero-medial region Anatomical region that overlaps the anterior and medial regions of the body or body part. Graph anteromedial region anteromedial region http://purl.obolibrary.org/obo/BSPO_0000050
BSPO:0000054 biolink:NamedThing anatomical side An anatomical region bounded by a plane perpendicular to an axis through the middle. FBql:00005841 Graph http://purl.obolibrary.org/obo/BSPO_0000054
BSPO:0000055 biolink:NamedThing anterior side An anatomical region that is the entire part of an anatomical structure anterior to a transverse plane and bounded on one side by the same transverse plane. FBcv:0000053|FBql:00005848 Graph anterior|rostral anterior|rostral http://purl.obolibrary.org/obo/BSPO_0000055
BSPO:0000056 biolink:NamedThing posterior side An anatomical region that is the entire part of an anatomical structure posterior to a transverse plane and bounded on one side by the same transverse plane. FBcv:0000065|FBql:00005849 Graph caudal|posterior posterior caudal http://purl.obolibrary.org/obo/BSPO_0000056
BSPO:0000057 biolink:NamedThing apical side Anatomical side that is located on the apical end of an organism or structure. FBcv:0000054|FBql:00005854 Graph apical apical http://purl.obolibrary.org/obo/BSPO_0000057
BSPO:0000058 biolink:NamedThing basal side Anatomical side that is located on the basal end of an organism or structure. FBcv:0000055|FBql:00005855 Graph basal basal http://purl.obolibrary.org/obo/BSPO_0000058
BSPO:0000059 biolink:NamedThing central side Anatomical side that is centrally located on an organism or structure. FBcv:0000056|FBql:00015851 Graph central central http://purl.obolibrary.org/obo/BSPO_0000059
BSPO:0000060 biolink:NamedThing contralateral side On the opposite side. FBcv:0000057|FBql:00005851 Graph contralateral contralateral http://purl.obolibrary.org/obo/BSPO_0000060
BSPO:0000061 biolink:NamedThing proximal side FBcv:0000066|FBql:00005852 Graph proximal proximal http://purl.obolibrary.org/obo/BSPO_0000061
BSPO:0000062 biolink:NamedThing distal side Anatomical side that is distally located on an organism or structure. FBcv:0000058|FBql:00005853 Graph distal distal http://purl.obolibrary.org/obo/BSPO_0000062
BSPO:0000063 biolink:NamedThing dorsal side An anatomical region that is the entire part of an anatomical structure dorsal to a horizontal plane and bounded on one side by the same transverse plane. FBcv:0000059|FBql:00005842 Graph dorsal dorsal http://purl.obolibrary.org/obo/BSPO_0000063
BSPO:0000064 biolink:NamedThing postero-medial region Anatomical region that overlaps the posterior and medial regions of the body or body part. Graph posteromedial region posteromedial region http://purl.obolibrary.org/obo/BSPO_0000064
BSPO:0000065 biolink:NamedThing ipsilateral side On the same side FBcv:0000062|FBql:00005850 Graph ipsilateral ipsilateral http://purl.obolibrary.org/obo/BSPO_0000065
BSPO:0000066 biolink:NamedThing lateral side FBcv:0000063|FBql:00005844 Graph lateral lateral http://purl.obolibrary.org/obo/BSPO_0000066
BSPO:0000067 biolink:NamedThing medial side FBcv:0000064|FBql:00005847 Graph medial medial http://purl.obolibrary.org/obo/BSPO_0000067
BSPO:0000068 biolink:NamedThing ventral side An anatomical region that is the entire part of an anatomical structure ventral to a horizontal plane and bounded on one side by the same horizontal plane. FBcv:0000070|FBql:00005843 Graph ventral ventral http://purl.obolibrary.org/obo/BSPO_0000068
BSPO:0000069 biolink:NamedThing dorso-medial region Anatomical region that overlaps the dorsal and medial regions of the body or body part. Graph dorsomedial region dorsomedial region http://purl.obolibrary.org/obo/BSPO_0000069
BSPO:0000070 biolink:NamedThing anatomical region A 3D region in space without well-defined compartmental boundaries; for example, the dorsal region of an ectoderm. FBql:00005841 Graph http://purl.obolibrary.org/obo/BSPO_0000070
BSPO:0000071 biolink:NamedThing anterior region Anatomical region anteriorly located on the body or body part. FBql:00005848 Graph http://purl.obolibrary.org/obo/BSPO_0000071
BSPO:0000072 biolink:NamedThing posterior region Anatomical region posteriorly located on the body or body part. FBql:00005849 Graph http://purl.obolibrary.org/obo/BSPO_0000072
BSPO:0000073 biolink:NamedThing apical region Anatomical region located on the apical end on the body or body part. FBql:00005854 Graph http://purl.obolibrary.org/obo/BSPO_0000073
BSPO:0000074 biolink:NamedThing basal region Anatomical region located basally on the body or body part. FBql:00005855 Graph http://purl.obolibrary.org/obo/BSPO_0000074
BSPO:0000075 biolink:NamedThing central region Anatomical region centrally located on the body or body part. FBql:00015851 Graph http://purl.obolibrary.org/obo/BSPO_0000075
BSPO:0000076 biolink:NamedThing contralateral region FBql:00005851 Graph http://purl.obolibrary.org/obo/BSPO_0000076
BSPO:0000077 biolink:NamedThing proximal region Anatomical region proximally located on the body or body part. FBql:00005852 Graph http://purl.obolibrary.org/obo/BSPO_0000077
BSPO:0000078 biolink:NamedThing distal region Anatomical region distally located on the body or body part. FBql:00005853 Graph http://purl.obolibrary.org/obo/BSPO_0000078
BSPO:0000079 biolink:NamedThing dorsal region Anatomical region dorsally located on the body or body part. FBql:00005842 Graph http://purl.obolibrary.org/obo/BSPO_0000079
BSPO:0000080 biolink:NamedThing dorso-lateral region Anatomical region that overlaps the dorsal and lateral regions of a body or body part. FBql:00005845 Graph dorsolateral region dorsolateral region http://purl.obolibrary.org/obo/BSPO_0000080
BSPO:0000081 biolink:NamedThing ipsilateral region FBql:00005850 Graph http://purl.obolibrary.org/obo/BSPO_0000081
BSPO:0000082 biolink:NamedThing lateral region Anatomical region laterally located on the body or body part. FBql:00005844 Graph http://purl.obolibrary.org/obo/BSPO_0000082
BSPO:0000083 biolink:NamedThing medial region Anatomical region medially located on the body or body part. FBql:00005847 Graph http://purl.obolibrary.org/obo/BSPO_0000083
BSPO:0000084 biolink:NamedThing ventral region Anatomical region ventrally located on the body or body part. FBql:00005843 Graph http://purl.obolibrary.org/obo/BSPO_0000084
BSPO:0000085 biolink:NamedThing ventro-lateral region Anatomical region that overlaps the ventral and lateral regions of a body or body part. FBql:00005846 Graph ventrolateral region ventrolateral region http://purl.obolibrary.org/obo/BSPO_0000085
BSPO:0000086 biolink:NamedThing anatomical compartment FBql:00005873|FMA:9647 Graph http://purl.obolibrary.org/obo/BSPO_0000086
BSPO:0000087 biolink:NamedThing anterior compartment FBcv:0000031|FBql:00005874 Graph http://purl.obolibrary.org/obo/BSPO_0000087
BSPO:0000088 biolink:NamedThing compartment boundary FBcv:0000032|FBql:00005878 Graph http://purl.obolibrary.org/obo/BSPO_0000088
BSPO:0000089 biolink:NamedThing dorsal compartment FBcv:0000035|FBql:00005876 Graph http://purl.obolibrary.org/obo/BSPO_0000089
BSPO:0000092 biolink:NamedThing anatomical compartment boundary FBql:00005881 Graph http://purl.obolibrary.org/obo/BSPO_0000092
BSPO:0000093 biolink:NamedThing anterior/posterior compartment boundary FBcv:0000033|FBql:00005880 Graph http://purl.obolibrary.org/obo/BSPO_0000093
BSPO:0000112 biolink:NamedThing ventro-medial region The region corresponding to the ventral region of the entity, towards the midline. Graph medioventral region|ventromedial region medioventral region|ventromedial region http://purl.obolibrary.org/obo/BSPO_0000112
BSPO:0000127 biolink:NamedThing peripheral region Anatomical region peripherally located on the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000127
BSPO:0000128 biolink:NamedThing axial region Graph http://purl.obolibrary.org/obo/BSPO_0000128
BSPO:0000129 biolink:NamedThing peripheral side Graph http://purl.obolibrary.org/obo/BSPO_0000129
BSPO:0000130 biolink:NamedThing axial side Graph http://purl.obolibrary.org/obo/BSPO_0000130
BSPO:0000195 biolink:NamedThing adaxial-abaxial axis An anatomical axis that extends from the side of the anatomical entity that is closer to an axis (adaxial) to the side that is further from the same axis (abaxial). Graph AA axis|dorsal-ventral axis AA axis dorsal-ventral axis http://purl.obolibrary.org/obo/BSPO_0000195
BSPO:0000196 biolink:NamedThing medial-external axis An anatomical axis that extends from the center of the body outwards or externally. Graph proximal-distal axis proximal-distal axis http://purl.obolibrary.org/obo/BSPO_0000196
BSPO:0000199 biolink:NamedThing animal-vegetal axis An axis that extends from the animal end of an egg or early embryo to the opposite, vegetal end. In animals with yolk-bearing eggs, the vegetal end is the yolk bearing pole. (pertains to animals only - both vertebrate and invertebrate embryos). Graph A-V axis|AV axis|animal/vegetal axis A-V axis|AV axis|animal/vegetal axis http://purl.obolibrary.org/obo/BSPO_0000199
BSPO:0000202 biolink:NamedThing radial plane Anatomical plane that follows the two dimensions specified by an apical-basal axis relative to direction of growth and a medial-lateral axis. Graph http://purl.obolibrary.org/obo/BSPO_0000202
BSPO:0000371 biolink:NamedThing anterior surface Anatomical surface that is located on the anterior side of the body or body part. FBql:00005848 Graph http://purl.obolibrary.org/obo/BSPO_0000371
BSPO:0000372 biolink:NamedThing posterior surface Anatomical surface that is located on the posterior side of the body or body part. FBql:00005849 Graph http://purl.obolibrary.org/obo/BSPO_0000372
BSPO:0000373 biolink:NamedThing apical surface Anatomical surface that is located on the apical side of the body or body part. FBql:00005854 Graph http://purl.obolibrary.org/obo/BSPO_0000373
BSPO:0000374 biolink:NamedThing basal surface Anatomical surface that is located on the basal side of the body or body part. FBql:00005855 Graph http://purl.obolibrary.org/obo/BSPO_0000374
BSPO:0000376 biolink:NamedThing contralateral surface FBql:00005851 Graph http://purl.obolibrary.org/obo/BSPO_0000376
BSPO:0000377 biolink:NamedThing proximal surface Anatomical surface that is located on the proximal side of the body or body part. FBql:00005852 Graph http://purl.obolibrary.org/obo/BSPO_0000377
BSPO:0000378 biolink:NamedThing distal surface Anatomical surface that is located on the distal side of the body or body part. FBql:00005853 Graph http://purl.obolibrary.org/obo/BSPO_0000378
BSPO:0000379 biolink:NamedThing dorsal surface Anatomical surface that located on the dorsal side of the body or body part. FBql:00005842 Graph http://purl.obolibrary.org/obo/BSPO_0000379
BSPO:0000381 biolink:NamedThing ipsilateral surface Anatomical surface that is located on the same side of an organism or structure. FBql:00005850 Graph http://purl.obolibrary.org/obo/BSPO_0000381
BSPO:0000382 biolink:NamedThing lateral surface Anatomical surface that located on the lateral side of the body or body part. FBql:00005844 Graph http://purl.obolibrary.org/obo/BSPO_0000382
BSPO:0000383 biolink:NamedThing medial surface Anatomical surface that located on the medial side of the body or body part. FBql:00005847 Graph http://purl.obolibrary.org/obo/BSPO_0000383
BSPO:0000384 biolink:NamedThing ventral surface Anatomical surface that is located on the ventral side of the body or body part. FBql:00005843 Graph http://purl.obolibrary.org/obo/BSPO_0000384
BSPO:0000400 biolink:NamedThing anatomical plane A flat 2D plane intersecting an anatomical continuant, dividing it into two adjacent portions. FMA:242982 Graph anatomical cross-section|anatomical section|cross-section|plane|section anatomical cross-section|anatomical section|plane|section cross-section http://purl.obolibrary.org/obo/BSPO_0000400
BSPO:0000417 biolink:NamedThing sagittal plane Anatomical plane that divides a bilateral body into left and right parts, not necessarily of even size. FMA:11361 Graph left/right plane|median plane|sagittal section left/right plane|median plane|sagittal section http://purl.obolibrary.org/obo/BSPO_0000417
BSPO:0000671 biolink:NamedThing anterior margin Anatomical margin that is located on the anterior side of a body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000671
BSPO:0000672 biolink:NamedThing posterior margin Anatomical margin that is located on the posterior side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000672
BSPO:0000673 biolink:NamedThing apical margin Anatomical margin that is located on the apical side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000673
BSPO:0000674 biolink:NamedThing basal margin Anatomical margin that is located on the basal side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000674
BSPO:0000677 biolink:NamedThing proximal margin Anatomical margin that is located on the proximal region of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000677
BSPO:0000678 biolink:NamedThing distal margin Anatomical margin that is located on the distal side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000678
BSPO:0000679 biolink:NamedThing dorsal margin Anatomical margin that is located on the dorsal side of body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000679
BSPO:0000680 biolink:NamedThing dorso-lateral margin Anatomical margin that is located on the dorso-lateral region of the body or body part. Graph dorsolateral margin dorsolateral margin http://purl.obolibrary.org/obo/BSPO_0000680
BSPO:0000682 biolink:NamedThing lateral margin Anatomical margin that is located on the lateral side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000682
BSPO:0000683 biolink:NamedThing medial margin Anatomical margin that is located on the medial side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000683
BSPO:0000684 biolink:NamedThing ventral margin Anatomical margin that is located on the ventral side of the body or body part. Graph http://purl.obolibrary.org/obo/BSPO_0000684
BSPO:0000685 biolink:NamedThing ventro-lateral margin Anatomical margin that is located on the ventro-lateral region of the body or body part. Graph ventrolateral margin ventrolateral margin http://purl.obolibrary.org/obo/BSPO_0000685
BSPO:0000686 biolink:NamedThing antero-dorsal margin Anatomical margin that is located on the antero-dorso region of the body or body part. Graph anterodorsal margin anterodorsal margin http://purl.obolibrary.org/obo/BSPO_0000686
BSPO:0000687 biolink:NamedThing postero-dorsal margin Anatomical margin that is located on the postero-dorsal region of the body or body part. Graph posterodorsal margin posterodorsal margin http://purl.obolibrary.org/obo/BSPO_0000687
BSPO:0000688 biolink:NamedThing antero-ventral margin Anatomical margin that is located on the antero-ventral region of the body or body part. Graph anteroventral margin anteroventral margin http://purl.obolibrary.org/obo/BSPO_0000688
BSPO:0000689 biolink:NamedThing postero-ventral margin Anatomical margin that is located on the postero-ventral region of the body or body part. Graph posteroventral margin posteroventral margin http://purl.obolibrary.org/obo/BSPO_0000689
BSPO:0001001 biolink:NamedThing medial-lateral axis An axis that extends from the center of organism to one or other side. http://upload.wikimedia.org/wikipedia/commons/3/34/Anatomical_Directions_and_Axes.JPG Graph M-L axis|ML axis|medio-lateral axis|mediolateral axis|proximal-distal axis M-L axis|ML axis|medio-lateral axis|mediolateral axis proximal-distal axis http://purl.obolibrary.org/obo/BSPO_0001001
CHEBI:100147 biolink:ChemicalEntity nalidixic acid A monocarboxylic acid comprising 1,8-naphthyridin-4-one substituted by carboxylic acid, ethyl and methyl groups at positions 3, 1, and 7, respectively. An orally administered antibacterial, it is used in the treatment of lower urinary-tract infections due to Gram-negative bacteria, including the majority of E. coli, Enterobacter, Klebsiella, and Proteus species. cas:389-08-2|drugbank:DB00779|drugcentral:1875|kegg.compound:C05079|kegg.drug:D00183|lincs.smallmolecule:LSM-5590|patent:BE612258|patent:US3590036|pdb-ccd:NIX|pubmed:11321869|pubmed:12002106|pubmed:12399485|pubmed:12702698|pubmed:14107587|pubmed:16107187|pubmed:16423473|pubmed:16667857|pubmed:16803589|pubmed:17132068|pubmed:17631104|pubmed:18788798|pubmed:19071706|pubmed:28166217|reaxys:750515|vsdb:1880|wikipedia.en:Nalidixic_Acid Graph 1,4-dihydro-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid|1-Aethyl-7-methyl-1,8-naphthyridin-4-on-3-karbonsaeure|1-Ethyl-7-methyl-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid|1-ethyl-1,4-dihydro-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid|1-ethyl-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one-3-carboxylic acid|1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid|3-carboxy-1-ethyl-7-methyl-1,8-naphthyridin-4-one|NALIDIXIC ACID|Nalidixic acid|acide nalidixique|acido nalidixico|acidum nalidixicum|nalidixic acid 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 1,4-dihydro-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid|1-Aethyl-7-methyl-1,8-naphthyridin-4-on-3-karbonsaeure|1-Ethyl-7-methyl-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid|1-ethyl-1,4-dihydro-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid|1-ethyl-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one-3-carboxylic acid|1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid|3-carboxy-1-ethyl-7-methyl-1,8-naphthyridin-4-one|NALIDIXIC ACID|Nalidixic acid|acide nalidixique|acido nalidixico|acidum nalidixicum|nalidixic acid http://purl.obolibrary.org/obo/CHEBI_100147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10022 biolink:ChemicalEntity deoxynivalenol A trichothecene mycotoxin produced by Fusarium to which wheat, barley, maize (corn) and their products are susceptible to contamination. cas:51481-10-8|chemspider:36584|kegg.compound:C09747|knapsack:C00003201|lipidmaps:LMPR0103180002|pubmed:28780485|pubmed:30284112|pubmed:30714884|pubmed:30760085|pubmed:30802751|pubmed:30806951|pubmed:30841652|pubmed:31394401|pubmed:31817218|pubmed:31867960|pubmed:31960350|pubmed:32218143|pubmed:32260237|pubmed:32560237|pubmed:32745571|pubmed:32805342|pubmed:32851525|pubmed:32880717|pubmed:32930227|wikipedia.en:Vomitoxin Graph 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one|4-Deoxynivalenol|4-Desoxynivalenol|DON|Dehydronivalenol|Desoxynivalenol|Vomitoxin 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one|4-Deoxynivalenol|4-Desoxynivalenol|DON|Dehydronivalenol|Desoxynivalenol|Vomitoxin http://purl.obolibrary.org/obo/CHEBI_10022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10023 biolink:ChemicalEntity voriconazole A triazole-based antifungal agent used for the treatment of esophageal candidiasis, invasive pulmonary aspergillosis, and serious fungal infections caused by Scedosporium apiospermum and Fusarium spp. It is an inhibitor of cytochrome P450 2C9 (CYP2C9) and CYP3A4. beilstein:7694998|cas:137234-62-9|drugbank:DB00582|drugcentral:2846|kegg.compound:C07622|kegg.drug:D00578|lincs.smallmolecule:LSM-5244|patent:EP440372|patent:US5278175|pubmed:12940129|pubmed:22718362|pubmed:23392902|pubmed:23527908|pubmed:23766489|pubmed:24102553|wikipedia.en:Voriconazole Graph (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol|(R-(R*,S*))-alpha-(2,4-difluorophenyl)-5-fluoro-beta-methyl-alpha-(1H-1,2,4-triazol-1-ylmethyl)-4-pyrimidineethanol|(alphaR,betaS)-alpha-(2,4-difluorophenyl)-5-fluoro-beta-methyl-alpha(1H-1,2,4-triazol-1-ylmethyl)-4-pyrimidineethanol|VCZ|Vfend|voriconazol|voriconazole|voriconazolum (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol|(R-(R*,S*))-alpha-(2,4-difluorophenyl)-5-fluoro-beta-methyl-alpha-(1H-1,2,4-triazol-1-ylmethyl)-4-pyrimidineethanol|(alphaR,betaS)-alpha-(2,4-difluorophenyl)-5-fluoro-beta-methyl-alpha(1H-1,2,4-triazol-1-ylmethyl)-4-pyrimidineethanol|VCZ|Vfend|voriconazol|voriconazole|voriconazolum http://purl.obolibrary.org/obo/CHEBI_10023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:100241 biolink:ChemicalEntity ciprofloxacin A quinolone that is quinolin-4(1H)-one bearing cyclopropyl, carboxylic acid, fluoro and piperazin-1-yl substituents at positions 1, 3, 6 and 7, respectively. cas:85721-33-1|drugbank:DB00537|drugcentral:659|hmdb:HMDB0014677|kegg.compound:C05349|kegg.drug:D00186|lincs.smallmolecule:LSM-5226|patent:DE3142854|patent:US4670444|pdb-ccd:CPF|pubmed:10397494|pubmed:10737746|reaxys:3568352|vsdb:1763|wikipedia.en:Ciprofloxacin Graph 1-CYCLOPROPYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID|1-Cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-quinoline-3-carboxylic acid|1-Cyclopropyl-6-fluoro-7-(4-methyl-piperazin-1-yl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-7-hexahydro-1-pyrazinyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid|Ciprofloxacin|ciprofloxacin|ciprofloxacine|ciprofloxacino|ciprofloxacinum 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid 1-CYCLOPROPYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID|1-Cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-quinoline-3-carboxylic acid|1-Cyclopropyl-6-fluoro-7-(4-methyl-piperazin-1-yl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid|1-cyclopropyl-6-fluoro-7-hexahydro-1-pyrazinyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid|Ciprofloxacin|ciprofloxacin|ciprofloxacine|ciprofloxacino|ciprofloxacinum http://purl.obolibrary.org/obo/CHEBI_100241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:100246 biolink:ChemicalEntity norfloxacin A quinolinemonocarboxylic acid with broad-spectrum antibacterial activity against most gram-negative and gram-positive bacteria. Norfloxacin is bactericidal and its mode of action depends on blocking of bacterial DNA replication by binding itself to an enzyme called DNA gyrase. cas:70458-96-7|drugbank:DB01059|drugcentral:1967|gmelin:1576626|hmdb:HMDB0015192|kegg.compound:C06687|kegg.drug:D00210|lincs.smallmolecule:LSM-5286|patent:BE863429|patent:DE2840910|patent:US4146719|patent:US4292317|pubmed:3317294|pubmed:3908074|pubmed:6211142|pubmed:6224685|pubmed:6234465|pubmed:6454381|pubmed:6461606|reaxys:567897|vsdb:1831|wikipedia.en:Norfloxacin Graph 1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-Ethyl-6-fluor-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-chinolincarbonsaeure|1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|NFLX|norfloxacin|norfloxacine|norfloxacino|norfloxacinum 1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid 1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-Ethyl-6-fluor-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-chinolincarbonsaeure|1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid|1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|NFLX|norfloxacin|norfloxacine|norfloxacino|norfloxacinum http://purl.obolibrary.org/obo/CHEBI_100246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10033 biolink:ChemicalEntity warfarin A racemate comprising equal amounts of (R)- and (S)-warfarin. Extensively used as both an anticoagulant drug and as a pesticide against rats and mice. cas:81-81-2|drugbank:DB00682|foodb.food:FDB022750|hmdb:HMDB0001935|kegg.compound:C01541|kegg.drug:D08682|lincs.smallmolecule:LSM-1405|patent:US2427578|patent:US2765321|patent:US2777859|patent:US3239529|pesticides:warfarin|pmc:PMC10207235|ppdb:681|pubmed:13358873|pubmed:15578879|pubmed:18294321|pubmed:19294412|pubmed:24478171|pubmed:24973057|pubmed:25022924|pubmed:25023204|pubmed:25393417|pubmed:25466603|pubmed:25534862|pubmed:25537751|pubmed:25555316|pubmed:25683623|pubmed:25757926|pubmed:25823787|pubmed:25828628|pubmed:25830869|pubmed:25842804|pubmed:25845131|pubmed:25986145|pubmed:26114209|pubmed:26142522|pubmed:26142525|pubmed:26203765|pubmed:26238769|pubmed:37359384|pubmed:37648560|pubmed:37755126|reaxys:1293536|wikipedia.en:Warfarin Graph (+-)-warfarin|(RS)-warfarin|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-2-one|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]-2H-chromen-2-one|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]coumarin|Brumolin|Coumafene|DL-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin|DL-warfarin|Kumadu|Kumatox|Ratron|Rodafarin|Warf 10|Zoocoumarin|rac-1-(4'-hydroxy-3'-coumarinyl)-1-phenyl-3-butanone|rac-3-(1'-phenyl-2'-acetylethyl)-4-hydroxycoumarin|rac-3-(acetonylbenzyl)-4-hydroxycoumarin|rac-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin|rac-3-(alpha-phenyl-beta-acetylethyl)-4-hydroxycoumarin|rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one|rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)coumarin|rac-warfarin|racemic warfarin|warfarin|warfarina|warfarine|warfarinum rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one (+-)-warfarin|(RS)-warfarin|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-2-one|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]-2H-chromen-2-one|4-hydroxy-3-[(1RS)-3-oxo-1-phenylbutyl]coumarin|Brumolin|Coumafene|DL-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin|DL-warfarin|Kumadu|Kumatox|Ratron|Rodafarin|Warf 10|Zoocoumarin|rac-1-(4'-hydroxy-3'-coumarinyl)-1-phenyl-3-butanone|rac-3-(1'-phenyl-2'-acetylethyl)-4-hydroxycoumarin|rac-3-(acetonylbenzyl)-4-hydroxycoumarin|rac-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin|rac-3-(alpha-phenyl-beta-acetylethyl)-4-hydroxycoumarin|rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one|rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)coumarin|rac-warfarin|racemic warfarin|warfarin|warfarina|warfarine|warfarinum http://purl.obolibrary.org/obo/CHEBI_10033 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10036 biolink:ChemicalEntity wax ester A fatty acid ester resulting from the condensation of the carboxy group of a fatty acid with the alcoholic hydroxy group of a fatty alcohol. kegg.compound:C01629|metacyc.compound:Wax-Esters|pubmed:12831900|pubmed:17750349|pubmed:18821728|pubmed:21247555|pubmed:21256496|pubmed:21961954|pubmed:22058425|pubmed:22685145|pubmed:22878160|pubmed:23087036|pubmed:23109878|pubmed:23196873|pubmed:23272127|wikipedia.en:Wax_ester Graph Wax esters|a wax ester Wax esters|a wax ester http://purl.obolibrary.org/obo/CHEBI_10036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10037 biolink:ChemicalEntity wedelolactone A member of the class of coumestans that is coumestan with hydroxy substituents as positions 1, 8 and 9 and a methoxy substituent at position 3. cas:524-12-9|kegg.compound:C10541|knapsack:C00002585|lipidmaps:LMPK12090046|pubmed:21315506|pubmed:21463376|pubmed:22198514|pubmed:22204306|pubmed:23076676|pubmed:23141142|reaxys:332398|wikipedia.en:Wedelolactone Graph 1,8,9-trihydroxy-3-methoxy-6H-[1]benzofuro[3,2-c]chromen-6-one|1,8,9-trihydroxy-3-methoxycoumestan|Wedelolactone 1,8,9-trihydroxy-3-methoxy-6H-[1]benzofuro[3,2-c]chromen-6-one 1,8,9-trihydroxy-3-methoxy-6H-[1]benzofuro[3,2-c]chromen-6-one|1,8,9-trihydroxy-3-methoxycoumestan|Wedelolactone http://purl.obolibrary.org/obo/CHEBI_10037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10043 biolink:ChemicalEntity wogonin A dihydroxy- and monomethoxy-flavone in which the hydroxy groups are positioned at C-5 and C-7 and the methoxy group is at C-8. cas:632-85-9|kegg.compound:C10197|knapsack:C00001111|lipidmaps:LMPK12111330|metacyc.compound:CPD-12727|pubmed:10724177|pubmed:11322923|pubmed:19438509|pubmed:22419433|pubmed:23371323|reaxys:287152|wikipedia.en:Wogonin Graph 5,7-Dihydroxy-8-methoxyflavone|5,7-dihydroxy-8-methoxy-2-phenyl-4H-1-benzopyran-4-one|5,7-dihydroxy-8-methoxy-2-phenyl-4H-chromen-4-one|Norwogonin 8-methyl ether|Wogonin 5,7-dihydroxy-8-methoxy-2-phenyl-4H-chromen-4-one 5,7-Dihydroxy-8-methoxyflavone|5,7-dihydroxy-8-methoxy-2-phenyl-4H-1-benzopyran-4-one|5,7-dihydroxy-8-methoxy-2-phenyl-4H-chromen-4-one|Norwogonin 8-methyl ether|Wogonin http://purl.obolibrary.org/obo/CHEBI_10043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10044 biolink:ChemicalEntity Wuweizisu C cas:61301-33-5|kegg.compound:C10893|knapsack:C00002634 Graph Schizandrin C|Wuweizisu C Schizandrin C|Wuweizisu C http://purl.obolibrary.org/obo/CHEBI_10044 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10049 biolink:ChemicalEntity XTP The xanthosine 5'-phosphate in which the 5'-phosphate is a triphosphate group. cas:6253-56-1|kegg.compound:C00700 Graph O(5')-(tetrahydroxytriphosphoryl)xanthosine|XTP|Xanthosine 5'-triphosphate|Xanthosine triphosphate|triphopsphoric acid 1-xanthosin-5'-yl ester|xanthosine 5'-(tetrahydrogen triphosphate) xanthosine 5'-(tetrahydrogen triphosphate) O(5')-(tetrahydroxytriphosphoryl)xanthosine|XTP|Xanthosine 5'-triphosphate|Xanthosine triphosphate|triphopsphoric acid 1-xanthosin-5'-yl ester|xanthosine 5'-(tetrahydrogen triphosphate) http://purl.obolibrary.org/obo/CHEBI_10049 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10055 biolink:ChemicalEntity Xamoterol cas:81801-12-9|drugcentral:2848|kegg.compound:C11775|kegg.drug:D06328 Graph Xamoterol|xamoterol fumarate|xamoterol hemifumarate Xamoterol|xamoterol fumarate|xamoterol hemifumarate http://purl.obolibrary.org/obo/CHEBI_10055 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10056 biolink:ChemicalEntity xanomeline beilstein:5480228|cas:131986-45-3|drugcentral:3652|kegg.compound:C11767|kegg.drug:D06330|patent:EP384288|patent:US5043345|patent:WO9429303 Graph 5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1-methyl-1,2,3,6-tetrahydropyridine|LY 246708|Xanomeline|xanomeline 5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1-methyl-1,2,3,6-tetrahydropyridine 5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1-methyl-1,2,3,6-tetrahydropyridine|LY 246708|Xanomeline|xanomeline http://purl.obolibrary.org/obo/CHEBI_10056 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10058 biolink:ChemicalEntity Xanthatin cas:26791-73-1|kegg.compound:C09601|knapsack:C00003394 Graph Xanthatin Xanthatin http://purl.obolibrary.org/obo/CHEBI_10058 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10082 biolink:ChemicalEntity Xylometazoline cas:526-36-3|drugcentral:3658|hmdb:HMDB0015640|kegg.compound:C07913|kegg.drug:D08684|lincs.smallmolecule:LSM-5262 Graph Xylometazoline|otrivine|rhinoxilin|xylometazoline HCl|xylometazoline hydrochloride Xylometazoline|otrivine|rhinoxilin|xylometazoline HCl|xylometazoline hydrochloride http://purl.obolibrary.org/obo/CHEBI_10082 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10089 biolink:ChemicalEntity Yangonin cas:500-62-9|hmdb:HMDB0034144|kegg.compound:C09980|knapsack:C00003024 Graph 4-Methoxy-6-[2-(4-methoxyphenyl)ethenyl]-2H-pyran-2-one|Yangonin 4-Methoxy-6-[2-(4-methoxyphenyl)ethenyl]-2H-pyran-2-one|Yangonin http://purl.obolibrary.org/obo/CHEBI_10089 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10093 biolink:ChemicalEntity yohimbine An indole alkaloid with α2-adrenoceptor antagonist activity. It is produced by Corynanthe johimbe and Rauwolfia serpentina. beilstein:4720812|beilstein:97276|cas:146-48-5|drugbank:DB01392|drugcentral:3659|kegg.compound:C09256|kegg.drug:D08685|knapsack:C00001789|lincs.smallmolecule:LSM-2779|vsdb:3010 Graph (+)-yohimbine|(16alpha,17alpha)-17-hydroxyyohimban-16-carboxylic acid methyl ester|17alpha-hydroxyyohimban-16alpha-carboxylic acid methyl ester|Johimbin|Quebrachin|Yohimbin|Yohimbine|aphrodine|corynine|methyl 17alpha-hydroxyyohimban-16alpha-carboxylate|quebrachine|yohimbic acid methyl ester methyl 17alpha-hydroxyyohimban-16alpha-carboxylate (+)-yohimbine|(16alpha,17alpha)-17-hydroxyyohimban-16-carboxylic acid methyl ester|17alpha-hydroxyyohimban-16alpha-carboxylic acid methyl ester|Johimbin|Quebrachin|Yohimbin|Yohimbine|aphrodine|corynine|methyl 17alpha-hydroxyyohimban-16alpha-carboxylate|quebrachine|yohimbic acid methyl ester http://purl.obolibrary.org/obo/CHEBI_10093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10100 biolink:ChemicalEntity zafirlukast cas:107753-78-6|drugbank:DB00549|drugcentral:2855|hmdb:HMDB0014689|kegg.compound:C07206|kegg.drug:D00411|lincs.smallmolecule:LSM-5792|pubmed:11888331|pubmed:19331987|pubmed:22159431|pubmed:22614107|pubmed:24258705|pubmed:25798389|pubmed:25834030|reaxys:3641829|wikipedia.en:Zafirlukast Graph 4-(5-cyclopentyloxycarbonylamino-1-methyl-1H-indol-3-ylmethyl)-3-methoxy-N-o-tolylsulfonylbenzamide|Accolate|cyclopentyl 3-(2-methoxy-4-((o-tolylsulfonyl)carbamoyl)benzyl)-1-methylindole-5-carbamate|cyclopentyl 3-[2-methoxy-4-(2-methylphenylsulfonylcarbamoyl)benzyl]-1-methyl-1H-indol-5-ylcarbamate|zafirlukast cyclopentyl 3-[2-methoxy-4-(2-methylphenylsulfonylcarbamoyl)benzyl]-1-methyl-1H-indol-5-ylcarbamate 4-(5-cyclopentyloxycarbonylamino-1-methyl-1H-indol-3-ylmethyl)-3-methoxy-N-o-tolylsulfonylbenzamide|Accolate|cyclopentyl 3-(2-methoxy-4-((o-tolylsulfonyl)carbamoyl)benzyl)-1-methylindole-5-carbamate|cyclopentyl 3-[2-methoxy-4-(2-methylphenylsulfonylcarbamoyl)benzyl]-1-methyl-1H-indol-5-ylcarbamate|zafirlukast http://purl.obolibrary.org/obo/CHEBI_10100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10101 biolink:ChemicalEntity zalcitabine A pyrimidine 2',3'-dideoxyribonucleoside compound having cytosine as the nucleobase. cas:7481-89-2|drugbank:DB00943|drugcentral:2856|hmdb:HMDB0015078|kegg.compound:C07207|kegg.drug:D00412|lincs.smallmolecule:LSM-5915|pubmed:11905988|pubmed:7727578|reaxys:654956|wikipedia.en:Zalcitabine Graph 2',3'-Dideoxycytidine|2',3'-dideoxycytidine|4-amino-1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2(1H)-one|DDC|DDCYD|Dideoxycytidine|zalcitabine 2',3'-dideoxycytidine 2',3'-Dideoxycytidine|2',3'-dideoxycytidine|4-amino-1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2(1H)-one|DDC|DDCYD|Dideoxycytidine|zalcitabine http://purl.obolibrary.org/obo/CHEBI_10101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10102 biolink:ChemicalEntity zaleplon A pyrazolo[1,5-a]pyrimidine having a nitrile group at position 3 and a 3-(N-ethylacetamido)phenyl substituent at the 7-position. beilstein:8153844|cas:151319-34-5|drugbank:DB00962|drugcentral:2857|kegg.compound:C07484|kegg.drug:D00530|lincs.smallmolecule:LSM-5971|patent:US4626538|wikipedia.en:Zaleplon Graph 3'-(3-Cyanopyrazolo(1,5-a)pyrimidin-7-yl)-N-ethylacetanilide|N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-ethylacetamide|zaleplon N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-ethylacetamide 3'-(3-Cyanopyrazolo(1,5-a)pyrimidin-7-yl)-N-ethylacetanilide|N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-ethylacetamide|zaleplon http://purl.obolibrary.org/obo/CHEBI_10102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10106 biolink:ChemicalEntity zearalenone A macrolide comprising a fourteen-membered lactone fused to 1,3-dihydroxybenzene; a potent estrogenic metabolite produced by some Giberella species. agr:IND608145868|cas:17924-92-4|kegg.compound:C09981|knapsack:C00003025|lipidmaps:LMPK04000016|pubmed:17339071|pubmed:18027362|pubmed:18221829|pubmed:18280460|pubmed:18692541|pubmed:20654554|pubmed:38449531|reaxys:4875541 Graph (-)-Zearalenone|(10S)-Zearalenone|(3S,11E)-14,16-dihydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione|(S)-(-)-Zearalenone|(S)-Zearalenone|(S-(E))-3,4,5,6,9,10-Hexahydro-14,16-dihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione|6-(10-Hydroxy-6-oxo-trans-1-undecenyl)-beta-resorcylic acid lactone|trans-Zearalenone|zearalenone (3S,11E)-14,16-dihydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione (-)-Zearalenone|(10S)-Zearalenone|(3S,11E)-14,16-dihydroxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione|(S)-(-)-Zearalenone|(S)-Zearalenone|(S-(E))-3,4,5,6,9,10-Hexahydro-14,16-dihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione|6-(10-Hydroxy-6-oxo-trans-1-undecenyl)-beta-resorcylic acid lactone|trans-Zearalenone|zearalenone http://purl.obolibrary.org/obo/CHEBI_10106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:101096 biolink:ChemicalEntity ethoxzolamide A sulfonamide that is 1,3-benzothiazole-2-sulfonamide which is substituted by an ethoxy group at position 6. A carbonic anhydrase inhibitor, it has been used in the treatment of glaucoma, and as a diuretic. cas:452-35-7|drugbank:DB00311|drugcentral:1089|kegg.drug:D02441|lincs.smallmolecule:LSM-18787|patent:GB795174|patent:US2868800|pubmed:10411484|pubmed:11087579|pubmed:11123998|pubmed:11906288|pubmed:12039560|pubmed:12617903|pubmed:12617904|pubmed:12643899|pubmed:12747790|pubmed:12747791|pubmed:14611846|pubmed:14640555|pubmed:14684333|pubmed:14971907|pubmed:15081039|pubmed:15139757|pubmed:15149691|pubmed:15454239|pubmed:15456265|pubmed:15501039|pubmed:15546717|pubmed:15603956|pubmed:15664816|pubmed:15686894|pubmed:15686895|pubmed:15686931|pubmed:15771455|pubmed:15837316|pubmed:15837325|pubmed:15905091|pubmed:15908201|pubmed:15908204|pubmed:16033263|pubmed:16039848|pubmed:16039853|pubmed:16165351|pubmed:16168653|pubmed:16302824|pubmed:16459077|pubmed:16539401|pubmed:16809036|pubmed:16942027|pubmed:17064072|pubmed:17125255|pubmed:17157501|pubmed:17228881|pubmed:17251018|pubmed:17276072|pubmed:17343373|pubmed:17475500|pubmed:17482815|pubmed:17540563|pubmed:17588751|pubmed:17646100|pubmed:17681760|pubmed:17826101|pubmed:18042384|pubmed:18242985|pubmed:18307288|pubmed:18359629|pubmed:18374572|pubmed:18513964|pubmed:2585443|pubmed:2810337|pubmed:6737424|wikipedia.en:Ethoxzolamide Graph 6-Ethoxy-benzothiazole-2-sulfonic acid amide|6-ethoxy-1,3-benzothiazole-2-sulfonamide|6-ethoxy-2-benzothiazolesulfonamide|6-ethoxybenzothiazole-2-sulfonamide|ETHOXZOLAMIDE|ethoxazolamide|ethoxyzolamide 6-ethoxy-1,3-benzothiazole-2-sulfonamide 6-Ethoxy-benzothiazole-2-sulfonic acid amide|6-ethoxy-1,3-benzothiazole-2-sulfonamide|6-ethoxy-2-benzothiazolesulfonamide|6-ethoxybenzothiazole-2-sulfonamide|ETHOXZOLAMIDE|ethoxazolamide|ethoxyzolamide http://purl.obolibrary.org/obo/CHEBI_101096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10110 biolink:ChemicalEntity zidovudine A pyrimidine 2',3'-dideoxyribonucleoside compound having a 3'-azido substituent and thymine as the nucleobase. beilstein:763034|cas:30516-87-1|drugbank:DB00495|drugcentral:2861|kegg.compound:C07210|kegg.drug:D00413|lincs.smallmolecule:LSM-5806|metacyc.compound:CPD-15110|patent:US4724232|pdb-ccd:AZZ|pubmed:19112024|pubmed:26859826|pubmed:29438107|pubmed:9203666|wikipedia.en:Zidovudine Graph 3'-azido-3'-deoxythymidine|AZT|Azidothymidine|Retrovir|Zidovudin|Zidovudinum|zidovudine 3'-azido-3'-deoxythymidine 3'-azido-3'-deoxythymidine|AZT|Azidothymidine|Retrovir|Zidovudin|Zidovudinum|zidovudine http://purl.obolibrary.org/obo/CHEBI_10110 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10112 biolink:ChemicalEntity zileuton A member of the class of 1-benzothiophenes that is 1-benzothiophene in which the hydrogen at position 2 is replaced by a 1-[carbamoyl(hydroxy)amino]ethyl group. A selective 5-lipoxygenase inhibitor, it inhibits the formation of leukotrienes LTB4, LTC4, LDT4, and LTE4. It is used for the management of chronic asthma. cas:111406-87-2|drugbank:DB00744|drugcentral:2862|kegg.drug:D00414|lincs.smallmolecule:LSM-5084|pubmed:19309543|pubmed:19645854|pubmed:20204486|pubmed:20436887|reaxys:4869674|wikipedia.en:Zileuton Graph (+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea|1-[1-(1-benzothien-2-yl)ethyl]-1-hydroxyurea|Leutrol|N-(1-Benzo(b)thien-2-ylethyl)-N-hydroxyurea|N-[1-(benzo[b]thiophen-2-yl)ethyl]-N-hydroxyurea|Zileuton|Zyflo|zileuton|zileutonum 1-[1-(1-benzothien-2-yl)ethyl]-1-hydroxyurea (+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea|1-[1-(1-benzothien-2-yl)ethyl]-1-hydroxyurea|Leutrol|N-(1-Benzo(b)thien-2-ylethyl)-N-hydroxyurea|N-[1-(benzo[b]thiophen-2-yl)ethyl]-N-hydroxyurea|Zileuton|Zyflo|zileuton|zileutonum http://purl.obolibrary.org/obo/CHEBI_10112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10115 biolink:ChemicalEntity zingiberene 2-Methylcyclohexa-1,3-diene in which a hydrogen at the 5 position is substituted (R configuration) by a 6-methyl-hept-5-en-2-yl group (S configuration). It is a sesquiterpene found in the dried rhizomes of Indonesian ginger, Zingiber officinale. beilstein:2554989|cas:495-60-3|kegg.compound:C09750|knapsack:C00003204 Graph (-)-alpha-zingiberene|(-)-zingiberene|(5R)-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]cyclohexa-1,3-diene|(5R)-5-[(1S)-1,5-dimethyl-4-hexenyl]-2-methyl-1,3-cyclohexadiene|Alpha-zingiberene|alpha-Zingiberene|alpha-zingiberene (5R)-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]cyclohexa-1,3-diene (-)-alpha-zingiberene|(-)-zingiberene|(5R)-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]cyclohexa-1,3-diene|(5R)-5-[(1S)-1,5-dimethyl-4-hexenyl]-2-methyl-1,3-cyclohexadiene|Alpha-zingiberene|alpha-Zingiberene|alpha-zingiberene http://purl.obolibrary.org/obo/CHEBI_10115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10119 biolink:ChemicalEntity ziprasidone A piperazine compound having 1,2-benzothiazol-3-yl- and 2-(6-chloro-1,3-dihydro-2-oxindol-5-yl)ethyl substituents attached to the nitrogen atoms. beilstein:6669199|cas:146939-27-7|drugbank:DB00246|drugcentral:2865|kegg.compound:C07568|kegg.drug:D08687|lincs.smallmolecule:LSM-5433|patent:EP281309|patent:US4831031|wikipedia.en:Ziprasidone Graph 5-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one|Ziprasidone|ziprasidona|ziprasidone|ziprasidonum 5-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one 5-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one|Ziprasidone|ziprasidona|ziprasidone|ziprasidonum http://purl.obolibrary.org/obo/CHEBI_10119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10124 biolink:ChemicalEntity zolmitriptan A member of the class of tryptamines that is N,N-dimethyltryptamine in which the hydrogen at position 5 of the indole ring has been replaced by a [(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl group. A serotonin 5-HT1 B and D receptor agonist, it is used for the treatment of migraine. beilstein:7415010|cas:139264-17-8|drugbank:DB00315|drugcentral:2869|kegg.compound:C07218|kegg.drug:D00415|lincs.smallmolecule:LSM-3208|wikipedia.en:Zolmitriptan Graph (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one|311C90|4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one|Zipton|Zomig|Zomigoro|Zominat|zolmitriptan|zolmitriptanum (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one|311C90|4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one|Zipton|Zomig|Zomigoro|Zominat|zolmitriptan|zolmitriptanum http://purl.obolibrary.org/obo/CHEBI_10124 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10125 biolink:ChemicalEntity zolpidem An imidazo[1,2-a]pyridine compound having a 4-tolyl group at the 2-position, an N,N-dimethylcarbamoylmethyl group at the 3-position and a methyl substituent at the 6-position. beilstein:4355785|cas:82626-48-0|drugbank:DB00425|drugcentral:2870|kegg.compound:C07219|kegg.drug:D08690|lincs.smallmolecule:LSM-5560|patent:EP50563|patent:US4382938|wikipedia.en:Zolpidem Graph N,N,6-Trimethyl-2-(4-methylphenyl)imidazo(1,2-a)pyridine-3-acetamide|N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide|zolpidem|zolpidemum N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide N,N,6-Trimethyl-2-(4-methylphenyl)imidazo(1,2-a)pyridine-3-acetamide|N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide|zolpidem|zolpidemum http://purl.obolibrary.org/obo/CHEBI_10125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10127 biolink:ChemicalEntity zonisamide A 1,2-benzoxazole compound having a sulfamoylmethyl substituent at the 3-position. beilstein:1077076|cas:68291-97-4|drugbank:DB00909|drugcentral:2872|kegg.compound:C07504|kegg.drug:D00538|lincs.smallmolecule:LSM-3062|patent:JP7877057|patent:US4172896|wikipedia.en:Zonisamide Graph 1,2-Benzisoxazole-3-methanesulfonamide|1-(1,2-benzisoxazol-3-yl)methanesulfonamide|3-(Sulfamoylmethyl)-1,2-benzisoxazole|Benzo[d]isoxazol-3-yl-methanesulfonamide|zonisamida|zonisamide|zonisamidum 1-(1,2-benzisoxazol-3-yl)methanesulfonamide 1,2-Benzisoxazole-3-methanesulfonamide|1-(1,2-benzisoxazol-3-yl)methanesulfonamide|3-(Sulfamoylmethyl)-1,2-benzisoxazole|Benzo[d]isoxazol-3-yl-methanesulfonamide|zonisamida|zonisamide|zonisamidum http://purl.obolibrary.org/obo/CHEBI_10127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:101278 biolink:ChemicalEntity diltiazem A 5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate in which both stereocentres have S configuration. A calcium-channel blocker and vasodilator, it is used as the hydrochloride in the management of angina pectoris and hypertension. cas:42399-41-7|drugbank:DB00343|drugcentral:897|hmdb:HMDB0014487|kegg.compound:C06958|kegg.drug:D07845|lincs.smallmolecule:LSM-2523|patent:DE1805714|patent:DE3415035|patent:US3562257|patent:US4552695|pubmed:11937779|pubmed:16651034|pubmed:19167257|pubmed:23687551|pubmed:24261918|pubmed:25122162|pubmed:8369596|reaxys:3573079|vsdb:1863|wikipedia.en:Diltiazem Graph (+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester|(2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate|(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate|(2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one|Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester|D-cis-diltiazem|d-cis-diltiazem|diltiazem|diltiazemum (2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate (+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester|(2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate|(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate|(2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one|Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester|D-cis-diltiazem|d-cis-diltiazem|diltiazem|diltiazemum http://purl.obolibrary.org/obo/CHEBI_101278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10136 biolink:ChemicalEntity gingerol A β-hydroxy ketone that is 5-hydroxydecan-3-one substituted by a 4-hydroxy-3-methoxyphenyl moiety at position 1; believed to inhibit adipogenesis. It is a constituent of fresh ginger. cas:23513-14-6|hmdb:HMDB0005783|kegg.compound:C10462|knapsack:C00002748|lincs.smallmolecule:LSM-2569|metacyc.compound:CPD-13494|pubmed:22719783|pubmed:23369342|pubmed:23437345|pubmed:23519881|reaxys:5287467|wikipedia.en:Gingerol Graph (+)-5-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-decanone|(5S)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)decan-3-one|(S)-(+)-[6]Gingerol|(S)-(6)-Gingerol|6-Gingerol|[6]-Gingerol (5S)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)decan-3-one (+)-5-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-decanone|(5S)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)decan-3-one|(S)-(+)-[6]Gingerol|(S)-(6)-Gingerol|6-Gingerol|[6]-Gingerol http://purl.obolibrary.org/obo/CHEBI_10136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:101381 biolink:ChemicalEntity aloxistatin An L-leucine derivative that is the amide obtained by formal condensation of the carboxy group of (2S,3S)-3-(ethoxycarbonyl)oxirane-2-carboxylic acid with the amino group of N-(3-methylbutyl)-L-leucinamide. cas:88321-09-9|pubmed:26388830|reaxys:5354546 Graph E 64d|E-64d|E64d|Ethyl (+)-(2S,3S)-2,3-epoxy-N-((S)-1-(isopentylcarbamoyl)-3-methylbutyl)succinamate|Loxistatin|aloxistatin|aloxistatina|aloxistatine|aloxistatinum|ethyl (2S,3S)-3-({(2S)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylate ethyl (2S,3S)-3-({(2S)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylate E 64d|E-64d|E64d|Ethyl (+)-(2S,3S)-2,3-epoxy-N-((S)-1-(isopentylcarbamoyl)-3-methylbutyl)succinamate|Loxistatin|aloxistatin|aloxistatina|aloxistatine|aloxistatinum|ethyl (2S,3S)-3-({(2S)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_101381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1015 biolink:ChemicalEntity 2-aminobenzenesulfonic acid An aminobenzenesulfonic acid carrying an amino group at position 2. cas:88-21-1|gmelin:241097|kegg.compound:C06333|pubmed:1368142|pubmed:16529512|pubmed:20638913|pubmed:23392615|pubmed:38215045|reaxys:1309204 Graph 1-aminobenzene-2-sulfonic acid|2-Aminobenzenesulfonic acid|2-aminobenzene-1-sulfonic acid|2-aminobenzenesulfonic acid|2-aminophenylsulfonic acid|2-sulfanilic acid|2-sulfoaniline|Orthanilic acid|aniline-2-sulfonic acid|aniline-o-sulfonic acid|aniline-o-sulphonic acid|o-Aminobenzenesulfonic acid|o-aminophenylsulfonic acid|o-sulfanilic acid 2-aminobenzenesulfonic acid 1-aminobenzene-2-sulfonic acid|2-Aminobenzenesulfonic acid|2-aminobenzene-1-sulfonic acid|2-aminobenzenesulfonic acid|2-aminophenylsulfonic acid|2-sulfanilic acid|2-sulfoaniline|Orthanilic acid|aniline-2-sulfonic acid|aniline-o-sulfonic acid|aniline-o-sulphonic acid|o-Aminobenzenesulfonic acid|o-aminophenylsulfonic acid|o-sulfanilic acid http://purl.obolibrary.org/obo/CHEBI_1015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:101854 biolink:ChemicalEntity talarozole A racemate comprising equimolar amounts of (R)- and (S)-talarozole. It is used for the treatment of keratinization disorders, psoriasis and acne. cas:201410-53-9|kegg.drug:D09385|pubmed:19120344|pubmed:26921399|reaxys:11737106|wikipedia.en:Talarozole Graph (+-)-talarozole|(RS)-talarozole|N-(4-((1RS)-2-Ethyl-1-(1H-1,2,4-triazol-1-yl)butyl)phenyl)benzothiazol-2-amine|N-(4-(2-Ethyl-1-(1H-1,2,4-triazol-1-yl)butyl)phenyl)-2-benzothiazolamine|R 115866|R115866|Rambazole|rac-N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine|talarozole rac-N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine (+-)-talarozole|(RS)-talarozole|N-(4-((1RS)-2-Ethyl-1-(1H-1,2,4-triazol-1-yl)butyl)phenyl)benzothiazol-2-amine|N-(4-(2-Ethyl-1-(1H-1,2,4-triazol-1-yl)butyl)phenyl)-2-benzothiazolamine|R 115866|R115866|Rambazole|rac-N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine|talarozole http://purl.obolibrary.org/obo/CHEBI_101854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102029 biolink:ChemicalEntity sorbinil An azaspiro compound having a monofluoro-substituted chromane skeleton spiro-linked to an imidazolidinedione ring. cas:68367-52-2|drugbank:DB02712|patent:DE2821966|patent:US4130714|pdb-ccd:SBI|pubmed:10875546|pubmed:10933817|pubmed:11048957|pubmed:11900277|pubmed:18772236|pubmed:19821053|pubmed:20138035|pubmed:20308528|pubmed:20354121|pubmed:21129963|pubmed:29438107|pubmed:7564101|pubmed:7591626|pubmed:8159110|pubmed:8692029|pubmed:9007520|pubmed:9088040|pubmed:9195881|pubmed:9349546|reaxys:4297401|wikipedia.en:Sorbinil Graph (4S)-6-fluoro-2,3-dihydro-2'H,5'H-spiro[chromene-4,4'-imidazolidine]-2',5'-dione|(S)-6-Fluorospiro(chroman-4,4'-imidazolidine)-2',5'-dione|sorbinil|sorbinilo|sorbinilum|sorbinol (4S)-6-fluoro-2,3-dihydro-2'H,5'H-spiro[chromene-4,4'-imidazolidine]-2',5'-dione (4S)-6-fluoro-2,3-dihydro-2'H,5'H-spiro[chromene-4,4'-imidazolidine]-2',5'-dione|(S)-6-Fluorospiro(chroman-4,4'-imidazolidine)-2',5'-dione|sorbinil|sorbinilo|sorbinilum|sorbinol http://purl.obolibrary.org/obo/CHEBI_102029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102030 biolink:ChemicalEntity (R)-talarozole An N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine that is the (R)-enantiomer of talarozole. The racemate is used for the treatment of keratinization disorders, psoriasis and acne. cas:870093-23-5|reaxys:10701600 Graph N-{4-[(1R)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[(1R)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[(1R)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine http://purl.obolibrary.org/obo/CHEBI_102030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10213 biolink:ChemicalEntity alpha-amyrin A pentacyclic triterpenoid that is ursane which contains a double bond between positions 12 and 13 and in which the hydrogen at the 3β position is substituted by a hydroxy group. cas:638-95-9|kegg.compound:C08615|knapsack:C00003737|lipidmaps:LMPR0106170001|metacyc.compound:CPD-8250|pubmed:10848960|pubmed:15626726|pubmed:15659316|pubmed:18129592|pubmed:19488928|pubmed:21575133|reaxys:1916550 Graph (3beta)-urs-12-en-3-ol|4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol|5alpha-urs-12-en-3beta-ol|Alpha-amyrin|alpha-Amyrin|alpha-amyrenol|alpha-amyrine|urs-12-ene-3beta-ol|viminalol (3beta)-urs-12-en-3-ol (3beta)-urs-12-en-3-ol|4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol|5alpha-urs-12-en-3beta-ol|Alpha-amyrin|alpha-Amyrin|alpha-amyrenol|alpha-amyrine|urs-12-ene-3beta-ol|viminalol http://purl.obolibrary.org/obo/CHEBI_10213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102131 biolink:ChemicalEntity (S)-talarozole An N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine that is the (S)-enantiomer of talarozole. The racemate is used for the treatment of keratinization disorders, psoriasis and acne. reaxys:18314092 Graph N-{4-[(1S)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[(1S)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[(1S)-2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine http://purl.obolibrary.org/obo/CHEBI_102131 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102166 biolink:ChemicalEntity thiopental A barbiturate, the structure of which is that of 2-thiobarbituric acid substituted at C-5 by ethyl and sec-pentyl groups. beilstein:209361|cas:76-75-5|drugbank:DB00599|drugcentral:2633|kegg.compound:C07521|pubmed:10666006|pubmed:10841799|pubmed:15857133|pubmed:16166909|pubmed:16897573|pubmed:18484074|pubmed:20488867|pubmed:2215478|pubmed:23305916|pubmed:23422796|pubmed:23490495|pubmed:23542731|pubmed:23644730|pubmed:23879844|pubmed:3654008|pubmed:6864729|pubmed:9171876|pubmed:9699097|reaxys:209361 Graph (+-)-thiopental|2-Thio-5-ethyl-5-sec-pentylbarbituric acid|5-Ethyl-5-(1-methyl-butyl)-2-thioxo-dihydro-pyrimidine-4,6-dione|5-ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|Penthiobarbital|Pentothiobarbital|Thiopental|Thiopentobarbital|Thiopentobarbitone|Thiopentobarbituric acid|Thiopentone 5-ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione (+-)-thiopental|2-Thio-5-ethyl-5-sec-pentylbarbituric acid|5-Ethyl-5-(1-methyl-butyl)-2-thioxo-dihydro-pyrimidine-4,6-dione|5-ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|Penthiobarbital|Pentothiobarbital|Thiopental|Thiopentobarbital|Thiopentobarbitone|Thiopentobarbituric acid|Thiopentone http://purl.obolibrary.org/obo/CHEBI_102166 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102167 biolink:ChemicalEntity N-{4-[2-ethyl-1-(1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine A member of the class of benzothiazoles that is 2-amino-1,3-benzothiazole in which one of the amino hydrogens is replaced by a 4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl group. Graph N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine N-{4-[2-ethyl-1-(1H-1,2,4-triazol-1-yl)butyl]phenyl}-1,3-benzothiazol-2-amine http://purl.obolibrary.org/obo/CHEBI_102167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10219 biolink:ChemicalEntity alpha-Chaconine cas:20562-03-2|kegg.compound:C10796|knapsack:C00002242 Graph alpha-Chaconine alpha-Chaconine http://purl.obolibrary.org/obo/CHEBI_10219 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10221 biolink:ChemicalEntity alpha-copaene A sesquiterpene that is tricyclo[4.4.0.02,7]dec-3-ene bearing an isopropyl substituent at position 8 and two methyl substituents at positions 1 and 3 (the 1S,6S,7S,8S-diastereomer). cas:3856-25-5|kegg.compound:C09639|knapsack:C00003118|metacyc.compound:CPD-8234|reaxys:8910321|wikipedia.en:Copaene Graph (1S,6S,7S,8S)-1,3-dimethyl-8-(propan-2-yl)-tricyclo[4.4.0.0(2,7)]dec-3-ene|(1S,6S,7S,8S)-8-isopropyl-1,3-dimethyltricyclo[4.4.0.0(2,7)]dec-3-ene|8-Isopropyl-1,3-dimethyltricyclo(4.4.0.02,7)dec-3-ene|Alpha-copaene|Copaene|alpha-Copaene (1S,6S,7S,8S)-1,3-dimethyl-8-(propan-2-yl)-tricyclo[4.4.0.0(2,7)]dec-3-ene (1S,6S,7S,8S)-1,3-dimethyl-8-(propan-2-yl)-tricyclo[4.4.0.0(2,7)]dec-3-ene|(1S,6S,7S,8S)-8-isopropyl-1,3-dimethyltricyclo[4.4.0.0(2,7)]dec-3-ene|8-Isopropyl-1,3-dimethyltricyclo(4.4.0.02,7)dec-3-ene|Alpha-copaene|Copaene|alpha-Copaene http://purl.obolibrary.org/obo/CHEBI_10221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102216 biolink:ChemicalEntity methohexital A barbiturate, the structure of which is that of barbituric acid substituted at N-1 by a methyl group and at C-5 by allyl and 1-methylpent-2-ynyl groups. cas:151-83-7|drugbank:DB00474|drugcentral:1748|kegg.compound:C07844|kegg.drug:D04985|pubmed:13919899|pubmed:20045848|pubmed:22330701|pubmed:22914630|pubmed:22914634|pubmed:23164727|pubmed:23399487|pubmed:23422530|pubmed:23813116|pubmed:3654008|pubmed:6864729|reaxys:89964|wikipedia.en:Methohexital Graph (+-)-5-allyl-1-methyl-5-(1-methyl-2-pentynyl)barbituric acid|1-methyl-5-(1-methylpent-2-yn-1-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione|5-Allyl-1-methyl-5-(1-methyl-pent-2-ynyl)-pyrimidine-2,4,6-trione|5-Allyl-5-(3-hexyn-2-yl)-1-methylbarbituric acid|5-allyl-1-methyl-5-(1-methyl-2-pentynyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|Methohexital|Methohexitalum|Methohexitone|Metohexital|alpha-DL-1-methyl-5-allyl-5-(1'-methylpentyn-2-yl)barbituric acid 1-methyl-5-(1-methylpent-2-yn-1-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione (+-)-5-allyl-1-methyl-5-(1-methyl-2-pentynyl)barbituric acid|1-methyl-5-(1-methylpent-2-yn-1-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione|5-Allyl-1-methyl-5-(1-methyl-pent-2-ynyl)-pyrimidine-2,4,6-trione|5-Allyl-5-(3-hexyn-2-yl)-1-methylbarbituric acid|5-allyl-1-methyl-5-(1-methyl-2-pentynyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|Methohexital|Methohexitalum|Methohexitone|Metohexital|alpha-DL-1-methyl-5-allyl-5-(1'-methylpentyn-2-yl)barbituric acid http://purl.obolibrary.org/obo/CHEBI_102216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:102484 biolink:ChemicalEntity sulfisoxazole A sulfonamide antibacterial with an oxazole substituent. It has antibiotic activity against a wide range of gram-negative and gram-positive organisms. beilstein:263871|cas:127-69-5|drugbank:DB00263|drugcentral:2529|gmelin:864477|kegg.compound:C07318|kegg.drug:D00450|lincs.smallmolecule:LSM-3120|patent:US2430094|pubmed:1861917|pubmed:4960234|pubmed:7356572|wikipedia.en:Sulfisoxazole Graph 3,4-Dimethyl-5-sulfanilamidoisoxazole|3,4-Dimethyl-5-sulfonamidoisoxazole|3,4-Dimethyl-5-sulphanilamidoisoxazole|3,4-Dimethyl-5-sulphonamidoisoxazole|3,4-Dimethylisoxazole-5-sulfanilamide|3,4-Dimethylisoxazole-5-sulphanilamide|4-Amino-N-(3,4-dimethyl-5-isoxazolyl)benzenesulfonamide|4-Amino-N-(3,4-dimethyl-5-isoxazolyl)benzenesulphonamide|4-amino-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide|5-(4-Aminophenylsulfonamido)-3,4-dimethylisoxazole|5-(p-Aminobenzenesulfonamido)-3,4-dimethylisoxazole|5-(p-Aminobenzenesulphonamido)-3,4-dimethylisoxazole|5-Sulfanilamido-3,4-dimethylisoxazole|5-Sulphanilamido-3,4-dimethyl-isoxazole|N'-(3,4)Dimethylisoxazol-5-yl-sulphanilamide|N(1)-(3,4-dimethyl-5-isoxazolyl)sulfanilamide|N(1)-(3,4-dimethyl-5-isoxazolyl)sulphanilamide|Sulfadimethylisoxazole|Sulfafurazol|Sulfaisoxazole|Sulfasoxazole|Sulfisonazole|Sulfisoxasole|Sulfisoxazol|Sulfofurazole|Sulphadimethylisoxazole|Sulphafurazol|Sulphafurazole|Sulphaisoxazole|Sulphisoxazol|Sulphofurazole|sulfafurazole|sulfafurazolum 4-amino-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide 3,4-Dimethyl-5-sulfanilamidoisoxazole|3,4-Dimethyl-5-sulfonamidoisoxazole|3,4-Dimethyl-5-sulphanilamidoisoxazole|3,4-Dimethyl-5-sulphonamidoisoxazole|3,4-Dimethylisoxazole-5-sulfanilamide|3,4-Dimethylisoxazole-5-sulphanilamide|4-Amino-N-(3,4-dimethyl-5-isoxazolyl)benzenesulfonamide|4-Amino-N-(3,4-dimethyl-5-isoxazolyl)benzenesulphonamide|4-amino-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide|5-(4-Aminophenylsulfonamido)-3,4-dimethylisoxazole|5-(p-Aminobenzenesulfonamido)-3,4-dimethylisoxazole|5-(p-Aminobenzenesulphonamido)-3,4-dimethylisoxazole|5-Sulfanilamido-3,4-dimethylisoxazole|5-Sulphanilamido-3,4-dimethyl-isoxazole|N'-(3,4)Dimethylisoxazol-5-yl-sulphanilamide|N(1)-(3,4-dimethyl-5-isoxazolyl)sulfanilamide|N(1)-(3,4-dimethyl-5-isoxazolyl)sulphanilamide|Sulfadimethylisoxazole|Sulfafurazol|Sulfaisoxazole|Sulfasoxazole|Sulfisonazole|Sulfisoxasole|Sulfisoxazol|Sulfofurazole|Sulphadimethylisoxazole|Sulphafurazol|Sulphafurazole|Sulphaisoxazole|Sulphisoxazol|Sulphofurazole|sulfafurazole|sulfafurazolum http://purl.obolibrary.org/obo/CHEBI_102484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10280 biolink:ChemicalEntity (E,E)-alpha-farnesene beilstein:1840984|cas:502-61-4|kegg.compound:C09665|knapsack:C00003130 Graph (3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene|(3E,6E)-alpha-farnesene|(E,E)-alpha-farnesene (3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene (3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene|(3E,6E)-alpha-farnesene|(E,E)-alpha-farnesene http://purl.obolibrary.org/obo/CHEBI_10280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10283 biolink:ChemicalEntity 2-hydroxy fatty acid Any fatty acid with a hydroxy functional group in the α- or 2-position. kegg.compound:C05102|pubmed:6423633|pubmed:9826358 Graph 2-OH fatty acid|2-OH fatty acids|2-hydroxy fatty acids|alpha-Hydroxy fatty acid|alpha-OH fatty acid|alpha-OH fatty acids|alpha-hydroxy fatty acid|alpha-hydroxy fatty acids 2-OH fatty acid|2-OH fatty acids|2-hydroxy fatty acids|alpha-Hydroxy fatty acid|alpha-OH fatty acid|alpha-OH fatty acids|alpha-hydroxy fatty acid|alpha-hydroxy fatty acids http://purl.obolibrary.org/obo/CHEBI_10283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10319 biolink:ChemicalEntity 1-naphthol A naphthol carrying a hydroxy group at position 1. cas:90-15-3|gmelin:69192|hmdb:HMDB0012138|kegg.compound:C11714|metacyc.compound:NAPHTHOL|pdb-ccd:1NP|pubmed:16721410|pubmed:18966375|pubmed:22740618|reaxys:1817321|wikipedia.en:1-Naphthol Graph 1-Naphthol|1-hydroxynaphthalene|1-naphthalenol|1-naphthol|alpha-Naphthol|alpha-hydroxynaphthalene|alpha-naphthol|naphthalen-1-ol naphthalen-1-ol 1-Naphthol|1-hydroxynaphthalene|1-naphthalenol|1-naphthol|alpha-Naphthol|alpha-hydroxynaphthalene|alpha-naphthol|naphthalen-1-ol http://purl.obolibrary.org/obo/CHEBI_10319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10329 biolink:ChemicalEntity alpha-ribazole beilstein:91101|cas:132-13-8|kegg.compound:C05775 Graph 5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole|N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole|alpha-Ribazole|alpha-ribazole 5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole 5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole|N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole|alpha-Ribazole|alpha-ribazole http://purl.obolibrary.org/obo/CHEBI_10329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10334 biolink:ChemicalEntity alpha-terpinene One of three isomeric monoterpenes differing in the positions of their two double bonds (β- and γ-terpinene being the others). In α-terpinene the double bonds are at the 1- and 3-positions of the p-menthane skeleton. bpdb:2014|cas:99-86-5|hmdb:HMDB0036995|kegg.compound:C09898|knapsack:C00003060|lipidmaps:LMPR0102090026|patent:WO2010099985|pubmed:15621337|pubmed:16780354|pubmed:20387784|pubmed:22164802|pubmed:23833899|pubmed:24020201|pubmed:8655097|reaxys:1853379|wikipedia.en:Terpinene Graph 1-Methyl-4-(1-methylethyl)-1,3-cyclohexadiene|1-isopropyl-4-methyl-1,3-cyclohexadiene|1-methyl-4-(propan-2-yl)cyclohexa-1,3-diene|Alpha-terpinene|Terpilene|alpha-Terpinene|p-Mentha-1,3-diene 1-methyl-4-(propan-2-yl)cyclohexa-1,3-diene 1-Methyl-4-(1-methylethyl)-1,3-cyclohexadiene|1-isopropyl-4-methyl-1,3-cyclohexadiene|1-methyl-4-(propan-2-yl)cyclohexa-1,3-diene|Alpha-terpinene|Terpilene|alpha-Terpinene|p-Mentha-1,3-diene http://purl.obolibrary.org/obo/CHEBI_10334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10352 biolink:ChemicalEntity beta-amyrin A pentacyclic triterpenoid that is oleanane substituted at the 3β-position by a hydroxy group and containing a double bond between positions 12 and 13. It is one of the most commonly occurring triterpenoids in higher plants. cas:559-70-6|kegg.compound:C08616|knapsack:C00003738|lipidmaps:LMPR0106150015|metacyc.compound:CPD-6948|pubmed:16478469|pubmed:17803686|pubmed:21046981|pubmed:24079177|pubmed:24960408|pubmed:25026352|pubmed:25115087|pubmed:5639923|pubmed:6875511|reaxys:2063468 Graph (3beta)-olean-12-en-3-ol|3beta-hydroxyolean-12-ene|Beta-amyrin|amyrin|beta-Amyrenol|beta-Amyrin|olean-12-en-3beta-ol olean-12-en-3beta-ol (3beta)-olean-12-en-3-ol|3beta-hydroxyolean-12-ene|Beta-amyrin|amyrin|beta-Amyrenol|beta-Amyrin|olean-12-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_10352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10357 biolink:ChemicalEntity (-)-beta-caryophyllene A β-caryophyllene in which the stereocentre adjacent to the exocyclic double bond has S configuration while the remaining stereocentre has R configuration. It is the most commonly occurring form of β-caryophyllene, occurring in many essential oils, particularly oil of cloves. cas:87-44-5|kegg.compound:C09629|knapsack:C00003110|metacyc.compound:CPD-8230|pubmed:12409018|pubmed:18296628|pubmed:18574142|pubmed:20015227|pubmed:20398787|pubmed:20433083|pubmed:21366052|pubmed:21425686|pubmed:21941920|pubmed:27871898|pubmed:30281175|reaxys:2044564|wikipedia.en:Caryophyllene Graph (-)-(E)-beta-caryophyllene|(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene|(E)-beta-caryophyllene|Caryophyllene|beta-Caryophyllene|caryophyllene|trans-(1R,9S)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene|trans-caryophyllene (1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene (-)-(E)-beta-caryophyllene|(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene|(E)-beta-caryophyllene|Caryophyllene|beta-Caryophyllene|caryophyllene|trans-(1R,9S)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene|trans-caryophyllene http://purl.obolibrary.org/obo/CHEBI_10357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10359 biolink:ChemicalEntity (-)-beta-chamigrene The (6R)-enantiomer of β-chamigrene. cas:18431-82-8|kegg.compound:C09637|knapsack:C00003116|reaxys:2326950 Graph (-)-chamigrene|(6R)-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-2-ene|(R)-beta-chamigrene|beta-Chamigrene (6R)-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-2-ene (-)-chamigrene|(6R)-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-2-ene|(R)-beta-chamigrene|beta-Chamigrene http://purl.obolibrary.org/obo/CHEBI_10359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10365 biolink:ChemicalEntity (5S)-3-acetyl-4-hydroxy-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}-1,5-dihydro-2H-pyrrol-2-one cas:31008-70-5|kegg.compound:C02899 Graph (5S)-3-acetyl-4-hydroxy-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}-1,5-dihydro-2H-pyrrol-2-one|(S)-3-acetyl-1,5-dihydro-4-hydroxy-5-((4-(3-methyl-2-butenyl)-1H-indol-3-yl)methyl)-2H-pyrrol-2-one|beta-Cyclopiazonate|beta-Cyclopiazonic acid|dehydrodisecocyclopiazonic acid (5S)-3-acetyl-4-hydroxy-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}-1,5-dihydro-2H-pyrrol-2-one (5S)-3-acetyl-4-hydroxy-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}-1,5-dihydro-2H-pyrrol-2-one|(S)-3-acetyl-1,5-dihydro-4-hydroxy-5-((4-(3-methyl-2-butenyl)-1H-indol-3-yl)methyl)-2H-pyrrol-2-one|beta-Cyclopiazonate|beta-Cyclopiazonic acid|dehydrodisecocyclopiazonic acid http://purl.obolibrary.org/obo/CHEBI_10365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:103854 biolink:ChemicalEntity N-[5-(4,5-dihydro-1H-imidazol-2-yl)-2-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl]methanesulfonamide lincs.smallmolecule:LSM-15205 Graph http://purl.obolibrary.org/obo/CHEBI_103854 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:104011 biolink:ChemicalEntity p-aminohippuric acid An N-acylglycine that is the 4-amino derivative of hippuric acid; used as a diagnostic agent in the measurement of renal plasma flow. beilstein:1216376|cas:61-78-9|drugbank:DB00345|drugcentral:165|gmelin:848144|hmdb:HMDB0001867|kegg.drug:D06890|lincs.smallmolecule:LSM-5739|pubmed:11060218|pubmed:11078692|pubmed:11443229|pubmed:12523660|pubmed:12552490|pubmed:17190852|pubmed:20439170|pubmed:22036005|pubmed:22273603|pubmed:22406909|pubmed:22460716|pubmed:2496229|reaxys:1213676|wikipedia.en:Aminohippuric_Acid Graph 4-aminohippuric acid|Aminohippuric acid|N-(4-aminobenzoyl)glycine|N-(p-Aminobenzoyl)aminoacetic acid|N-(p-Aminobenzoyl)glycine|N-(para-aminobenzoyl)glycine|Paha|p-aminohippurate|para-Aminohippuric acid|paraaminohippuric acid N-(4-aminobenzoyl)glycine 4-aminohippuric acid|Aminohippuric acid|N-(4-aminobenzoyl)glycine|N-(p-Aminobenzoyl)aminoacetic acid|N-(p-Aminobenzoyl)glycine|N-(para-aminobenzoyl)glycine|Paha|p-aminohippurate|para-Aminohippuric acid|paraaminohippuric acid http://purl.obolibrary.org/obo/CHEBI_104011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:104023 biolink:ChemicalEntity 2-[3-(2-quinolinylmethoxy)anilino]benzoic acid lincs.smallmolecule:LSM-15379 Graph http://purl.obolibrary.org/obo/CHEBI_104023 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10415 biolink:ChemicalEntity beta-endorphin A polypeptide consisting of 31 amino acid residues in the sequence Tyr-Gly-Gly-Phe-Met-Thr-Ser-Glu-Lys-Ser-Gln-Thr-Pro-Leu-Val-Thr-Leu-Phe-Lys-Asn-Ala-Ile-Ile-Lys-Asn-Ala-Tyr-Lys-Lys-Gly-Glu. It is an endogenous opioid peptide neurotransmitter found in the neurons of both the central and peripheral nervous system and results from processing of the precursor protein proopiomelanocortin (POMC). cas:60617-12-1|kegg.compound:C02210|pubmed:21044625|pubmed:21187108|pubmed:21775068|pubmed:22014186|pubmed:22080997|pubmed:22101356|pubmed:22574561|pubmed:22578170|pubmed:22626645|wikipedia.en:Beta-endorphin Graph L-tyrosylglycylglycyl-L-phenylalanyl-L-methionyl-L-threonyl-L-seryl-L-glutaminyl-L-lysyl-L-seryl-L-glutaminyl-L-threonyl-L-prolyl-L-leucyl-L-valyl-L-threonyl-L-leucyl-L-phenylalanyl-L-lysyl-L-asparaginyl-L-alanyl-L-isoleucyl-L-isoleucyl-L-lysyl-L-asparaginyl-L-alanyl-L-tyrosyl-L-lysyl-L-lysylglycyl-L-glutamine|Tyr-Gly-Gly-Phe-Met-Thr-Ser-Glu-Lys-Ser-Gln-Thr-Pro-Leu-Val-Thr-Leu-Phe-Lys-Asn-Ala-Ile-Ile-Lys-Asn-Ala-Tyr-Lys-Lys-Gly-Glu|beta-Endorphin L-tyrosylglycylglycyl-L-phenylalanyl-L-methionyl-L-threonyl-L-seryl-L-glutaminyl-L-lysyl-L-seryl-L-glutaminyl-L-threonyl-L-prolyl-L-leucyl-L-valyl-L-threonyl-L-leucyl-L-phenylalanyl-L-lysyl-L-asparaginyl-L-alanyl-L-isoleucyl-L-isoleucyl-L-lysyl-L-asparaginyl-L-alanyl-L-tyrosyl-L-lysyl-L-lysylglycyl-L-glutamine L-tyrosylglycylglycyl-L-phenylalanyl-L-methionyl-L-threonyl-L-seryl-L-glutaminyl-L-lysyl-L-seryl-L-glutaminyl-L-threonyl-L-prolyl-L-leucyl-L-valyl-L-threonyl-L-leucyl-L-phenylalanyl-L-lysyl-L-asparaginyl-L-alanyl-L-isoleucyl-L-isoleucyl-L-lysyl-L-asparaginyl-L-alanyl-L-tyrosyl-L-lysyl-L-lysylglycyl-L-glutamine|Tyr-Gly-Gly-Phe-Met-Thr-Ser-Glu-Lys-Ser-Gln-Thr-Pro-Leu-Val-Thr-Leu-Phe-Lys-Asn-Ala-Ile-Ile-Lys-Asn-Ala-Tyr-Lys-Lys-Gly-Glu|beta-Endorphin http://purl.obolibrary.org/obo/CHEBI_10415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10417 biolink:ChemicalEntity beta-eudesmol A carbobicyclic compound that is trans-decalin substituted at positions 2, 4a, and 8 by 2-hydroxypropan-2-yl, methyl and methylidene groups, respectively (the 2R,4aR,8aS-diastereoisomer). cas:473-15-4|kegg.compound:C09664|knapsack:C00000164|metacyc.compound:CPD-11432|pubmed:18242187|reaxys:5735560 Graph (2R,4aR,8aS)-decahydro-8-methylene-alpha,alpha,4a-trimethyl-2-naphthylmethanol|2-[(2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl]propan-2-ol|Beta-eudesmol|beta-Eudesmol|beta-selinenol|eudesm-4(14)-en-11-ol 2-[(2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl]propan-2-ol|eudesm-4(14)-en-11-ol (2R,4aR,8aS)-decahydro-8-methylene-alpha,alpha,4a-trimethyl-2-naphthylmethanol|2-[(2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl]propan-2-ol|Beta-eudesmol|beta-Eudesmol|beta-selinenol|eudesm-4(14)-en-11-ol http://purl.obolibrary.org/obo/CHEBI_10417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10429 biolink:ChemicalEntity beta-lapachone A benzochromenone that is 3,4-dihydro-2H-benzo[h]chromene-5,6-dione substituted by geminal methyl groups at position 2. Isolated from Tabebuia avellanedae, it exhibits antineoplastic and anti-inflammatory activities. cas:4707-32-8|kegg.compound:C10367|knapsack:C00002836|pubmed:16822200|pubmed:16891723|pubmed:18180274|pubmed:18227145|pubmed:18424157|pubmed:18706870|pubmed:19051226|pubmed:22560628|pubmed:22736525|pubmed:23010281|pubmed:23071729|pubmed:23865001|pubmed:25448047|pubmed:26328485|pubmed:3652040|pubmed:6704108|reaxys:181499 Graph 2,2-dimethyl-3,4-dihydro-2H-benzo[h]chromene-5,6-dione|3,4-dihydro-2,2-dimethyl-2H-naphtho(1,2-b)pyran-5,6-dione|ARQ 501|beta-Lapachone|beta-lap 2,2-dimethyl-3,4-dihydro-2H-benzo[h]chromene-5,6-dione 2,2-dimethyl-3,4-dihydro-2H-benzo[h]chromene-5,6-dione|3,4-dihydro-2,2-dimethyl-2H-naphtho(1,2-b)pyran-5,6-dione|ARQ 501|beta-Lapachone|beta-lap http://purl.obolibrary.org/obo/CHEBI_10429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10432 biolink:ChemicalEntity 2-naphthol A naphthol carrying a hydroxy group at position 2. cas:135-19-3|drugcentral:3370|foodb.food:FDB000877|gmelin:27395|hmdb:HMDB0012322|kegg.compound:C11713|metacyc.compound:CPD-8131|pdb-ccd:03V|pubmed:13386410|pubmed:14751800|pubmed:18515997|pubmed:18856458|pubmed:20260560|pubmed:22069470|pubmed:22740618|pubmed:23344974|pubmed:29987264|pubmed:30572877|pubmed:30828382|pubmed:32206945|pubmed:33862438|pubmed:34033865|reaxys:742134|wikipedia.en:2-Naphthol Graph 2-Naftol|2-Naphthol|2-hydroxynaphthalene|2-naftolo|2-naphthalenol|2-naphthol|2-naphtol|Antioxygene BN|Azogen Developer A|C.I. Azoic Coupling Component 1|C.I. Developer 5|Developer A|Developer AMS|Developer BN|Isonaphthol|beta-Naftol|beta-Naphthol|beta-Naphtol|beta-hydroxynaphthalene|beta-naftolo|beta-naphthol|beta-naphthyl alcohol|beta-naphthyl hydroxide|naphthalen-2-ol naphthalen-2-ol 2-Naftol|2-Naphthol|2-hydroxynaphthalene|2-naftolo|2-naphthalenol|2-naphthol|2-naphtol|Antioxygene BN|Azogen Developer A|C.I. Azoic Coupling Component 1|C.I. Developer 5|Developer A|Developer AMS|Developer BN|Isonaphthol|beta-Naftol|beta-Naphthol|beta-Naphtol|beta-hydroxynaphthalene|beta-naftolo|beta-naphthol|beta-naphthyl alcohol|beta-naphthyl hydroxide|naphthalen-2-ol http://purl.obolibrary.org/obo/CHEBI_10432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10436 biolink:ChemicalEntity beta-ocimene The trans-stereoisomer of ocimene. Graph trans-3,7-dimethylocta-1,3,6-triene trans-3,7-dimethylocta-1,3,6-triene trans-3,7-dimethylocta-1,3,6-triene http://purl.obolibrary.org/obo/CHEBI_10436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10545 biolink:ChemicalEntity electron Elementary particle not affected by the strong force having a spin ½, a negative elementary charge and a rest mass of 0.000548579903(13) u, or 0.51099906(15) MeV. kegg.compound:C05359|pubmed:21614077|wikipedia.en:Electron Graph Elektron|beta|beta(-)|beta-particle|e|e(-)|e-|electron|negatron electron Elektron|beta|beta(-)|beta-particle|e|e(-)|e-|electron|negatron http://purl.obolibrary.org/obo/CHEBI_10545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10577 biolink:ChemicalEntity gamma-terpinene One of three isomeric monoterpenes differing in the positions of their two double bonds (α- and β-terpinene being the others). In γ-terpinene the double bonds are at the 1- and 4-positions of the p-menthane skeleton. bpdb:2013|cas:99-85-4|hmdb:HMDB0005806|kegg.compound:C09900|knapsack:C00003061|lipidmaps:LMPR0102090027|metacyc.compound:CPD-8736|pubmed:12696969|pubmed:17314143|pubmed:22284503|pubmed:24066512|pubmed:24421258|reaxys:2038347|wikipedia.en:Terpinene Graph 1,4-p-Menthadiene|1-Isopropyl-4-methyl-1,4-cyclohexadiene|1-Isopropyl-4-methylcyclohexa-1,4-diene|1-Methyl-4-(1-methylethyl)-1,4-cyclohexadiene|1-methyl-4-(propan-2-yl)cyclohexa-1,4-diene|1-methyl-4-propan-2-ylcyclohexa-1,4-diene|4-Isopropyl-1-methyl-1,4-cyclohexadiene|Crithmene|Gamma-terpinene|Moslene|gamma-Terpinene|p-Mentha-1,4-diene 1-methyl-4-(propan-2-yl)cyclohexa-1,4-diene 1,4-p-Menthadiene|1-Isopropyl-4-methyl-1,4-cyclohexadiene|1-Isopropyl-4-methylcyclohexa-1,4-diene|1-Methyl-4-(1-methylethyl)-1,4-cyclohexadiene|1-methyl-4-(propan-2-yl)cyclohexa-1,4-diene|1-methyl-4-propan-2-ylcyclohexa-1,4-diene|4-Isopropyl-1-methyl-1,4-cyclohexadiene|Crithmene|Gamma-terpinene|Moslene|gamma-Terpinene|p-Mentha-1,4-diene http://purl.obolibrary.org/obo/CHEBI_10577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10588 biolink:ChemicalEntity 1-(3-chlorophenyl)piperazine A N-arylpiperazine that is piperazine carrying a 3-chlorophenyl substituent at position 1. It is a metabolite of the antidepressant drug trazodone. cas:6640-24-0|hmdb:HMDB0061008|kegg.compound:C11738|lincs.smallmolecule:LSM-25627|pubmed:11311791|pubmed:18621591|pubmed:23768699|pubmed:24062697|pubmed:6827905|reaxys:8409|wikipedia.en:Meta-Chlorophenylpiperazine Graph (m-CPP)|1-(3-Chlorophenyl)piperazine|1-(3-chlorophenyl)piperazine|m-Chlorophenylpiperazine 1-(3-chlorophenyl)piperazine (m-CPP)|1-(3-Chlorophenyl)piperazine|1-(3-chlorophenyl)piperazine|m-Chlorophenylpiperazine http://purl.obolibrary.org/obo/CHEBI_10588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1060 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-arabinonic acid A 2-oxo monocarboxylic acid that is 2-oxopentanoic acid which is substituted at positions 4 and 5 by hydroxy groups (the 4S-enantiomer). beilstein:1704607|kegg.compound:C03826 Graph (4S)-4,5-Dihydroxy-2-oxopentanoate|(4S)-4,5-dihydroxy-2-oxopentanoic acid|2-Dehydro-3-deoxy-D-arabinonate|2-Dehydro-3-deoxy-D-pentonate|2-Dehydro-3-deoxy-D-xylonate (4S)-4,5-dihydroxy-2-oxopentanoic acid (4S)-4,5-Dihydroxy-2-oxopentanoate|(4S)-4,5-dihydroxy-2-oxopentanoic acid|2-Dehydro-3-deoxy-D-arabinonate|2-Dehydro-3-deoxy-D-pentonate|2-Dehydro-3-deoxy-D-xylonate http://purl.obolibrary.org/obo/CHEBI_1060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10615 biolink:ChemicalEntity omega-hydroxy fatty acid Any member of the class of naturally-occurring straight-chain fatty acids n carbon atoms long with a carboxyl group at position 1 and a hydroxyl at position n (ω). kegg.compound:C03547|pubmed:13771448|pubmed:16660004 Graph omega-Hydroxy fatty acid|omega-hydroxy fatty acids omega-Hydroxy fatty acid|omega-hydroxy fatty acids http://purl.obolibrary.org/obo/CHEBI_10615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10642 biolink:ChemicalEntity scyllo-inositol cas:488-59-5|gmelin:561300|kegg.compound:C06153|pubmed:24352657|reaxys:2206312 Graph (1r,2r,3r,4r,5r,6r)-cyclohexane-1,2,3,4,5,6-hexol|1,3,5/2,4,6-cyclohexanehexol|Cocositol|Quercinitol|Scyllitol|scyllo-Inositol|scyllo-inositol scyllo-inositol (1r,2r,3r,4r,5r,6r)-cyclohexane-1,2,3,4,5,6-hexol|1,3,5/2,4,6-cyclohexanehexol|Cocositol|Quercinitol|Scyllitol|scyllo-Inositol|scyllo-inositol http://purl.obolibrary.org/obo/CHEBI_10642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10650 biolink:ChemicalEntity sumatriptan A sulfonamide that consists of N,N-dimethyltryptamine bearing an additional (N-methylsulfamoyl)methyl substituent at position 5. Selective agonist for a vascular 5-HT1 receptor subtype (probably a member of the 5-HT1D family). Used (in the form of its succinate salt) for the acute treatment of migraine with or without aura in adults. cas:103628-46-2|drugbank:DB00669|drugcentral:2543|hmdb:HMDB0005037|kegg.compound:C07319|kegg.drug:D00451|lincs.smallmolecule:LSM-5618|pubmed:11045888|pubmed:11401410|pubmed:12172708|pubmed:12856385|pubmed:12917936|pubmed:15652399|pubmed:16120224|pubmed:16142613|pubmed:17557349|pubmed:18442019|pubmed:19619527|pubmed:19825906|pubmed:22106962|pubmed:22150557|pubmed:22272067|pubmed:22302025|pubmed:22336849|pubmed:22336867|pubmed:22336868|pubmed:22435741|reaxys:5346011|wikipedia.en:Sumatriptan Graph (3-[2-(dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide|1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-methanesulfonamide|1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide|3-(2-(dimethylamino)ethyl)-N-methyl-1H-indole-5-methanesulfonamide|3-[2-(dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide|Imigran|Imitrex|Sumatran|Sumax|sumatriptan|sumatriptanum 1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide (3-[2-(dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide|1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-methanesulfonamide|1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide|3-(2-(dimethylamino)ethyl)-N-methyl-1H-indole-5-methanesulfonamide|3-[2-(dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide|Imigran|Imitrex|Sumatran|Sumax|sumatriptan|sumatriptanum http://purl.obolibrary.org/obo/CHEBI_10650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10668 biolink:ChemicalEntity tRNA precursor kegg.compound:C02211 Graph tRNA precursor tRNA precursor http://purl.obolibrary.org/obo/CHEBI_10668 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10696 biolink:ChemicalEntity (3S)-3-hydroxy-L-aspartic acid The (3S)-diastereomer of 3-hydroxy-L-aspartic acid. cas:7298-99-9|kegg.compound:C11511|knapsack:C00018064|pdb-ccd:BHD|pubmed:22735334|reaxys:2046208|ymdb:YMDB00166 Graph (2S,3S)-2-amino-3-hydroxybutanedioic acid|(3S)-3-hydroxy-L-aspartic acid|DL-threo-beta-Hydroxyaspartic acid (2S,3S)-2-amino-3-hydroxybutanedioic acid|(3S)-3-hydroxy-L-aspartic acid (2S,3S)-2-amino-3-hydroxybutanedioic acid|(3S)-3-hydroxy-L-aspartic acid|DL-threo-beta-Hydroxyaspartic acid http://purl.obolibrary.org/obo/CHEBI_10696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10702 biolink:ChemicalEntity (1R,2R)-cyclohexa-3,5-diene-1,2-diol beilstein:1928465|beilstein:4658201|kegg.compound:C04221 Graph (1R,2R)-1,2-dihydrobenzene-1,2-diol|(1R,2R)-cyclohexa-3,5-diene-1,2-diol|trans-1,2-Dihydrobenzene-1,2-diol (1R,2R)-cyclohexa-3,5-diene-1,2-diol (1R,2R)-1,2-dihydrobenzene-1,2-diol|(1R,2R)-cyclohexa-3,5-diene-1,2-diol|trans-1,2-Dihydrobenzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_10702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10723 biolink:ChemicalEntity trans-dec-2-enoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-dec-2-enoic acid. hmdb:HMDB0003948|kegg.compound:C05275|lipidmaps:LMFA07050023|pubmed:1731641|pubmed:8439301|reaxys:11165744 Graph (2E)-2-decenoyl-coenzyme A|(2E)-Decenoyl-CoA|2-trans-decenoyl-coenzyme A|2E-decenoyl-CoA|2E-decenoyl-coenzyme A|3'-phosphoadenosine 5'-[3-(4-{[3-({2-[(2E)-dec-2-enoylsulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|trans-2,3-didehydroacyl-CoA (C10)|trans-2-decenoyl-coenzyme A|trans-Dec-2-enoyl-CoA|trans-dec-2-enoyl-coenzyme A 3'-phosphoadenosine 5'-[3-(4-{[3-({2-[(2E)-dec-2-enoylsulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] (2E)-2-decenoyl-coenzyme A|(2E)-Decenoyl-CoA|2-trans-decenoyl-coenzyme A|2E-decenoyl-CoA|2E-decenoyl-coenzyme A|3'-phosphoadenosine 5'-[3-(4-{[3-({2-[(2E)-dec-2-enoylsulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|trans-2,3-didehydroacyl-CoA (C10)|trans-2-decenoyl-coenzyme A|trans-Dec-2-enoyl-CoA|trans-dec-2-enoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_10723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:107633 biolink:ChemicalEntity 3,4,5-trimethoxybenzoic acid 8-(diethylamino)octyl ester lincs.smallmolecule:LSM-18991 Graph http://purl.obolibrary.org/obo/CHEBI_107633 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:107736 biolink:ChemicalEntity metoclopramide A member of the class of benzamides resulting from the formal condensation of 4-amino-5-chloro-2-methoxybenzoic acid with the primary amino group of N,N-diethylethane-1,2-diamine. cas:364-62-5|drugbank:DB01233|drugcentral:1782|hmdb:HMDB0015363|kegg.compound:C07868|kegg.drug:D00726|lincs.smallmolecule:LSM-3689|patent:BE620543|patent:US3177252|reaxys:1884366|vsdb:1821|wikipedia.en:Metoclopramide Graph 2-methoxy-4-amino-5-chloro-N,N-(dimethylaminoethyl)benzamide|2-methoxy-5-chloroprocainamide|4-amino-5-chloro-2-methoxy-N-(beta-diethylaminoethyl)benzamide|4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide|4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide|4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide|Elieten|Reliveran|metoclopramida|metoclopramide|metoclopramidum 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide 2-methoxy-4-amino-5-chloro-N,N-(dimethylaminoethyl)benzamide|2-methoxy-5-chloroprocainamide|4-amino-5-chloro-2-methoxy-N-(beta-diethylaminoethyl)benzamide|4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide|4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide|4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide|Elieten|Reliveran|metoclopramida|metoclopramide|metoclopramidum http://purl.obolibrary.org/obo/CHEBI_107736 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10782 biolink:ChemicalEntity (S)-(-)-perillyl alcohol A perillyl alcohol in which the chiral centre has S configuration. cas:18457-55-1|cas:536-59-4|kegg.compound:C02452|knapsack:C00010885|lipidmaps:LMPR0102090008|metacyc.compound:CPD-261|pubmed:24125633|pubmed:24623736|pubmed:28233648|reaxys:2501605 Graph (-)-Perillylalcohol|(4S)-perillyl alcohol|4-isopropenylcyclohex-1-en-1-ylmethanol|Perillyl alcohol|[(4S)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|p-Mentha-1,8-dien-7-ol [(4S)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol (-)-Perillylalcohol|(4S)-perillyl alcohol|4-isopropenylcyclohex-1-en-1-ylmethanol|Perillyl alcohol|[(4S)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|p-Mentha-1,8-dien-7-ol http://purl.obolibrary.org/obo/CHEBI_10782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10790 biolink:ChemicalEntity methylenediurea beilstein:1812254|cas:13547-17-6|gmelin:694187 Graph 1-[(carbamoylamino)methyl]urea|N,N''-methanediyldiurea|N,N''-methylenebis(urea)|N,N''-methylenediurea|NH2-CO-NH-CH2-NH-CO-NH2|methylenediurea 1-[(carbamoylamino)methyl]urea|N,N''-methylenediurea 1-[(carbamoylamino)methyl]urea|N,N''-methanediyldiurea|N,N''-methylenebis(urea)|N,N''-methylenediurea|NH2-CO-NH-CH2-NH-CO-NH2|methylenediurea http://purl.obolibrary.org/obo/CHEBI_10790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:109543 biolink:ChemicalEntity 5,7-dibromo-8-quinolinol cas:521-74-4|drugcentral:412|lincs.smallmolecule:LSM-20949 Graph broxyquinolin|dibromoquin|dibromoxin|dibromoxine|dibromoxyquinoline broxyquinolin|dibromoquin|dibromoxin|dibromoxine|dibromoxyquinoline http://purl.obolibrary.org/obo/CHEBI_109543 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:10956 biolink:ChemicalEntity (E)-cinnamoyl-CoA The (E)-isomer of cinnamoyl-CoA. cas:76109-04-1|kegg.compound:C16256 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|Cinnamoyl-coenzyme A|Coenzyme A, S-(3-phenyl-2-propenoate), (E)- 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|Cinnamoyl-coenzyme A|Coenzyme A, S-(3-phenyl-2-propenoate), (E)- http://purl.obolibrary.org/obo/CHEBI_10956 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10965 biolink:ChemicalEntity (R)-2,3,4,5-tetrahydrodipicolinate(2-) Graph (2R)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|(R)-2,3,4,5-tetrahydrodipicolinate|(R)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate (2R)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate (2R)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|(R)-2,3,4,5-tetrahydrodipicolinate|(R)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate http://purl.obolibrary.org/obo/CHEBI_10965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10970 biolink:ChemicalEntity (R)-2-benzylsuccinyl-CoA The (R)-enantiomer of 2-benzylsuccinyl-CoA. kegg.compound:C09817 Graph (R)-2-Benzylsuccinyl-CoA|(R)-2-benzylsuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2R)-2-benzyl-3-carboxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2R)-2-benzyl-3-carboxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (R)-2-Benzylsuccinyl-CoA|(R)-2-benzylsuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2R)-2-benzyl-3-carboxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_10970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10979 biolink:ChemicalEntity (R)-3-[(R)-3-hydroxybutanoyloxy]butanoate A hydroxy monocarboxylic acid anion that is the conjugate base of (R)-3-[(R)-3-hydroxybutanoyloxy]butanoic acid kegg.compound:C04546 Graph (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoate|(3R)-hydroxybutanoate dimer|(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoate (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoate|(3R)-hydroxybutanoate dimer|(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate http://purl.obolibrary.org/obo/CHEBI_10979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10983 biolink:ChemicalEntity (R)-3-hydroxybutyrate The conjugate base of (R)-3-hydroxybutyric acid. kegg.compound:C01089|metacyc.compound:CPD-335|pubmed:19304817|reaxys:6114857 Graph (3R)-3-hydroxybutanoate|(R)-(-)-beta-hydroxybutyrate|(R)-3-Hydroxybutanoate|(R)-3-hydroxybutanoate|3-D-hydroxybutyrate|D-3-hydroxybutyrate|D-beta-hydroxybutyrate (3R)-3-hydroxybutanoate (3R)-3-hydroxybutanoate|(R)-(-)-beta-hydroxybutyrate|(R)-3-Hydroxybutanoate|(R)-3-hydroxybutanoate|3-D-hydroxybutyrate|D-3-hydroxybutyrate|D-beta-hydroxybutyrate http://purl.obolibrary.org/obo/CHEBI_10983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:10986 biolink:ChemicalEntity (R)-4'-phosphonatopantothenate(3-) An organophosphate oxoanion that is the trianion of (R)-5-phosphopantothenic acid arising from deprotonation of the carboxy and phosphate OH groups; major species at pH 7.3 Graph (R)-4'-phosphopantothenate|3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanamido]propanoate 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanamido]propanoate (R)-4'-phosphopantothenate|3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanamido]propanoate http://purl.obolibrary.org/obo/CHEBI_10986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:109895 biolink:ChemicalEntity beta-carboline The parent compound of the β-carbolines, a tricyclic structure comprising an indole ring system ortho- fused to C-3 and C-4 of a pyridine ring. cas:244-63-3|hmdb:HMDB0012897|kegg.compound:C20157|lincs.smallmolecule:LSM-19021|metacyc.compound:CPD-15304|pdb-ccd:NRH|pubmed:23600147|pubmed:8070089|reaxys:128414|wikipedia.en:Beta-Carboline Graph 2,9-Diazafluorene|2-Azacarbazole|9H-Pyrido(3,4-B)indole|9H-beta-Carboline|9H-beta-carboline|9H-pyrido[3,4-b]indole|Carbazoline|Norharman|Norharmane|beta-carboline 9H-beta-carboline 2,9-Diazafluorene|2-Azacarbazole|9H-Pyrido(3,4-B)indole|9H-beta-Carboline|9H-beta-carboline|9H-pyrido[3,4-b]indole|Carbazoline|Norharman|Norharmane|beta-carboline http://purl.obolibrary.org/obo/CHEBI_109895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11009 biolink:ChemicalEntity (R)-3-phenyllactate A (2R)-2-hydroxy monocarboxylic acid anion resulting from the removal of a proton from the carboxylic acid group of (R)-3-phenyllactic acid. Graph (2R)-2-hydroxy-3-phenylpropanoate|(R)-3-phenyllactate (2R)-2-hydroxy-3-phenylpropanoate (2R)-2-hydroxy-3-phenylpropanoate|(R)-3-phenyllactate http://purl.obolibrary.org/obo/CHEBI_11009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11010 biolink:ChemicalEntity (R)-phenyllactoyl-CoA An acyl-CoA having (R)-phenyllactoyl as the S-acyl group. kegg.compound:C16257 Graph (R)-3-phenyllactyl-CoA|(R)-3-phenyllactyl-coenzyme A|(R)-phenyllactoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2R)-2-hydroxy-3-phenylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2R)-2-hydroxy-3-phenylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (R)-3-phenyllactyl-CoA|(R)-3-phenyllactyl-coenzyme A|(R)-phenyllactoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2R)-2-hydroxy-3-phenylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_11010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11022 biolink:ChemicalEntity (S)-4-amino-5-oxopentanoate A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of (S)-4-amino-5-oxopentanoic acid. Graph (4S)-4-amino-5-oxopentanoate (4S)-4-amino-5-oxopentanoate (4S)-4-amino-5-oxopentanoate http://purl.obolibrary.org/obo/CHEBI_11022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11041 biolink:ChemicalEntity (S)-3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid Graph 3-[(5S)-4-oxo-4,5-dihydro-1H-imidazol-5-yl]propanoic acid 3-[(5S)-4-oxo-4,5-dihydro-1H-imidazol-5-yl]propanoic acid 3-[(5S)-4-oxo-4,5-dihydro-1H-imidazol-5-yl]propanoic acid http://purl.obolibrary.org/obo/CHEBI_11041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:110423 biolink:ChemicalEntity clodronic acid An organochlorine compound that is methylene chloride in which both hydrogens are replaced by phosphonic acid groups. It inhibits bone resorption and soft tissue calcification, and is used (often as the disodium salt tetrahydrate) as an adjunct in the treatment of severe hypercalcaemia associated with malignancy, and in the management of osteolytic lesions and bone pain associated with skeletal metastases. beilstein:1876367|cas:10596-23-3|drugbank:DB00720|drugcentral:690|kegg.drug:D03545|lincs.smallmolecule:LSM-5802|patent:BE672205|pubmed:15658873|pubmed:7818726|pubmed:8421279 Graph (Dichloro-phosphono-methyl)-phosphonic acid|(dichloromethanediyl)bis(phosphonic acid)|(dichloromethylene)bisphosphonic acid|(dichloromethylene)diphosphonic acid|acide clodronique|acido clodronico|acidum clodronicum|clodronate|clodronic acid|clodronsaeure|dichloromethylene-1,1-bisphosphonic acid|dichloromethylene-1,1-diphosphonic acid|dichloromethylidene diphosphonate (dichloromethanediyl)bis(phosphonic acid) (Dichloro-phosphono-methyl)-phosphonic acid|(dichloromethanediyl)bis(phosphonic acid)|(dichloromethylene)bisphosphonic acid|(dichloromethylene)diphosphonic acid|acide clodronique|acido clodronico|acidum clodronicum|clodronate|clodronic acid|clodronsaeure|dichloromethylene-1,1-bisphosphonic acid|dichloromethylene-1,1-diphosphonic acid|dichloromethylidene diphosphonate http://purl.obolibrary.org/obo/CHEBI_110423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11047 biolink:ChemicalEntity (S)-3-hydroxybutyrate The conjugate base of (S)-3-hydroxybutyric acid. kegg.compound:C03197|metacyc.compound:CPD-1843|pubmed:18461320|pubmed:19304817|reaxys:4175317 Graph (3S)-3-hydroxybutanoate|(S)-3-Hydroxybutanoate|(S)-3-hydroxy-2-methylpropanoate|(S)-3-hydroxybutanoate|(S)-3HB|L-(+)-2-methylhydracrylate|S3HB (3S)-3-hydroxybutanoate (3S)-3-hydroxybutanoate|(S)-3-Hydroxybutanoate|(S)-3-hydroxy-2-methylpropanoate|(S)-3-hydroxybutanoate|(S)-3HB|L-(+)-2-methylhydracrylate|S3HB http://purl.obolibrary.org/obo/CHEBI_11047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11060 biolink:ChemicalEntity (S)-carnitine The (S)-enantiomer of carnitine. beilstein:4292316|cas:541-14-0|kegg.compound:C15025 Graph (+)-Carnitine|(3S)-3-hydroxy-4-(trimethylammonio)butanoate|(S)-Carnitine|(S)-carnitine|Carnitine D-form|D-(3-Carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt|D-Carnitine|d-Carnitine (3S)-3-hydroxy-4-(trimethylammonio)butanoate (+)-Carnitine|(3S)-3-hydroxy-4-(trimethylammonio)butanoate|(S)-Carnitine|(S)-carnitine|Carnitine D-form|D-(3-Carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt|D-Carnitine|d-Carnitine http://purl.obolibrary.org/obo/CHEBI_11060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:110725 biolink:ChemicalEntity EC 2.1.1.8 (histamine N-methyltransferase) inhibitor An EC 2.1.1.* (methyltransferases) inhibitor that interferes with the action of histamine N-methyltransferase (EC 2.1.1.8). Graph EC 2.1.1.8 (histamine N-methyltransferase) inhibitors|EC 2.1.1.8 inhibitor|EC 2.1.1.8 inhibitors|S-adenosyl-L-methionine:histamine N-tele-methyltransferase inhibitor|S-adenosyl-L-methionine:histamine N-tele-methyltransferase inhibitors|S-adenosylmethionine-histamine N-methyltransferase inhibitor|S-adenosylmethionine-histamine N-methyltransferase inhibitors|histamine 1-methyltransferase inhibitor|histamine 1-methyltransferase inhibitors|histamine methyltransferase inhibitor|histamine methyltransferase inhibitors|histamine-methylating enzyme inhibitor|histamine-methylating enzyme inhibitors|imidazolemethyltransferase inhibitor|imidazolemethyltransferase inhibitors EC 2.1.1.8 (histamine N-methyltransferase) inhibitors|EC 2.1.1.8 inhibitor|EC 2.1.1.8 inhibitors|S-adenosyl-L-methionine:histamine N-tele-methyltransferase inhibitor|S-adenosyl-L-methionine:histamine N-tele-methyltransferase inhibitors|S-adenosylmethionine-histamine N-methyltransferase inhibitor|S-adenosylmethionine-histamine N-methyltransferase inhibitors|histamine 1-methyltransferase inhibitor|histamine 1-methyltransferase inhibitors|histamine methyltransferase inhibitor|histamine methyltransferase inhibitors|histamine-methylating enzyme inhibitor|histamine-methylating enzyme inhibitors|imidazolemethyltransferase inhibitor|imidazolemethyltransferase inhibitors http://purl.obolibrary.org/obo/CHEBI_110725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:111006 biolink:ChemicalEntity maltose 6'-phosphate A maltose phosphate having a single monophosphate group placed at position 6'. kegg.glycan:G10519|metacyc.compound:CPD-15982 Graph 4-O-(6-O-phosphono-alpha-D-glucopyranosyl)-D-glucopyranose|6-O-phosphono-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|maltose 6'-monophosphate 6-O-phosphono-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose 4-O-(6-O-phosphono-alpha-D-glucopyranosyl)-D-glucopyranose|6-O-phosphono-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|maltose 6'-monophosphate http://purl.obolibrary.org/obo/CHEBI_111006 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1113 biolink:ChemicalEntity cis-2-hydroxypenta-2,4-dienoic acid The cis-isomer of 2-hydroxypenta-2,4-dienoic acid. beilstein:10772855|cas:159694-16-3|kegg.compound:C00596|reaxys:11016640 Graph (2E)-2-hydroxypenta-2,4-dienoic acid|cis-2-Hydroxypenta-2,4-dienoate (2E)-2-hydroxypenta-2,4-dienoic acid (2E)-2-hydroxypenta-2,4-dienoic acid|cis-2-Hydroxypenta-2,4-dienoate http://purl.obolibrary.org/obo/CHEBI_1113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:111511 biolink:ChemicalEntity (beta-D-glucopyranosyloxymethyl)deoxyuridine 5'-monophosphate A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having β-D-glucopyranosyloxymethyluracil (base J) as the nucleobase Graph (beta-D-glucosyloxymethyl)deoxyuridine 5'-monophosphate|2'-deoxy-5-[(beta-D-glucopyranosyloxy)methyl]uridine 5'-(dihydrogen phosphate)|5-(beta-D-glucopyranosyloxymethyl)-2'-deoxyuridine 5'-monophosphate|beta-D-glucopyranosyloxymethyl-dUMP|beta-D-glucosyloxymethyl-dUMP|dJMP 2'-deoxy-5-[(beta-D-glucopyranosyloxy)methyl]uridine 5'-(dihydrogen phosphate) (beta-D-glucosyloxymethyl)deoxyuridine 5'-monophosphate|2'-deoxy-5-[(beta-D-glucopyranosyloxy)methyl]uridine 5'-(dihydrogen phosphate)|5-(beta-D-glucopyranosyloxymethyl)-2'-deoxyuridine 5'-monophosphate|beta-D-glucopyranosyloxymethyl-dUMP|beta-D-glucosyloxymethyl-dUMP|dJMP http://purl.obolibrary.org/obo/CHEBI_111511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11173 biolink:ChemicalEntity 1,4-dihydroxy-2-naphthoate A hydroxy monocarboxylic acid anion that is the conjugate base of 1,4-dihydroxy-2-naphthoic acid. metacyc.compound:DIHYDROXYNAPHTHOATE|reaxys:21815550 Graph 1,4-dihydroxy-2-naphthoate|1,4-dihydroxynaphthalene-2-carboxylate 1,4-dihydroxynaphthalene-2-carboxylate 1,4-dihydroxy-2-naphthoate|1,4-dihydroxynaphthalene-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_11173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:112106 biolink:ChemicalEntity (R)-3-(indol-3-yl)-2-oxobutyric acid The (R)-enantiomer of 3-(indol-3-yl)-2-oxobutyric acid. metacyc.compound:CPD-398|pubmed:25730866|reaxys:26479367 Graph (3R)-3-(1H-indol-3-yl)-2-oxobutanoic acid|(R)-beta-methylindolepyruvic acid (3R)-3-(1H-indol-3-yl)-2-oxobutanoic acid (3R)-3-(1H-indol-3-yl)-2-oxobutanoic acid|(R)-beta-methylindolepyruvic acid http://purl.obolibrary.org/obo/CHEBI_112106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11222 biolink:ChemicalEntity 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium kegg.compound:C02691 Graph 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium|Heteropyrithiamine|heteropyrithiamine 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium|Heteropyrithiamine|heteropyrithiamine http://purl.obolibrary.org/obo/CHEBI_11222 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11230 biolink:ChemicalEntity 1-acylglycerophosphocholine(1+) A glycerophosphocholine having an unspecified O-acyl substituent at the 1-position of the glycerol fragment. Graph 1-O-acylglycerophosphocholines|2-lysophosphatidylcholine 1-O-acylglycerophosphocholines|2-lysophosphatidylcholine http://purl.obolibrary.org/obo/CHEBI_11230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11302 biolink:ChemicalEntity 10-desacetyltaxuyunnanin C kegg.compound:C15538 Graph 10-deacetyltaxuyunnanin C|10beta-hydroxytaxa-4(20),11-diene-2alpha,5alpha,14beta-triyl triacetate 10beta-hydroxytaxa-4(20),11-diene-2alpha,5alpha,14beta-triyl triacetate 10-deacetyltaxuyunnanin C|10beta-hydroxytaxa-4(20),11-diene-2alpha,5alpha,14beta-triyl triacetate http://purl.obolibrary.org/obo/CHEBI_11302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11305 biolink:ChemicalEntity 10-hydroxycaprate The conjugate base of 10-hydroxycapric acid. beilstein:4800124|metacyc.compound:10-HYDROXYDECANOATE Graph 10-hydroxydecanoate|omega-hydroxycaprate|omega-hydroxydecanoate 10-hydroxydecanoate 10-hydroxydecanoate|omega-hydroxycaprate|omega-hydroxydecanoate http://purl.obolibrary.org/obo/CHEBI_11305 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11320 biolink:ChemicalEntity 13-hydroxydocosanoate The conjugate base of 13-hydroxydocosanoic acid. kegg.compound:C03049 Graph 13-hydroxydocosanoate 13-hydroxydocosanoate 13-hydroxydocosanoate http://purl.obolibrary.org/obo/CHEBI_11320 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:113455 biolink:ChemicalEntity sodium benzoate An organic sodium salt resulting from the replacement of the proton from the carboxy group of benzoic acid by a sodium ion. cas:532-32-1|kegg.drug:D02277|pubmed:25377186|pubmed:25582668|pubmed:26585641|pubmed:26706697|pubmed:26749113|pubmed:26870932|pubmed:26875563|pubmed:26907495|pubmed:26951541|pubmed:26989415|pubmed:27000017|reaxys:1100243|wikipedia.en:Sodium_benzoate Graph Benzoic acid, sodium salt|E211|Sodium benzoate|sodium benzoate sodium benzoate Benzoic acid, sodium salt|E211|Sodium benzoate|sodium benzoate http://purl.obolibrary.org/obo/CHEBI_113455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:113532 biolink:ChemicalEntity thymoquinone A member of the class of 1,4-benzoquinones that is 1,4-bezoquinone in which the hydrogens at positions 2 and 5 are replaced by methyl and isopropyl groups, respectively. It is a natural compound isolated from Nigella sativa which has demonstrated promising chemotherapeutic activity. cas:490-91-5|foodb.food:FDB013274|hmdb:HMDB0034732|knapsack:C00010876|lincs.smallmolecule:LSM-24947|pdb-ccd:IMW|pubmed:23135290|pubmed:29519737|pubmed:30422744|pubmed:32074066|pubmed:32133061|pubmed:32560283|pubmed:32588453|pubmed:32596711|pubmed:32608003|pubmed:32610056|pubmed:32618005|pubmed:32620860|pubmed:32637881|pubmed:32652915|pubmed:32767958|pubmed:32774669|pubmed:32774804|pubmed:32793594|pubmed:32843585|pubmed:32860490|pubmed:32867015|pubmed:32901987|pubmed:32920292|reaxys:1939047|wikipedia.en:Thymoquinone Graph 2-isopropyl-5-methyl-1,4-benzoquinone|2-isopropyl-5-methyl-p-benzoquinone|2-methyl-5-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione|2-methyl-5-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione|5-isopropyl-2-methyl-2,5-cyclohexadiene-1,4-dione|TQ|p-cymene-2,5-dione|p-mentha-3,6-diene-2,5-dione|thymoquinon 2-methyl-5-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione 2-isopropyl-5-methyl-1,4-benzoquinone|2-isopropyl-5-methyl-p-benzoquinone|2-methyl-5-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione|2-methyl-5-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione|5-isopropyl-2-methyl-2,5-cyclohexadiene-1,4-dione|TQ|p-cymene-2,5-dione|p-mentha-3,6-diene-2,5-dione|thymoquinon http://purl.obolibrary.org/obo/CHEBI_113532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11369 biolink:ChemicalEntity 1L-myo-inositol 1,2,3,4,6-pentakisphosphate beilstein:7742493|beilstein:9175136|kegg.compound:C15990 Graph 1L-myo-inositol 1,2,3,4,6-pentakis(dihydrogen phosphate)|myo-Inositol 1,2,3,4,6-pentakisphosphate 1L-myo-inositol 1,2,3,4,6-pentakis(dihydrogen phosphate) 1L-myo-inositol 1,2,3,4,6-pentakis(dihydrogen phosphate)|myo-Inositol 1,2,3,4,6-pentakisphosphate http://purl.obolibrary.org/obo/CHEBI_11369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11392 biolink:ChemicalEntity 2'-(5-triphosphoribosyl)-3'-dephospho-CoA An adenosine 5'-phosphate derivative that has the structure of coenzyme A dephosphorylated at C-3' and with a 5-triphospho-α-D-ribosyl substituent at C-2'. pubmed:11052675 Graph 2'-(5-triphospho-alpha-D-ribofuranosyl)adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} 2'-(5-triphospho-alpha-D-ribofuranosyl)adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} 2'-(5-triphospho-alpha-D-ribofuranosyl)adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_11392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11408 biolink:ChemicalEntity 2,3,4,5-tetrahydrodipicolinate(2-) A dicarboxylic acid dianion resulting from deprotonation of both carboxy groups of 2,3,4,5-tetrahydrodipicolinic acid. Graph 2,3,4,5-tetrahydrodipicolinate|2,3,4,5-tetrahydropyridine-2,6-dicarboxylate 2,3,4,5-tetrahydropyridine-2,6-dicarboxylate 2,3,4,5-tetrahydrodipicolinate|2,3,4,5-tetrahydropyridine-2,6-dicarboxylate http://purl.obolibrary.org/obo/CHEBI_11408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11412 biolink:ChemicalEntity (2R,3S,4S)-leucocyanidin beilstein:6574536|cas:93527-39-0|kegg.compound:C05906|kegg.drug:D08112|knapsack:C00007235|knapsack:C00008991 Graph (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol|(2R,3S,4S)-leucocyanidin|2,3-trans-3,4-cis-Leucocyanidin|2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|2r-(3,4-dihydroxyphenyl)chromane-3t,4t,5,7-tetrol|3,3',4,4',5,7-Flavanhexol|3,4-Cyanidiol|Leucoanthocyanidol|Leucocianidol|Leucocyanidol|Leukocyanidine|Procyanidol|Resivit (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol|(2R,3S,4S)-leucocyanidin|2,3-trans-3,4-cis-Leucocyanidin|2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|2r-(3,4-dihydroxyphenyl)chromane-3t,4t,5,7-tetrol|3,3',4,4',5,7-Flavanhexol|3,4-Cyanidiol|Leucoanthocyanidol|Leucocianidol|Leucocyanidol|Leukocyanidine|Procyanidol|Resivit http://purl.obolibrary.org/obo/CHEBI_11412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11424 biolink:ChemicalEntity 2,3-dihydroxy-3-methylbutanoate Graph 2,3-dihydroxy-3-methylbutanoate|2,3-dihydroxyisovalerate 2,3-dihydroxy-3-methylbutanoate|2,3-dihydroxyisovalerate http://purl.obolibrary.org/obo/CHEBI_11424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11438 biolink:ChemicalEntity 2,4-dichloro-cis,cis-muconate(2-) umbbd.compound:c0292 Graph (2E,4E)-2,4-dichlorohexa-2,4-dienedioate|(2E,4E)-2,4-dichloromuconate (2E,4E)-2,4-dichlorohexa-2,4-dienedioate (2E,4E)-2,4-dichlorohexa-2,4-dienedioate|(2E,4E)-2,4-dichloromuconate http://purl.obolibrary.org/obo/CHEBI_11438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11449 biolink:ChemicalEntity 2,5-didehydro-D-gluconate Conjugate base of 2,5-didehydro-D-gluconic acid. beilstein:3671140 Graph 2,5-Didehydro-D-gluconate|2,5-didehydro-D-gluconate|2,5-diketo-D-gluconate|2,5-diketogluconate|2-Dehydro-L-idonate|D-threo-2,5-hexodiulosonate|D-threo-hexo-2,5-diulosonate D-threo-hexo-2,5-diulosonate 2,5-Didehydro-D-gluconate|2,5-didehydro-D-gluconate|2,5-diketo-D-gluconate|2,5-diketogluconate|2-Dehydro-L-idonate|D-threo-2,5-hexodiulosonate|D-threo-hexo-2,5-diulosonate http://purl.obolibrary.org/obo/CHEBI_11449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:114785 biolink:ChemicalEntity erlotinib A quinazoline compound having a (3-ethynylphenyl)amino group at the 4-position and two 2-methoxyethoxy groups at the 6- and 7-positions. cas:183321-74-6|drugbank:DB00530|drugcentral:1045|hmdb:HMDB0014671|kegg.drug:D07907|lincs.smallmolecule:LSM-1097|patent:US2010094004|pdb-ccd:AQ4|pubmed:12270171|pubmed:14684309|pubmed:15711537|pubmed:16014882|pubmed:16014883|pubmed:16480284|pubmed:17889528|pubmed:17983745|pubmed:29448920|pubmed:29579331|pubmed:29687154|pubmed:30039303|pubmed:30071517|pubmed:30150014|pubmed:30158288|reaxys:8798958|wikipedia.en:Erlotinib Graph N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine|[6,7-bis(2-methoxy-ethoxy)quinazoline-4-yl]-(3-ethynylphenyl)amine|[6,7-bis-(2-methoxy-ethoxy)-quinazolin-4-yl]-(3-ethynyl-phenyl)-amine|erlotinib|erlotinibum N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine|[6,7-bis(2-methoxy-ethoxy)quinazoline-4-yl]-(3-ethynylphenyl)amine|[6,7-bis-(2-methoxy-ethoxy)-quinazolin-4-yl]-(3-ethynyl-phenyl)-amine|erlotinib|erlotinibum http://purl.obolibrary.org/obo/CHEBI_114785 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:114953 biolink:ChemicalEntity (2S)-2-ammonio-5-{[iminio(methylamino)methyl]amino}pentanoate The zwitterionic form of Nω-methyl-L-arginine in which the imino nitrogen has been protonated. pubmed:1372655 Graph N(omega)-methyl-L-arginine|N(omega)-methyl-L-arginine zwitterion(1+) N(omega)-methyl-L-arginine|N(omega)-methyl-L-arginine zwitterion(1+) http://purl.obolibrary.org/obo/CHEBI_114953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11502 biolink:ChemicalEntity 2-acylglycerophosphocholine(1+) A glycerophosphocholine having an unspecified acyl group attached at the 2-position. pubmed:15913955 Graph 2-acylglycerophosphocholines|LPC 2-acylglycerophosphocholines|LPC http://purl.obolibrary.org/obo/CHEBI_11502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11515 biolink:ChemicalEntity 2-amino-5-formylamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate The 5-N-formyl derivative of 2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate. kegg.compound:C15563|pubmed:19309161 Graph 1-deoxy-1-[(2-amino-5-formamido-6-oxo-1,6-dihydropyrimidin-4-yl)amino]-beta-D-ribofuranose 5-(dihydrogen phosphate)|2-amino-5-formylamino-6-(1-D-ribosylamino)-4(3H)-pyrimidinone 5'-monophosphate|2-amino-5-formylamino-6-(1-D-ribosylamino)-4(3H)-pyrimidinone 5'-phosphate|2-amino-5-formylamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-monophosphate|2-amino-5-formylamino-6-(5-phosphoribosylamino)pyrimidin-4(3H)-one|2-amino-5-formylamino-6-hydroxy-4-(5-phosphoribosylamino)-pyrimidine|2-amino-5-formylamino-6-ribosylamino-4(3H)-pyrimidinone 5'-monophosphate|2-amino-5-formylamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate|N-[2-amino-5-(formylamino)-6-oxo-1,6-dihydropyrimidin-4-yl]-5-O-phosphono-beta-D-ribofuranosylamine 1-deoxy-1-[(2-amino-5-formamido-6-oxo-1,6-dihydropyrimidin-4-yl)amino]-beta-D-ribofuranose 5-(dihydrogen phosphate)|N-[2-amino-5-(formylamino)-6-oxo-1,6-dihydropyrimidin-4-yl]-5-O-phosphono-beta-D-ribofuranosylamine 1-deoxy-1-[(2-amino-5-formamido-6-oxo-1,6-dihydropyrimidin-4-yl)amino]-beta-D-ribofuranose 5-(dihydrogen phosphate)|2-amino-5-formylamino-6-(1-D-ribosylamino)-4(3H)-pyrimidinone 5'-monophosphate|2-amino-5-formylamino-6-(1-D-ribosylamino)-4(3H)-pyrimidinone 5'-phosphate|2-amino-5-formylamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-monophosphate|2-amino-5-formylamino-6-(5-phosphoribosylamino)pyrimidin-4(3H)-one|2-amino-5-formylamino-6-hydroxy-4-(5-phosphoribosylamino)-pyrimidine|2-amino-5-formylamino-6-ribosylamino-4(3H)-pyrimidinone 5'-monophosphate|2-amino-5-formylamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate|N-[2-amino-5-(formylamino)-6-oxo-1,6-dihydropyrimidin-4-yl]-5-O-phosphono-beta-D-ribofuranosylamine http://purl.obolibrary.org/obo/CHEBI_11515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:115239 biolink:ChemicalEntity 3-quinuclidinol Quinuclidine in which a hydrogen atom at position 3 is substituted by a hydroxy group. cas:1619-34-7|patent:US2648667|pubmed:8487254 Graph (+-)-3-quinuclidinol|1-Aza-bicyclo[2.2.2]octan-3-ol|1-azabicyclo[2.2.2]octan-3-ol|3-hydroxy-1-azabicyclo[2.2.2]octane|3-hydroxyquinuclidine|quinuclidin-3-ol 1-azabicyclo[2.2.2]octan-3-ol (+-)-3-quinuclidinol|1-Aza-bicyclo[2.2.2]octan-3-ol|1-azabicyclo[2.2.2]octan-3-ol|3-hydroxy-1-azabicyclo[2.2.2]octane|3-hydroxyquinuclidine|quinuclidin-3-ol http://purl.obolibrary.org/obo/CHEBI_115239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11561 biolink:ChemicalEntity 2-dehydropantoate A 2-oxo monocarboxylic acid anion that results from the removal of a proton from the carboxylic acid group of 2-dehydropantoic acid. drugbank:DB03795|kegg.compound:C00966|metacyc.compound:2-DEHYDROPANTOATE Graph 2-Dehydropantoate|2-dehydropantoate|4-hydroxy-3,3-dimethyl-2-oxobutanoate 4-hydroxy-3,3-dimethyl-2-oxobutanoate 2-Dehydropantoate|2-dehydropantoate|4-hydroxy-3,3-dimethyl-2-oxobutanoate http://purl.obolibrary.org/obo/CHEBI_11561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11563 biolink:ChemicalEntity 2-deoxy-alpha-D-ribose 1-phosphate The α-anomer of 2-deoxy-D-ribofuranose 1-phosphate. cas:17210-42-3|kegg.compound:C00672|reaxys:12467 Graph 2-Deoxy-alpha-D-ribose 1-phosphate|2-deoxy-1-O-phosphono-alpha-D-erythro-pentofuranose|2-deoxy-alpha-D-erythro-pentofuranose 1-(dihydrogen phosphate) 2-deoxy-alpha-D-erythro-pentofuranose 1-(dihydrogen phosphate) 2-Deoxy-alpha-D-ribose 1-phosphate|2-deoxy-1-O-phosphono-alpha-D-erythro-pentofuranose|2-deoxy-alpha-D-erythro-pentofuranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_11563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11594 biolink:ChemicalEntity 2-coumarate A coumarate that is the conjugate base of 2-coumaric acid. beilstein:7022193|gmelin:1146630 Graph 3-(2-hydroxyphenyl)acrylate|3-(2-hydroxyphenyl)prop-2-enoate 3-(2-hydroxyphenyl)prop-2-enoate 3-(2-hydroxyphenyl)acrylate|3-(2-hydroxyphenyl)prop-2-enoate http://purl.obolibrary.org/obo/CHEBI_11594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11596 biolink:ChemicalEntity 2-hydroxyglutarate(2-) A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of 2-hydroxyglutaric acid. metacyc.compound:2-HYDROXYGLUTARIC_ACID|reaxys:5736650 Graph 2-hydroxyglutarate|2-hydroxypentanedioate 2-hydroxypentanedioate 2-hydroxyglutarate|2-hydroxypentanedioate http://purl.obolibrary.org/obo/CHEBI_11596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11614 biolink:ChemicalEntity 2-methylbut-2-enoyl-coenzyme A An alk-2-enoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-methylbut-2-enoic acid. Graph 2-methylbut-2-enol-coenzyme A|2-methylcrotonoyl-CoA|2-methylcrotonoyl-coenzyme A|2-methylcrotonyl-CoA|2-methylcrotonyl-coenzyme A|3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate]|Methylcrotonyl-coa|alpha-methylcrotonoyl-CoA|alpha-methylcrotonoyl-coenzyme A 3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate] 2-methylbut-2-enol-coenzyme A|2-methylcrotonoyl-CoA|2-methylcrotonoyl-coenzyme A|2-methylcrotonyl-CoA|2-methylcrotonyl-coenzyme A|3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate]|Methylcrotonyl-coa|alpha-methylcrotonoyl-CoA|alpha-methylcrotonoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_11614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116225 biolink:ChemicalEntity nomifensine An N-methylated tetrahydroisoquinoline carrying phenyl and amino substituents at positions C-4 and C-8, respectively. cas:24526-64-5|drugbank:DB04821|drugcentral:1958|lincs.smallmolecule:LSM-4388|pubmed:1502708|pubmed:24766210|pubmed:7189402|reaxys:484561 Graph (+-)-Nomifensin|(+-)-Nomifensine|2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine|2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amine|8-Amino-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline|D,L-nomifensine|Nomifenison|Nomifensin|Nomifensine|Nomiphensine|R/S-nomifensine|nomifensina|nomifensine|nomifensinum 2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amine (+-)-Nomifensin|(+-)-Nomifensine|2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine|2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amine|8-Amino-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline|D,L-nomifensine|Nomifenison|Nomifensin|Nomifensine|Nomiphensine|R/S-nomifensine|nomifensina|nomifensine|nomifensinum http://purl.obolibrary.org/obo/CHEBI_116225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116278 biolink:ChemicalEntity lomefloxacin A fluoroquinolone antibiotic, used (generally as the hydrochloride salt) to treat bacterial infections including bronchitis and urinary tract infections. It is also used to prevent urinary tract infections prior to surgery. beilstein:4210041|cas:98079-51-7|drugbank:DB00978|drugcentral:1594|kegg.compound:C07078|kegg.drug:D02318|lincs.smallmolecule:LSM-5145|patent:DE3433924|patent:US4528287|pubmed:11195849|pubmed:3134843|pubmed:3348607|pubmed:3476021|wikipedia.en:Lomefloxacin Graph (+-)-1-ethyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid|1,4-Dihydro-6,8-difluoro-1-ethyl-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid|1-ethyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid|LFLX|Lomefloxacine|Lomefloxacino|Lomefloxacinum|lomefloxacin 1-ethyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid (+-)-1-ethyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid|1,4-Dihydro-6,8-difluoro-1-ethyl-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid|1-ethyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid|LFLX|Lomefloxacine|Lomefloxacino|Lomefloxacinum|lomefloxacin http://purl.obolibrary.org/obo/CHEBI_116278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116314 biolink:ChemicalEntity oleamide A fatty amide derived from oleic acid. cas:301-02-0|hmdb:HMDB0002117|lipidmaps:LMFA08010004|pubmed:11681856|pubmed:17445087|pubmed:23078175|pubmed:24253045|reaxys:1726539|wikipedia.en:Oleamide Graph (9Z)-9-Octadecenamide|(9Z)-octadec-9-enamide|(9Z)-octadecenamide|(Z)-9-Octadecenamide|(Z)-Octadec-9-enoic acid amide|9-Octadecenamide|9Z-octadecenamide|Oleic acid amide|Oleyl amide|Oleylamide|cis-9,10-Octadecenoamide (9Z)-octadec-9-enamide (9Z)-9-Octadecenamide|(9Z)-octadec-9-enamide|(9Z)-octadecenamide|(Z)-9-Octadecenamide|(Z)-Octadec-9-enoic acid amide|9-Octadecenamide|9Z-octadecenamide|Oleic acid amide|Oleyl amide|Oleylamide|cis-9,10-Octadecenoamide http://purl.obolibrary.org/obo/CHEBI_116314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11641 biolink:ChemicalEntity 2-oxopent-4-enoate kegg.compound:C00596|umbbd.compound:c0042 Graph 2-Oxopent-4-enoate|2-oxopent-4-enoate|Oxopent-4-enoate 2-oxopent-4-enoate 2-Oxopent-4-enoate|2-oxopent-4-enoate|Oxopent-4-enoate http://purl.obolibrary.org/obo/CHEBI_11641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116509 biolink:ChemicalEntity diuron A member of the class of 3-(3,4-substituted-phenyl)-1,1-dimethylureas that is urea in which both of the hydrogens attached to one nitrogen are substituted by methyl groups, and one of the hydrogens attached to the other nitrogen is substituted by a 3,4-dichlorophenyl group. cas:330-54-1|kegg.compound:C18428|lincs.smallmolecule:LSM-25609|metacyc.compound:CPD-16775|patent:CN103120180|patent:CN103125511|patent:US2768971|pesticides:diuron|ppdb:260|pubmed:10866370|pubmed:17142046|pubmed:17449247|pubmed:23081760|pubmed:33400299|reaxys:2215168|wikipedia.en:Diuron Graph 1,1-dimethyl-3-(3,4-dichlorophenyl)urea|1-(3,4-dichlorophenyl)-3,3-dimethylurea|1-(3,4-dichlorophenyl)-3,3-dimethyluree|3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff|3-(3,4-Dichloro-phenyl)-1,1-dimethyl-urea|3-(3,4-dichlorophenyl)-1,1-dimethylurea|DCMU|N'-(3,4-dichlorophenyl)-N,N-dimethylurea|N,N,-dimethyl-N'-(3,4-dichlorophenyl)urea|N-(3,4-dichlorophenyl)-N',N'-dimethylurea|diuron 3-(3,4-dichlorophenyl)-1,1-dimethylurea 1,1-dimethyl-3-(3,4-dichlorophenyl)urea|1-(3,4-dichlorophenyl)-3,3-dimethylurea|1-(3,4-dichlorophenyl)-3,3-dimethyluree|3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff|3-(3,4-Dichloro-phenyl)-1,1-dimethyl-urea|3-(3,4-dichlorophenyl)-1,1-dimethylurea|DCMU|N'-(3,4-dichlorophenyl)-N,N-dimethylurea|N,N,-dimethyl-N'-(3,4-dichlorophenyl)urea|N-(3,4-dichlorophenyl)-N',N'-dimethylurea|diuron http://purl.obolibrary.org/obo/CHEBI_116509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11656 biolink:ChemicalEntity 2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid Graph 2-(3-carboxypropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid 2-(3-carboxypropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid 2-(3-carboxypropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_11656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116735 biolink:ChemicalEntity benzocaine A benzoate ester having 4-aminobenzoic acid as the acid component and ethanol as the alcohol component. A surface anaesthetic, it is used to suppress the gag reflex, and as a lubricant and topical anaesthetic on the larynx, mouth, nasal cavity, respiratory tract, oesophagus, rectum, urinary tract, and vagina. beilstein:638434|cas:94-09-7|drugbank:DB01086|drugcentral:323|hmdb:HMDB0004992|kegg.compound:C07527|kegg.drug:D00552|lincs.smallmolecule:LSM-5830|pubmed:10866370|pubmed:1155304|pubmed:12574744|pubmed:12873507|pubmed:16640711|pubmed:18971079|pubmed:21616561|pubmed:22015737|pubmed:22105694|pubmed:22551703|pubmed:22556388|pubmed:23301559|pubmed:23565580|pubmed:23696166|pubmed:25097477|pubmed:2579237|pubmed:29079364|reaxys:638434|wikipedia.en:Benzocaine Graph 4-aminobenzoic acid ethyl ester|Amben ethyl ester|Benzocaina|Benzocaine|Benzocainum|Ethyl aminobenzoate|Ethyl p-aminobenzoate|Ethyl p-aminophenylcarboxylate|ethyl 4-aminobenzoate|p-(Ethoxycarbonyl)aniline|p-Carbethoxyaniline|p-Ethoxycarboxylic aniline ethyl 4-aminobenzoate 4-aminobenzoic acid ethyl ester|Amben ethyl ester|Benzocaina|Benzocaine|Benzocainum|Ethyl aminobenzoate|Ethyl p-aminobenzoate|Ethyl p-aminophenylcarboxylate|ethyl 4-aminobenzoate|p-(Ethoxycarbonyl)aniline|p-Carbethoxyaniline|p-Ethoxycarboxylic aniline http://purl.obolibrary.org/obo/CHEBI_116735 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11684 biolink:ChemicalEntity 3,3',5'-triiodo-L-thyronine The L-enantiomer of 3,3',5'-triiodothyronine. beilstein:2823535|cas:5817-39-0|kegg.compound:C07639|pubmed:30366665|pubmed:34569083|pubmed:34714056|pubmed:34916749|pubmed:38149630 Graph 3,3',5'-triiodo-L-thyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3-iodo-L-phenylalanine|L-3,3',5'-triiodothyronine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodo-L-tyrosine|Reverse triiodothyronine|rT3|reverse L-triiodothyronine 3,3',5'-triiodo-L-thyronine 3,3',5'-triiodo-L-thyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3-iodo-L-phenylalanine|L-3,3',5'-triiodothyronine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodo-L-tyrosine|Reverse triiodothyronine|rT3|reverse L-triiodothyronine http://purl.obolibrary.org/obo/CHEBI_11684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116931 biolink:ChemicalEntity nipecotic acid A piperidinemonocarboxylic acid that is piperidine in which one of the hydrogens at position 3 is substituted by a carboxylic acid group. beilstein:81096|cas:498-95-3|gmelin:1782986|lincs.smallmolecule:LSM-6517|patent:US3159639 Graph 3-piperidinecarboxylic acid|Piperidine-3-carboxylic acid|hexahydronicotinic acid|piperidine-3-carboxylic acid piperidine-3-carboxylic acid 3-piperidinecarboxylic acid|Piperidine-3-carboxylic acid|hexahydronicotinic acid|piperidine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_116931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:116962 biolink:ChemicalEntity fosinoprilat A phosphinic acid-containing N-acyl derivative of (4S)-cyclohexyl-L-proline. An inhibitor of angiotensin converting enzyme (ACE), it is used as the phosphinate ester pro-drug fosinopril for treatment of hypertension and chronic heart failure. cas:95399-71-6|kegg.drug:D03772|pubmed:10606834|pubmed:17482898|pubmed:7751424|pubmed:9549638|reaxys:6492772 Graph (2S,4S)-4-cyclohexyl-1-{2-[hydroxy(4-phenylbutyl)phosphoryl]acetyl}pyrrolidine-2-carboxylic acid|(2S,4S)-4-cyclohexyl-1-{2-[hydroxy-(4-phenyl-butyl)-phosphinoyl]-acetyl}-pyrrolidine-2-carboxylic acid|(4S)-4-cyclohexyl-1-((hydroxy(4-phenylbutyl)phosphinyl)acetyl)-L-proline|(4S)-4-cyclohexyl-1-{[hydroxy(4-phenylbutyl)phosphoryl]acetyl}-L-proline|4-Cyclohexyl-1-{2-[hydroxy-(4-phenyl-butyl)-phosphinoyl]-acetyl}-pyrrolidine-2-carboxylic acid|fosinopril diacid|fosinoprilat|fosinoprilatum|fosinoprilic acid (4S)-4-cyclohexyl-1-{[hydroxy(4-phenylbutyl)phosphoryl]acetyl}-L-proline (2S,4S)-4-cyclohexyl-1-{2-[hydroxy(4-phenylbutyl)phosphoryl]acetyl}pyrrolidine-2-carboxylic acid|(2S,4S)-4-cyclohexyl-1-{2-[hydroxy-(4-phenyl-butyl)-phosphinoyl]-acetyl}-pyrrolidine-2-carboxylic acid|(4S)-4-cyclohexyl-1-((hydroxy(4-phenylbutyl)phosphinyl)acetyl)-L-proline|(4S)-4-cyclohexyl-1-{[hydroxy(4-phenylbutyl)phosphoryl]acetyl}-L-proline|4-Cyclohexyl-1-{2-[hydroxy-(4-phenyl-butyl)-phosphinoyl]-acetyl}-pyrrolidine-2-carboxylic acid|fosinopril diacid|fosinoprilat|fosinoprilatum|fosinoprilic acid http://purl.obolibrary.org/obo/CHEBI_116962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11750 biolink:ChemicalEntity 3-sn-phosphatidyl-L-serine A 3-sn-glycerophosphoserine compound having acyl substituents at the 1- and 2-hydroxy positions. kegg.compound:C02737|lipidmaps:LMGP03010000|pubmed:16341241 Graph 1,2-diacyl-sn-glycero-3-phospho-L-serine|1,2-diacyl-sn-glycerol 3-phospho-L-serine|1-D-phosphatidyl-L-serine|3-L-phosphatidyl-L-serine|3-O-sn-phosphatidyl-L-serine|3-sn-phosphatidyl-L-serines|L-alpha-phosphatidylserine 1,2-diacyl-sn-glycero-3-phospho-L-serine|1,2-diacyl-sn-glycerol 3-phospho-L-serine|1-D-phosphatidyl-L-serine|3-L-phosphatidyl-L-serine|3-O-sn-phosphatidyl-L-serine|3-sn-phosphatidyl-L-serines|L-alpha-phosphatidylserine http://purl.obolibrary.org/obo/CHEBI_11750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1178 biolink:ChemicalEntity (2S)-2-isopropylmalate(2-) A 2-isopropylmalate(2−) with S-configuration at the chiral centre. kegg.compound:C02504|metacyc.compound:3-CARBOXY-3-HYDROXY-ISOCAPROATE Graph (2S)-2-Isopropylmalate|(2S)-2-hydroxy-2-(propan-2-yl)butanedioate|(2S)-2-isopropylmalate (2S)-2-hydroxy-2-(propan-2-yl)butanedioate (2S)-2-Isopropylmalate|(2S)-2-hydroxy-2-(propan-2-yl)butanedioate|(2S)-2-isopropylmalate http://purl.obolibrary.org/obo/CHEBI_1178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11791 biolink:ChemicalEntity 3-deoxy-D-manno-octulosonic acid An eight-membered ketoaldonic acid having D-manno configuration Graph 3-deoxy-D-manno-octulosonic acid 3-deoxy-D-manno-octulosonic acid 3-deoxy-D-manno-octulosonic acid http://purl.obolibrary.org/obo/CHEBI_11791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11805 biolink:ChemicalEntity 3-hydroxyisobutyrate kegg.compound:C01188 Graph 3-Hydroxy-2-methylpropanoate|3-Hydroxyisobutyrate|3-hydroxy-2-isobutyrate|3-hydroxy-2-methylpropanoate|3-hydroxy-2-methylpropionate 3-hydroxy-2-methylpropanoate 3-Hydroxy-2-methylpropanoate|3-Hydroxyisobutyrate|3-hydroxy-2-isobutyrate|3-hydroxy-2-methylpropanoate|3-hydroxy-2-methylpropionate http://purl.obolibrary.org/obo/CHEBI_11805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11807 biolink:ChemicalEntity 5-hydroxy-6-methylpyridine-3,4-dicarboxylate Graph 5-hydroxy-6-methylpyridine-3,4-dicarboxylate 5-hydroxy-6-methylpyridine-3,4-dicarboxylate 5-hydroxy-6-methylpyridine-3,4-dicarboxylate http://purl.obolibrary.org/obo/CHEBI_11807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11812 biolink:ChemicalEntity 3-hydroxy-3-methyl-2-oxobutanoate kegg.compound:C04181 Graph 2-Oxo-3-hydroxyisovalerate|3-Hydroxy-3-methyl-2-oxobutanoate|3-hydroxy-3-methyl-2-oxobutanoate 2-Oxo-3-hydroxyisovalerate|3-Hydroxy-3-methyl-2-oxobutanoate|3-hydroxy-3-methyl-2-oxobutanoate http://purl.obolibrary.org/obo/CHEBI_11812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11814 biolink:ChemicalEntity 3-hydroxy-3-methylglutaryl-CoA An α,ω dicarboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with one of the carboxy groups of 3-hydroxy-3-methylglutaric acid. pubmed:20640529|pubmed:9160173 Graph (4-carboxy-3-hydroxy-3-methylbutanoyl)-CoA|(4-carboxy-3-hydroxy-3-methylbutanoyl)-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-3-hydroxy-3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-hydroxy-3-methylglutaryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-3-hydroxy-3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (4-carboxy-3-hydroxy-3-methylbutanoyl)-CoA|(4-carboxy-3-hydroxy-3-methylbutanoyl)-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-3-hydroxy-3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-hydroxy-3-methylglutaryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_11814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1184 biolink:ChemicalEntity maleylacetic acid A 4-oxohex-2-enedioic acid with a Z-configuration. cas:24740-88-3|kegg.compound:C02222|knapsack:C00013593|pubmed:24252642|pubmed:25058513|reaxys:8544937 Graph (2Z)-4-oxohex-2-enedioic acid|(Z)-4-oxo-2-hexenedioic acid|2-Maleylacetate|4-Oxohex-2-enedioate|Maleylacetate (2Z)-4-oxohex-2-enedioic acid (2Z)-4-oxohex-2-enedioic acid|(Z)-4-oxo-2-hexenedioic acid|2-Maleylacetate|4-Oxohex-2-enedioate|Maleylacetate http://purl.obolibrary.org/obo/CHEBI_1184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11851 biolink:ChemicalEntity 3-methyl-2-oxobutanoate A 2-oxo monocarboxylic acid anion that is the conjugate base of 3-methyl-2-oxobutanoic acid, arising from deprotonation of the carboxy group. kegg.compound:C00141|metacyc.compound:2-KETO-ISOVALERATE|pubmed:9748245|reaxys:3661467 Graph 2-Oxo-3-methylbutanoate|2-Oxoisopentanoate|2-Oxoisovalerate|3-methyl-2-oxobutanoate|3-methyl-2-oxobutyrate|alpha-keto-isovalerate 3-methyl-2-oxobutanoate 2-Oxo-3-methylbutanoate|2-Oxoisopentanoate|2-Oxoisovalerate|3-methyl-2-oxobutanoate|3-methyl-2-oxobutyrate|alpha-keto-isovalerate http://purl.obolibrary.org/obo/CHEBI_11851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11867 biolink:ChemicalEntity 3-oxo-5beta-cholanate Graph 3-oxo-5-beta-cholan-24-oate|3-oxo-5beta-cholan-24-oate 3-oxo-5beta-cholan-24-oate 3-oxo-5-beta-cholan-24-oate|3-oxo-5beta-cholan-24-oate http://purl.obolibrary.org/obo/CHEBI_11867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11892 biolink:ChemicalEntity N-carbamoyl-beta-alaninate A monocarboxylic acid anion that is the conjugate base of N-carbamoyl-β-alanine arising from deprotonation of the carboxy group. gmelin:675229|reaxys:3663255 Graph 3-(carbamoylamino)propanoate|3-[(aminocarbonyl)amino]propanoate|3-ureidopropanoate|3-ureidopropionate|ureidopropanoate|ureidopropionate 3-(carbamoylamino)propanoate 3-(carbamoylamino)propanoate|3-[(aminocarbonyl)amino]propanoate|3-ureidopropanoate|3-ureidopropionate|ureidopropanoate|ureidopropionate http://purl.obolibrary.org/obo/CHEBI_11892 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11893 biolink:ChemicalEntity 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholanate Graph 3-alpha,12-alpha-dihydroxy-7-oxo-5-beta-cholanate|3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oate 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oate 3-alpha,12-alpha-dihydroxy-7-oxo-5-beta-cholanate|3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oate http://purl.obolibrary.org/obo/CHEBI_11893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:119 biolink:ChemicalEntity D-synephrine The D-enantiomer of synephrine. cas:614-35-7|hmdb:HMDB0004826|kegg.compound:C01869|metacyc.compound:1-4-HYDROXYPHENYL-2-METHYLAMINOETHAN|pubmed:8255371|pubmed:8833327|reaxys:3198818 Graph (-)-4-hydroxy-alpha-[(methylamino)methyl]benzenemethanol|(-)-Oxedrine|(-)-Sympatol|(-)-Synephrine|(-)-p-hydroxy-alpha-[(methylamino)methyl]benzyl alcohol|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol|D(-)-Synephrine 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol (-)-4-hydroxy-alpha-[(methylamino)methyl]benzenemethanol|(-)-Oxedrine|(-)-Sympatol|(-)-Synephrine|(-)-p-hydroxy-alpha-[(methylamino)methyl]benzyl alcohol|4-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol|D(-)-Synephrine http://purl.obolibrary.org/obo/CHEBI_119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11901 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanate Conjugate base of 3α,7α-dihydroxy-12-oxo-5β-cholanic acid; major species at pH 7.3. Graph 3-alpha,7-alpha-dihydroxy-12-oxo-5-beta-cholanate|3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oate 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oate 3-alpha,7-alpha-dihydroxy-12-oxo-5-beta-cholanate|3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oate http://purl.obolibrary.org/obo/CHEBI_11901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11909 biolink:ChemicalEntity 3beta-hydroxy-5alpha-pregnan-20-one beilstein:2219963|cas:516-55-2|kegg.compound:C15484 Graph (3beta,5alpha)-3-hydroxypregnan-20-one|3-beta-hydroxy-5-alpha-pregnane-20-one|3beta-Hydroxy-5alpha-pregnane-20-one|3beta-hydroxy-5alpha-pregnan-20-one|5alpha-pregnan-3beta-ol-20-one|allopregnan-3beta-ol-20-one 3beta-hydroxy-5alpha-pregnan-20-one (3beta,5alpha)-3-hydroxypregnan-20-one|3-beta-hydroxy-5-alpha-pregnane-20-one|3beta-Hydroxy-5alpha-pregnane-20-one|3beta-hydroxy-5alpha-pregnan-20-one|5alpha-pregnan-3beta-ol-20-one|allopregnan-3beta-ol-20-one http://purl.obolibrary.org/obo/CHEBI_11909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11935 biolink:ChemicalEntity 4-(beta-D-glucosyloxy)benzoate A benzoate resulting from the removal of a proton from the carboxylic acid group of 4-(β-D-glucosyloxy)benzoic acid. kegg.compound:C03993 Graph 4-(beta-D-Glucosyloxy)benzoate|4-(beta-D-glucopyranosyloxy)benzoate|4-(beta-D-glucosyloxy)benzoate 4-(beta-D-glucopyranosyloxy)benzoate 4-(beta-D-Glucosyloxy)benzoate|4-(beta-D-glucopyranosyloxy)benzoate|4-(beta-D-glucosyloxy)benzoate http://purl.obolibrary.org/obo/CHEBI_11935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11944 biolink:ChemicalEntity 4-(hydroxymethyl)benzenesulfonate An arenesulfonate that is the conjugate base of 4-(hydroxymethyl)benzenesulfonic acid, obtained by deprotonation of the sulfonic acid group. umbbd.compound:c0302 Graph 4-(hydroxymethyl)benzenesulfonate 4-(hydroxymethyl)benzenesulfonate 4-(hydroxymethyl)benzenesulfonate http://purl.obolibrary.org/obo/CHEBI_11944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11946 biolink:ChemicalEntity 4-(trimethylammonio)but-2-enoate beilstein:3904235 Graph 4-(trimethylammonio)but-2-enoate 4-(trimethylammonio)but-2-enoate 4-(trimethylammonio)but-2-enoate http://purl.obolibrary.org/obo/CHEBI_11946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:119486 biolink:ChemicalEntity efavirenz 1,4-Dihydro-2H-3,1-benzoxazin-2-one substituted at the 4 position by cyclopropylethynyl and trifluoromethyl groups (S configuration) and at the 6 position by chlorine. A non-nucleoside reverse transcriptase inhibitor with activity against HIV, it is used with other antiretrovirals for combination therapy of HIV infection. cas:154598-52-4|drugbank:DB00625|drugcentral:989|hmdb:HMDB0014763|kegg.compound:C08088|kegg.drug:D00896|lincs.smallmolecule:LSM-5526|patent:EP582455|patent:US5519021|pdb-ccd:EFZ|pubmed:10576692|pubmed:10673109|pubmed:25017682|reaxys:7387333|wikipedia.en:Efavirenz Graph (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-3,1-BENZOXAZIN-2-ONE|(4S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one|(S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one|(S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one|6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one|Efavirenz (4S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-3,1-BENZOXAZIN-2-ONE|(4S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one|(S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one|(S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one|6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one|Efavirenz http://purl.obolibrary.org/obo/CHEBI_119486 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11951 biolink:ChemicalEntity 4-acetamidobutanoate A monocarboxylic acid anion that is the conjugate base of 4-acetamidobutanoic acid, arising from deprotonation of the carboxy group. kegg.compound:C02946|metacyc.compound:CPD-35|pubmed:4156831 Graph 4-acetamidobutanoate|N-acetyl-4-aminobutyrate|N-acetyl-gamma-aminobutyrate|N4-Acetylaminobutanoate 4-acetamidobutanoate 4-acetamidobutanoate|N-acetyl-4-aminobutyrate|N-acetyl-gamma-aminobutyrate|N4-Acetylaminobutanoate http://purl.obolibrary.org/obo/CHEBI_11951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11955 biolink:ChemicalEntity 4-amino-3-hydroxybutanoate The conjugate base of γ-amino-β-hydroxybutyric acid arising from deprotonation of the carboxy group. cas:352-21-6|kegg.compound:C03678 Graph 4-Amino-3-hydroxybutanoate 4-Amino-3-hydroxybutanoate http://purl.obolibrary.org/obo/CHEBI_11955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:119573 biolink:ChemicalEntity delavirdine The amide resulting from the formal condensation of 5-[(methylsulfonyl)amino]-1H-indole-2-carboxylic acid and 4-amino group of 1-[3-(isopropylamino)pyridin-2-yl]piperazine, delavirdine is a non-nucleoside reverse transcriptase inhibitor with activity specific for HIV-1. Viral resistance emerges rapidly when delavirdine is used alone, so it is therefore used (as the methanesulfonic acid salt) with other antiretrovirals for combination therapy of HIV infection. cas:136817-59-9|drugbank:DB00705|drugcentral:799|kegg.compound:C06941|kegg.drug:D07782|patent:WO9109849|pdb-ccd:SPP|pubmed:11124228|pubmed:11225565|pubmed:11327199|pubmed:11363651|pubmed:11363709|pubmed:11364022|pubmed:11364099|pubmed:11364363|pubmed:11364481|pubmed:11590527|pubmed:16449090|pubmed:21080015|pubmed:21683601|pubmed:21865017|reaxys:6356813|wikipedia.en:Delavirdine Graph (N-[2-[4-[3-(1-methylethylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-1H-indol-5-yl] methanesulfonamide)|1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((5-((methylsulfonyl)amino)-1H-indol-2-yl)carbonyl)piperazine|2-(4-(5-methanesulfonamido-1H-indol-2-ylcarbonyl)-1-piperazinyl)-N-(1-methylethyl)-3-pyridinamine|Delavirdine|N-(2-(1-(3-(isopropylamino)pyridin-2-yl)piperazine-4-carbonyl)-1H-indol-5-yl)methanesulfonamide|N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide|N-{2-[4-(3-Isopropylamino-pyridin-2-yl)-piperazine-1-carbonyl]-1H-indol-5-yl}-methanesulfonamide|delavirdine N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide (N-[2-[4-[3-(1-methylethylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-1H-indol-5-yl] methanesulfonamide)|1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((5-((methylsulfonyl)amino)-1H-indol-2-yl)carbonyl)piperazine|2-(4-(5-methanesulfonamido-1H-indol-2-ylcarbonyl)-1-piperazinyl)-N-(1-methylethyl)-3-pyridinamine|Delavirdine|N-(2-(1-(3-(isopropylamino)pyridin-2-yl)piperazine-4-carbonyl)-1H-indol-5-yl)methanesulfonamide|N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide|N-{2-[4-(3-Isopropylamino-pyridin-2-yl)-piperazine-1-carbonyl]-1H-indol-5-yl}-methanesulfonamide|delavirdine http://purl.obolibrary.org/obo/CHEBI_119573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11972 biolink:ChemicalEntity 4-carboxymethylenebut-2-en-4-olide A butenolide having a carboxymethylene group at the 4-position. beilstein:3111 Graph (5-oxofuran-2(5H)-ylidene)acetic acid (5-oxofuran-2(5H)-ylidene)acetic acid (5-oxofuran-2(5H)-ylidene)acetic acid http://purl.obolibrary.org/obo/CHEBI_11972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11986 biolink:ChemicalEntity 4-fluoro-L-threonine beilstein:4372061|cas:102130-93-8|kegg.compound:C15533 Graph (2S,3S)-2-amino-4-fluoro-3-hydroxybutanoic acid|4-fluoro-L-threonine|4-fluorothreonine 4-fluoro-L-threonine (2S,3S)-2-amino-4-fluoro-3-hydroxybutanoic acid|4-fluoro-L-threonine|4-fluorothreonine http://purl.obolibrary.org/obo/CHEBI_11986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:11987 biolink:ChemicalEntity 4-formylbenzenesulfonate An arenesulfonate that is the conjugate base of 4-formylbenzenesulfonic acid, obtained by deprotonation of the sulfonic acid group. umbbd.compound:c0303 Graph 4-formylbenzenesulfonate 4-formylbenzenesulfonate 4-formylbenzenesulfonate http://purl.obolibrary.org/obo/CHEBI_11987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:119915 biolink:ChemicalEntity fentanyl A monocarboxylic acid amide resulting from the formal condensation of the aryl amino group of N-phenyl-1-(2-phenylethyl)piperidin-4-amine with propanoic acid. cas:437-38-7|drugbank:DB00813|drugcentral:1164|kegg.drug:D00320|patent:FR1344366|patent:US3164600|pubmed:10669565|pubmed:10987438|pubmed:11585443|pubmed:14698188|pubmed:16621415|pubmed:18462178|pubmed:18728103|pubmed:30176422|pubmed:30305277|reaxys:494484|vsdb:1864|wikipedia.en:Fentanyl Graph 1-phenethyl-4-(N-phenylpropionamido)piperidine|1-phenethyl-4-N-propionylanilinopiperidine|Duragesic|N-(1-phenethyl-4-piperidinyl)-N-phenylpropionamide|N-(1-phenethyl-4-piperidyl)propionanilide|N-(1-phenethyl-piperidin-4-yl)-N-phenyl-propionamide|N-(1-phenethylpiperidin-4-yl)-N-phenylpropionamide|N-phenethyl-4-(N-propionylanilino)piperidine|N-phenyl-N-(1-(2-phenylethyl)-4-piperidinyl)propanamide|N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide|fentanilo|fentanyl|fentanylum|phentanyl N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide 1-phenethyl-4-(N-phenylpropionamido)piperidine|1-phenethyl-4-N-propionylanilinopiperidine|Duragesic|N-(1-phenethyl-4-piperidinyl)-N-phenylpropionamide|N-(1-phenethyl-4-piperidyl)propionanilide|N-(1-phenethyl-piperidin-4-yl)-N-phenyl-propionamide|N-(1-phenethylpiperidin-4-yl)-N-phenylpropionamide|N-phenethyl-4-(N-propionylanilino)piperidine|N-phenyl-N-(1-(2-phenylethyl)-4-piperidinyl)propanamide|N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide|fentanilo|fentanyl|fentanylum|phentanyl http://purl.obolibrary.org/obo/CHEBI_119915 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12040 biolink:ChemicalEntity 4-oxohex-2-enedioate An oxo dicarboxylate that is the conjugate base of 4-oxohex-2-enedioic acid. Graph 4-oxohex-2-enedioate 4-oxohex-2-enedioate http://purl.obolibrary.org/obo/CHEBI_12040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12060 biolink:ChemicalEntity 5'-deoxy-5'-fluoroadenosine beilstein:40576|drugbank:DB03716 Graph 5'-deoxy-5'-fluoroadenosine|5'-fluoro-5'-deoxyadenosine|6-amino-9-(5-deoxy-5-fluoro-beta-D-ribofuranosyl)-9H-purine|9-(5-deoxy-5-fluoro-beta-D-ribofuranosyl)-9H-purin-6-amine 5'-deoxy-5'-fluoroadenosine 5'-deoxy-5'-fluoroadenosine|5'-fluoro-5'-deoxyadenosine|6-amino-9-(5-deoxy-5-fluoro-beta-D-ribofuranosyl)-9H-purine|9-(5-deoxy-5-fluoro-beta-D-ribofuranosyl)-9H-purin-6-amine http://purl.obolibrary.org/obo/CHEBI_12060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12071 biolink:ChemicalEntity 5,10-methylenetetrahydrofolate(2-) Graph 5,10-methylenetetrahydrofolate|N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate 5,10-methylenetetrahydrofolate|N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate http://purl.obolibrary.org/obo/CHEBI_12071 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12109 biolink:ChemicalEntity 5-aminolevulinate beilstein:3937762 Graph 5-amino-4-oxopentanoate 5-amino-4-oxopentanoate 5-amino-4-oxopentanoate http://purl.obolibrary.org/obo/CHEBI_12109 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12113 biolink:ChemicalEntity 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate(3-) A tricarboxylic acid trianion that is the conjugate base of 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid. Graph 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate http://purl.obolibrary.org/obo/CHEBI_12113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:121196 biolink:ChemicalEntity reumycin A pyrimidotriazine that is 6-methyl-5,6,7,8-tetrahydropyrimido[5,4-e][1,2,4]triazine with oxo groups at positions 5 and 6. cas:5016-18-2|lincs.smallmolecule:LSM-32639|metacyc.compound:CPD-21062|pubmed:1656661|pubmed:3566230|pubmed:4026251|pubmed:4062279|pubmed:4322358|pubmed:4792066|pubmed:5907865|pubmed:6486750|reaxys:614208 Graph 1-demethyltoxoflavin|6-methyl-8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione|6-methyl-pyrimido-[5,4-e]-as-triazine-5,7(6H,8H)-dione|6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione|reumicine|reumitsin|reumycin|rheumycin|rheumygin 6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione 1-demethyltoxoflavin|6-methyl-8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione|6-methyl-pyrimido-[5,4-e]-as-triazine-5,7(6H,8H)-dione|6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione|reumicine|reumitsin|reumycin|rheumycin|rheumygin http://purl.obolibrary.org/obo/CHEBI_121196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12154 biolink:ChemicalEntity 5-oxohexanoate An oxo fatty acid anion that is the conjugate base of 5-oxohexanoic acid, arising from deprotonation of the carboxy group. Graph 4-acetylbutyrate|5-ketocaproate|5-ketohexanoate|5-oxohexanoate|delta-ketocaproate|delta-oxocaproate|gamma-acetylbutyrate 5-oxohexanoate 4-acetylbutyrate|5-ketocaproate|5-ketohexanoate|5-oxohexanoate|delta-ketocaproate|delta-oxocaproate|gamma-acetylbutyrate http://purl.obolibrary.org/obo/CHEBI_12154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12164 biolink:ChemicalEntity 5-phosphoribosyl diphosphate A ribose diphosphate carrying an additional phosphate group at position 5. Graph http://purl.obolibrary.org/obo/CHEBI_12164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12194 biolink:ChemicalEntity 6-(N-acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol The α-anomer of 6-(N-acetyl-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol. kegg.compound:C01288|kegg.glycan:G00143 Graph 6-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol|6-(N-Acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol 6-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol 6-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol|6-(N-Acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_12194 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12195 biolink:ChemicalEntity 6-O-(N-acetyl-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol Graph 6-O-(2-acetamido-2-deoxy-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol 6-O-(2-acetamido-2-deoxy-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol 6-O-(2-acetamido-2-deoxy-D-glucopyranosyl)-1-O-(3-sn-phosphatidyl)-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_12195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:122 biolink:ChemicalEntity (-)-usnic acid The (−)-enantiomer of usnic acid. beilstein:4719209|beilstein:96698|cas:6159-66-6|kegg.compound:C10101|knapsack:C00002413|lipidmaps:LMPK13060002|metacyc.compound:CPD-7411 Graph (-)-Usnic acid|(9bS)-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo[b,d]furan-1(9bH)-one|(S)-Usnic acid|(S)-usnate (9bS)-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo[b,d]furan-1(9bH)-one (-)-Usnic acid|(9bS)-2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo[b,d]furan-1(9bH)-one|(S)-Usnic acid|(S)-usnate http://purl.obolibrary.org/obo/CHEBI_122 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12256 biolink:ChemicalEntity 7-hydroxyisoflavone The simplest member of the class of 7-hydroxyisoflavones that is isoflavone with a hydroxy substituent at position 7. cas:13057-72-2|cba:568259|kegg.compound:C15615|patent:EP0941992|pubmed:16864424|pubmed:21562980|pubmed:22175340|reaxys:193534 Graph 4H-1-Benzopyran-4-one, 7-hydroxy-3-phenyl-|7-hydroxy-3-phenyl-4H-chromen-4-one 7-hydroxy-3-phenyl-4H-chromen-4-one 4H-1-Benzopyran-4-one, 7-hydroxy-3-phenyl-|7-hydroxy-3-phenyl-4H-chromen-4-one http://purl.obolibrary.org/obo/CHEBI_12256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12266 biolink:ChemicalEntity 8-amino-7-oxononanoate kegg.compound:C01092 Graph 8-Amino-7-oxononanoate|8-amino-7-oxononanoate 8-amino-7-oxononanoate 8-Amino-7-oxononanoate|8-amino-7-oxononanoate http://purl.obolibrary.org/obo/CHEBI_12266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1230 biolink:ChemicalEntity sophorose A glycosylglucose that is D-glucopyranose attached to a β-D-glucopyranosyl unit at position 2 via a glycosidic linkage. cas:20429-79-2|kegg.compound:C08250|knapsack:C00001149|metacyc.compound:CPD-13242|pubmed:14469205|pubmed:24655731|pubmed:39061|wikipedia.en:Sophorose Graph 2-O-beta-D-Glucopyranosyl-D-glucopyranose|2-O-beta-D-Glucopyranosyl-D-glucose|2-O-beta-D-glucopyranosyl-D-glucopyranose|2-O-beta-D-glucopyranosyl-D-glucose|Sophorose|beta-D-Glc-(1->2)-D-Glc|beta-D-glucopyranosyl-(1->2)-D-glucopyranose|sophorose 2-O-beta-D-glucopyranosyl-D-glucopyranose 2-O-beta-D-Glucopyranosyl-D-glucopyranose|2-O-beta-D-Glucopyranosyl-D-glucose|2-O-beta-D-glucopyranosyl-D-glucopyranose|2-O-beta-D-glucopyranosyl-D-glucose|Sophorose|beta-D-Glc-(1->2)-D-Glc|beta-D-glucopyranosyl-(1->2)-D-glucopyranose|sophorose http://purl.obolibrary.org/obo/CHEBI_1230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12336 biolink:ChemicalEntity alpha-cyclopiazonic acids Graph alpha-Cyclopiazonsaeure|alpha-Zyklopiazonsaeure alpha-Cyclopiazonsaeure|alpha-Zyklopiazonsaeure http://purl.obolibrary.org/obo/CHEBI_12336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1235 biolink:ChemicalEntity 2-methoxy-6-(all-trans-octaprenyl)phenol A 2-methoxy-6-(all-trans-polyprenyl)phenol in which the substituent at position 6 is an all-trans-octaprenyl moiety. kegg.compound:C05812|metacyc.compound:2-OCTAPRENYL-6-METHOXYPHENOL|pubmed:10419476|pubmed:8703953 Graph 2-Octaprenyl-6-methoxyphenol|2-methoxy-6-(all-trans-octaprenyl)phenol|2-methoxy-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]phenol|6-methoxy-2-octaprenylphenol 2-methoxy-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]phenol 2-Octaprenyl-6-methoxyphenol|2-methoxy-6-(all-trans-octaprenyl)phenol|2-methoxy-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]phenol|6-methoxy-2-octaprenylphenol http://purl.obolibrary.org/obo/CHEBI_1235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12350 biolink:ChemicalEntity beta-D-fructofuranose 2-phosphate The β-anomer of D-fructofuranose 2-phosphate. beilstein:1386343|cas:19046-69-6|kegg.compound:C03267 Graph 2-O-phosphono-beta-D-fructofuranose|2-phospho-beta-D-fructofuranose|beta-D-Fructofuranose 2-phosphate|beta-D-Fructose 2-phosphate|beta-D-fructofuranose 2-(dihydrogen phosphate) beta-D-fructofuranose 2-(dihydrogen phosphate) 2-O-phosphono-beta-D-fructofuranose|2-phospho-beta-D-fructofuranose|beta-D-Fructofuranose 2-phosphate|beta-D-Fructose 2-phosphate|beta-D-fructofuranose 2-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_12350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12387 biolink:ChemicalEntity beta-L-fucose 1-phosphate The β-anomer of L-fucose 1-phosphate. beilstein:1685243|cas:28553-11-9|kegg.compound:C02985 Graph 6-Deoxy-L-galactose 1-phosphate|6-deoxy-1-O-phosphono-beta-L-galactopyranose|6-deoxy-beta-L-galactopyranose 1-(dihydrogen phosphate)|Fucopyranosyl phosphate|Fucose 1-phosphate|beta-L-Fucose 1-phosphate|beta-L-fucopyranose 1-(dihydrogen phosphate) 6-deoxy-beta-L-galactopyranose 1-(dihydrogen phosphate)|beta-L-fucopyranose 1-(dihydrogen phosphate) 6-Deoxy-L-galactose 1-phosphate|6-deoxy-1-O-phosphono-beta-L-galactopyranose|6-deoxy-beta-L-galactopyranose 1-(dihydrogen phosphate)|Fucopyranosyl phosphate|Fucose 1-phosphate|beta-L-Fucose 1-phosphate|beta-L-fucopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_12387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12427 biolink:ChemicalEntity N,N'-diacetylchitobiosyldiphosphodolichol kegg.compound:C04537|kegg.glycan:G00002 Graph N,N'-Diacetylchitobiosyldiphosphodolichol N,N'-Diacetylchitobiosyldiphosphodolichol http://purl.obolibrary.org/obo/CHEBI_12427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:124938 biolink:ChemicalEntity 2-propyl-2-pentenoic acid lincs.smallmolecule:LSM-36397 Graph http://purl.obolibrary.org/obo/CHEBI_124938 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:124939 biolink:ChemicalEntity N-[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine A glycine derivative that is glycine in which one of the hydrogens of the amino group is substituted by a 2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl group. lincs.smallmolecule:LSM-44954 Graph 2-[2-methoxy-5-[2-(2,4,6-trimethoxyphenyl)ethenylsulfonylmethyl]anilino]acetic acid|N-[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine|[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetic acid N-[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine 2-[2-methoxy-5-[2-(2,4,6-trimethoxyphenyl)ethenylsulfonylmethyl]anilino]acetic acid|N-[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine|[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetic acid http://purl.obolibrary.org/obo/CHEBI_124939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:124991 biolink:ChemicalEntity cefalotin A semisynthetic, first-generation cephalosporin antibiotic with acetoxymethyl and (2-thienylacetyl)nitrilo moieties at positions 3 and 7, respectively, of the core structure. Administered parenterally during surgery and to treat a wide spectrum of blood infections. beilstein:945586|cas:153-61-7|drugbank:DB00456|drugcentral:574|hmdb:HMDB0014599|kegg.compound:C07761|kegg.drug:D07635|lincs.smallmolecule:LSM-15184|patent:FR1384197|patent:US3218318|pdb-ccd:CLS|pubmed:10930630|pubmed:12569987|pubmed:12833570|pubmed:1384868|pubmed:13963283|pubmed:1701026|pubmed:2083978|pubmed:23472927|pubmed:23680238|pubmed:29017833|pubmed:6176550|reaxys:945586|wikipedia.en:Cephalothin Graph (6R,7R)-3-(acetoxymethyl)-8-oxo-7-(thiophen-2-ylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-Acetoxymethyl-7-(2-thienylacetamido)-3-cephem-4-carboxylic acid|7-(2'-thienylacetamido)cephalosporanic acid|7-(2-Thienylacetamido)cephalosporanic acid|7-(Thiophene-2-acetamido)cephalosporin|7beta-(thiophen-2-ylacetamido)-3-acetoxymethyl-3,4-didehydrocepham-4-carboxylic acid|CEPHALOTHIN|CET|Cefalothin|Cefalotin|Cephalothin|Cephalotin|cefalotin|cefalotina|cefalotine|cefalotinum (6R,7R)-3-(acetoxymethyl)-8-oxo-7-(thiophen-2-ylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|7beta-(thiophen-2-ylacetamido)-3-acetoxymethyl-3,4-didehydrocepham-4-carboxylic acid (6R,7R)-3-(acetoxymethyl)-8-oxo-7-(thiophen-2-ylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-Acetoxymethyl-7-(2-thienylacetamido)-3-cephem-4-carboxylic acid|7-(2'-thienylacetamido)cephalosporanic acid|7-(2-Thienylacetamido)cephalosporanic acid|7-(Thiophene-2-acetamido)cephalosporin|7beta-(thiophen-2-ylacetamido)-3-acetoxymethyl-3,4-didehydrocepham-4-carboxylic acid|CEPHALOTHIN|CET|Cefalothin|Cefalotin|Cephalothin|Cephalotin|cefalotin|cefalotina|cefalotine|cefalotinum http://purl.obolibrary.org/obo/CHEBI_124991 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:125204 biolink:ChemicalEntity 4-guanidinobenzoic acid Benzoic acid substituted at the para position by a guanidino group. cas:16060-65-4|drugbank:DB02459|patent:JP2004284982|pdb-ccd:GBS|pubmed:10848923|pubmed:1144503|pubmed:28166217|reaxys:2369015 Graph 4-Guanidino-benzoic acid|4-carbamimidamidobenzoic acid|p-guanidinobenzoic acid 4-carbamimidamidobenzoic acid 4-Guanidino-benzoic acid|4-carbamimidamidobenzoic acid|p-guanidinobenzoic acid http://purl.obolibrary.org/obo/CHEBI_125204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:125354 biolink:ChemicalEntity plerixafor An azamacrocycle consisting of two cyclam rings connected by a 1,4-phenylenebis(methylene) linker. It is a CXCR4 chemokine receptor antagonist and a hematopoietic stem cell mobilizer. It is used in combination with grulocyte-colony stimulating factor (G-CSF) to mobilize hematopoietic stem cells to the perpheral blood for collection and subsequent autologous transplantation in patients with non-Hodgkin's lymphoma and multiple myeloma. cas:110078-46-1|drugbank:DB06809|drugcentral:4410|hmdb:HMDB0015681|kegg.drug:D08971|lincs.smallmolecule:LSM-36826|pubmed:17324009|pubmed:18847313|pubmed:24179472|pubmed:26106388|pubmed:26154069|pubmed:26600122|pubmed:27575003|pubmed:28411174|pubmed:29461034|pubmed:30037618|pubmed:30290049|pubmed:30422351|pubmed:30776910|pubmed:7913308|wikipedia.en:Plerixafor Graph 1,1'-(benzene-1,4-diyldimethanediyl)bis(1,4,8,11-tetraazacyclotetradecane)|1,1'-[1,4-phenylenebis(methylene)]bis(1,4,8,11-tetraazacyclotetradecane)|1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane|AMD 3100|AMD-3100|AMD3100|JKL 169|JM3100|Mozobil|SDZ SID 791|plerixafor|plerixaforum 1,1'-(benzene-1,4-diyldimethanediyl)bis(1,4,8,11-tetraazacyclotetradecane) 1,1'-(benzene-1,4-diyldimethanediyl)bis(1,4,8,11-tetraazacyclotetradecane)|1,1'-[1,4-phenylenebis(methylene)]bis(1,4,8,11-tetraazacyclotetradecane)|1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane|AMD 3100|AMD-3100|AMD3100|JKL 169|JM3100|Mozobil|SDZ SID 791|plerixafor|plerixaforum http://purl.obolibrary.org/obo/CHEBI_125354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:125372 biolink:ChemicalEntity 1-methyl-1,2,3,4-tetrahydroisoquinoline lincs.smallmolecule:LSM-36851 Graph http://purl.obolibrary.org/obo/CHEBI_125372 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:125498 biolink:ChemicalEntity 1,2,3,4-tetrahydroisoquinoline hmdb:HMDB0012489|lincs.smallmolecule:LSM-37002 Graph http://purl.obolibrary.org/obo/CHEBI_125498 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:125616 biolink:ChemicalEntity 3-[2-(4-fluorophenyl)ethylamino]-1-methyl-4-(2-methyl-1H-indol-3-yl)pyrrole-2,5-dione lincs.smallmolecule:LSM-37170 Graph http://purl.obolibrary.org/obo/CHEBI_125616 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:126237 biolink:ChemicalEntity enprofylline Xanthine bearing a propyl substituent at position 3. A bronchodilator, it is used for the symptomatic treatment of asthma and chronic obstructive pulmonary disease, and in the management of cerebrovascular insufficiency, sickle cell disease, and diabetic neuropathy. beilstein:4189165|cas:41078-02-8|drugbank:DB00824|drugcentral:1015|kegg.drug:D04006 Graph 3,7-dihydro-3-propyl-1H-purine-2,6-dione|3-Propyl-3,7-dihydro-purine-2,6-dione|3-n-propylxanthine|3-propyl-3,7-dihydro-1H-purine-2,6-dione|3-propylxanthine|Enprofylline|enprofilina|enprofylline|enprofyllinum 3-propyl-3,7-dihydro-1H-purine-2,6-dione 3,7-dihydro-3-propyl-1H-purine-2,6-dione|3-Propyl-3,7-dihydro-purine-2,6-dione|3-n-propylxanthine|3-propyl-3,7-dihydro-1H-purine-2,6-dione|3-propylxanthine|Enprofylline|enprofilina|enprofylline|enprofyllinum http://purl.obolibrary.org/obo/CHEBI_126237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1269 biolink:ChemicalEntity 2-polyprenylphenol A member of the class of phenols that is phenol in which the hydrogen at position 2 is replaced by a polyprenyl group. kegg.compound:C05807|metacyc.compound:2-Polyprenyl-Phenol|pubmed:17889824 Graph 2-(polyprenyl)phenol|a 2-polyprenylphenol 2-(polyprenyl)phenol|a 2-polyprenylphenol http://purl.obolibrary.org/obo/CHEBI_1269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:127342 biolink:ChemicalEntity atomoxetine A secondary amino compound having methyl and 3-(2-methylphenoxy)-3-phenylpropan-1-yl substituents. cas:83015-26-3|drugbank:DB00289|drugcentral:256|hmdb:HMDB0014434|kegg.drug:D07473|lincs.smallmolecule:LSM-2452|pubmed:15338851|pubmed:23048018|reaxys:4318684|wikipedia.en:Atomoxetine Graph (-)-Tomoxetine|(3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine|Tomoxetina|Tomoxetinum|atomoxetine|tomoxetine (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine (-)-Tomoxetine|(3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine|Tomoxetina|Tomoxetinum|atomoxetine|tomoxetine http://purl.obolibrary.org/obo/CHEBI_127342 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12755 biolink:ChemicalEntity indol-3-ylacetyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of indol-3-ylacetic acid. kegg.compound:C15489 Graph 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|S-(indol-3-ylacetyl)-CoA|S-(indol-3-ylacetyl)-coenzyme A|S-2-(indol-3-yl)acetyl-CoA|indol-3-ylacetyl-coenzyme A 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(1H-indol-3-ylacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|S-(indol-3-ylacetyl)-CoA|S-(indol-3-ylacetyl)-coenzyme A|S-2-(indol-3-yl)acetyl-CoA|indol-3-ylacetyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_12755 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12777 biolink:ChemicalEntity vitamin A Any member of a group of fat-soluble retinoids produced via metabolism of provitamin A carotenoids that exhibit biological activity against vitamin A deficiency. Vitamin A is involved in immune function, vision, reproduction, and cellular communication. metacyc.compound:Vitamin-A|wikipedia.en:Vitamin_A Graph vitamin A vitamer|vitamin A vitamers|vitamin-A|vitamins A vitamin A vitamer|vitamin A vitamers|vitamin-A|vitamins A http://purl.obolibrary.org/obo/CHEBI_12777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:127780 biolink:ChemicalEntity phosphonoformic acid Phosphoric acid in which one of the hydroxy groups is replaced by a carboxylic acid group. It is used as the trisodium salt as an antiviral agent in the treatment of cytomegalovirus retinitis (CMV retinitis, an inflamation of the retina that can lead to blindness) and as an alternative to ganciclovir for AIDS patients who require concurrent antiretroviral therapy but are unable to tolerate ganciclovir due to haematological toxicity. cas:4428-95-9|drugbank:DB00529|drugcentral:1241|hmdb:HMDB0014670|kegg.compound:C06456|knapsack:C00000800|pdb-ccd:PPF|pubmed:11576919|pubmed:15182735|pubmed:16858125|pubmed:19213941|pubmed:19288498|pubmed:21056575|pubmed:21566148|pubmed:7518199|reaxys:1756501|wikipedia.en:Foscarnet Graph FOSCARNET|Foscarmet|Foscarnet|PHOSPHONOFORMIC ACID|carboxyphosphonic acid|dihydroxyphosphanecarboxylic acid oxide|foscarnet|phosphonomethanoic acid dihydroxyphosphanecarboxylic acid oxide FOSCARNET|Foscarmet|Foscarnet|PHOSPHONOFORMIC ACID|carboxyphosphonic acid|dihydroxyphosphanecarboxylic acid oxide|foscarnet|phosphonomethanoic acid http://purl.obolibrary.org/obo/CHEBI_127780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12834 biolink:ChemicalEntity n-alkanal An aliphatic aldehyde obtained by formal oxygenation of one of the terminal methyl groups of any straight-chain alkane. Graph an n-alkanal an n-alkanal http://purl.obolibrary.org/obo/CHEBI_12834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:128458 biolink:ChemicalEntity disodium cromoglycate An organic sodium salt that is the disodium salt of cromoglycic acid. beilstein:3647577|cas:15826-37-6|kegg.drug:D00526|pubmed:12001789|pubmed:19107959|pubmed:26176755|pubmed:26656593|pubmed:26871132|pubmed:26964003|pubmed:3128591 Graph Cromoglycate disodium|Cromolyn sodium|DSCG|Dinatrium salz von 1,3-bis-(2-carboxychromon-5-yloxy)-2-hydroxypropan|Disodium 5,5'-((2-hydroxytrimethylene)bis(oxy))bis(4-oxo-4H-1-benzopyran-2-carboxylate)|FPL-670|Natrium cromoglicat|Sodium cromoglicate|Sodium cromoglycate|Sodium cromolyn|Sodium salt of 5-[3-(2-carboxy-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy]-4-oxo-4H-2-chromenecarboxylic acid|disodium 5,5'-[(2-hydroxypropane-1,3-diyl)bis(oxy)]bis(4-oxo-4H-chromene-2-carboxylate)|disodium 5-[3-(2-carboxylato-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy]-4-oxo-4H-2-chromenecarboxylate|disodium 5-{3-[(2-carboxylato-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate|disodium cromoglycate disodium 5,5'-[(2-hydroxypropane-1,3-diyl)bis(oxy)]bis(4-oxo-4H-chromene-2-carboxylate) Cromoglycate disodium|Cromolyn sodium|DSCG|Dinatrium salz von 1,3-bis-(2-carboxychromon-5-yloxy)-2-hydroxypropan|Disodium 5,5'-((2-hydroxytrimethylene)bis(oxy))bis(4-oxo-4H-1-benzopyran-2-carboxylate)|FPL-670|Natrium cromoglicat|Sodium cromoglicate|Sodium cromoglycate|Sodium cromolyn|Sodium salt of 5-[3-(2-carboxy-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy]-4-oxo-4H-2-chromenecarboxylic acid|disodium 5,5'-[(2-hydroxypropane-1,3-diyl)bis(oxy)]bis(4-oxo-4H-chromene-2-carboxylate)|disodium 5-[3-(2-carboxylato-4-oxo-4H-5-chromenyloxy)-2-hydroxypropoxy]-4-oxo-4H-2-chromenecarboxylate|disodium 5-{3-[(2-carboxylato-4-oxo-4H-chromen-5-yl)oxy]-2-hydroxypropoxy}-4-oxo-4H-chromene-2-carboxylate|disodium cromoglycate http://purl.obolibrary.org/obo/CHEBI_128458 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12855 biolink:ChemicalEntity (1S,2S)-cyclohexa-3,5-diene-1,2-diol beilstein:2324500|beilstein:4658202 Graph (1S,2S)-1,2-dihydrobenzene-1,2-diol|(1S,2S)-cyclohexa-3,5-diene-1,2-diol (1S,2S)-cyclohexa-3,5-diene-1,2-diol (1S,2S)-1,2-dihydrobenzene-1,2-diol|(1S,2S)-cyclohexa-3,5-diene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_12855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12875 biolink:ChemicalEntity trans-2-coumarate The trans-isomer of 2-coumarate. gmelin:1342074 Graph (2E)-3-(2-hydroxyphenyl)acrylate|(2E)-3-(2-hydroxyphenyl)prop-2-enoate|trans-2-coumarate (2E)-3-(2-hydroxyphenyl)prop-2-enoate (2E)-3-(2-hydroxyphenyl)acrylate|(2E)-3-(2-hydroxyphenyl)prop-2-enoate|trans-2-coumarate http://purl.obolibrary.org/obo/CHEBI_12875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:128753 biolink:ChemicalEntity (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate(3-) An organophosphate oxoanion that is the trianion of (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate arising from deprotonation of the three OH groups of the diphosphate. pubmed:12657258|reaxys:9274408 Graph (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate|(2E)-4-hydroxy-3-methylbut-2-enyl diphosphate trianion|(2E)-4-hydroxy-3-methylbut-2-enyl pyrophosphate(3-)|(E)-4-hydroxy-3-methyl-but-2-enyl pyrophosphate|HMBPP (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate|(2E)-4-hydroxy-3-methylbut-2-enyl diphosphate trianion|(2E)-4-hydroxy-3-methylbut-2-enyl pyrophosphate(3-)|(E)-4-hydroxy-3-methyl-but-2-enyl pyrophosphate|HMBPP http://purl.obolibrary.org/obo/CHEBI_128753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12876 biolink:ChemicalEntity trans-4-coumarate The trans-isomer of 4-coumarate. gmelin:2148756|metacyc.compound:COUMARATE|reaxys:5513651 Graph (2E)-3-(4-hydroxyphenyl)acrylate|(2E)-3-(4-hydroxyphenyl)prop-2-enoate|(E)-4-coumarate|trans-p-coumarate (2E)-3-(4-hydroxyphenyl)prop-2-enoate (2E)-3-(4-hydroxyphenyl)acrylate|(2E)-3-(4-hydroxyphenyl)prop-2-enoate|(E)-4-coumarate|trans-p-coumarate http://purl.obolibrary.org/obo/CHEBI_12876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:128769 biolink:ChemicalEntity isopentenyl diphosphate(3-) An organophosphate oxoanion that is the trianion of isopentenyl diphosphate arising from deprotonation of the three OH groups of the diphosphate. pubmed:12657258|pubmed:9873578|reaxys:1824090 Graph 3-methylbut-3-en-1-yl diphosphate|3-methylbut-3-enyl diphosphate|3-methylbut-3-enyl diphosphate trianion|3-methylbut-3-enyl pyrophosphate|isopentenyl diphosphate|isopentenyl pyrophosphate 3-methylbut-3-en-1-yl diphosphate 3-methylbut-3-en-1-yl diphosphate|3-methylbut-3-enyl diphosphate|3-methylbut-3-enyl diphosphate trianion|3-methylbut-3-enyl pyrophosphate|isopentenyl diphosphate|isopentenyl pyrophosphate http://purl.obolibrary.org/obo/CHEBI_128769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12886 biolink:ChemicalEntity (R)-4'-phosphopantothenate(1-) Graph 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoate 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoate 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoate http://purl.obolibrary.org/obo/CHEBI_12886 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12931 biolink:ChemicalEntity D-galactonate A galactonate compound having D-configuration. kegg.compound:C00880 Graph D-Galactonate|D-galactonate D-galactonate D-Galactonate|D-galactonate http://purl.obolibrary.org/obo/CHEBI_12931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12936 biolink:ChemicalEntity D-galactose Graph D-Gal|D-galacto-hexose|D-galactose D-galacto-hexose|D-galactose D-Gal|D-galacto-hexose|D-galactose http://purl.obolibrary.org/obo/CHEBI_12936 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12937 biolink:ChemicalEntity D-galactose 6-phosphate Graph D-galactose 6-(dihydrogen phosphate) D-galactose 6-(dihydrogen phosphate) D-galactose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_12937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1294 biolink:ChemicalEntity (20R,22R)-20,22-dihydroxycholesterol An oxysterol that is cholesterol substituted by hydroxy groups at positions 20 and 22 (the 20R,22R-stereoisomer). cas:596-94-1|hmdb:HMDB0006763|kegg.compound:C05501|lipidmaps:LMST01010200|metacyc.compound:20A-20B-DIHYDROXY-CHOLESTEROL|reaxys:2339391 Graph (20R,22R)-20,22-Dihydroxycholesterol|(20R,22R)-20,22-dihydroxycholesterol|(22R)-20alpha,22-Dihydroxycholesterol|(22R)-cholest-5-ene-3beta,20,22-triol|20,22-Dihydroxycholesterol|20alpha,22R-Dihydroxycholesterol|20alpha,22beta-Dihydroxycholesterol (22R)-cholest-5-ene-3beta,20,22-triol (20R,22R)-20,22-Dihydroxycholesterol|(20R,22R)-20,22-dihydroxycholesterol|(22R)-20alpha,22-Dihydroxycholesterol|(22R)-cholest-5-ene-3beta,20,22-triol|20,22-Dihydroxycholesterol|20alpha,22R-Dihydroxycholesterol|20alpha,22beta-Dihydroxycholesterol http://purl.obolibrary.org/obo/CHEBI_1294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12952 biolink:ChemicalEntity aldehydo-D-galacturonate kegg.compound:C00333 Graph D-Galacturonate|D-galacturonate|aldehydo-D-galacturonate D-galacturonate D-Galacturonate|D-galacturonate|aldehydo-D-galacturonate http://purl.obolibrary.org/obo/CHEBI_12952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:12962 biolink:ChemicalEntity D-glucosamine 6-phosphate A glucosamine phosphate that is D-glucosamine substituted by a phosphate group at position 6. hmdb:HMDB0001254|pubmed:11270676 Graph 2-amino-2-deoxy-6-O-phosphono-D-glucose|2-amino-2-deoxy-D-glucose 6-(dihydrogen phosphate) 2-amino-2-deoxy-D-glucose 6-(dihydrogen phosphate) 2-amino-2-deoxy-6-O-phosphono-D-glucose|2-amino-2-deoxy-D-glucose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_12962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1301 biolink:ChemicalEntity (22S)-22-hydroxycholesterol An oxysterol that is the 22S-hydroxy derivative of cholesterol. cas:22348-64-7 Graph (22S)-22-hydroxycholesterol|(22S)-cholest-5-ene-3beta,22-diol|(3beta,22S)-Cholest-5-ene-3,22-diol (22S)-cholest-5-ene-3beta,22-diol (22S)-22-hydroxycholesterol|(22S)-cholest-5-ene-3beta,22-diol|(3beta,22S)-Cholest-5-ene-3,22-diol http://purl.obolibrary.org/obo/CHEBI_1301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:130181 biolink:ChemicalEntity calmodulin antagonist An antagonist that interferes with the action of the calcium-binding messenger protein calmodulin. pubmed:26717596 Graph http://purl.obolibrary.org/obo/CHEBI_130181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13022 biolink:ChemicalEntity keto-D-sorbose beilstein:1724559|cas:3615-56-3 Graph (3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one|keto-D-sorbose keto-D-sorbose (3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one|keto-D-sorbose http://purl.obolibrary.org/obo/CHEBI_13022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13043 biolink:ChemicalEntity 3-amino-L-alaninate Graph (2S)-2,3-diaminopropanoate|3-amino-L-alaninate (2S)-2,3-diaminopropanoate|3-amino-L-alaninate (2S)-2,3-diaminopropanoate|3-amino-L-alaninate http://purl.obolibrary.org/obo/CHEBI_13043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1307 biolink:ChemicalEntity 24-methylenecycloartanol A pentacyclic triterpenoid that is (9β)-24-methylene-9,19-cyclolanostane which carries a hydroxy group at position 3β. It is isolated from several plant species including Euphorbia, Epidendrum, Psychotria and Sideritis. cas:1449-09-8|foodb.food:FDB014438|kegg.compound:C08830|knapsack:C00003661|lipidmaps:LMST01100001|metacyc.compound:CPD-696|pubmed:10691725|pubmed:13573499|pubmed:14622971|pubmed:17265335|pubmed:17337022|pubmed:17691046|pubmed:28480734|pubmed:4651646 Graph (3beta,9beta)-24-methylene-9,19-cyclolanostan-3-ol|24(28)-methylenecycloartanol|24-methylene cycloartanol|24-methylene-9beta,19-cyclo-lanostan-3beta-ol|24-methylene-9beta,19-cyclolanostan-3beta-ol|24-methylene-cycloartanol|24-methylenecycloartan-3beta-ol|24-methylenecycloartanol 24-methylene-9beta,19-cyclolanostan-3beta-ol (3beta,9beta)-24-methylene-9,19-cyclolanostan-3-ol|24(28)-methylenecycloartanol|24-methylene cycloartanol|24-methylene-9beta,19-cyclo-lanostan-3beta-ol|24-methylene-9beta,19-cyclolanostan-3beta-ol|24-methylene-cycloartanol|24-methylenecycloartan-3beta-ol|24-methylenecycloartanol http://purl.obolibrary.org/obo/CHEBI_1307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13086 biolink:ChemicalEntity L-aspartate 4-semialdehyde An α-amino-acid anion that is the conjugate base of L-aspartic 4-semialdehyde, arising from deprotonation of the carboxy group. kegg.compound:C00441 Graph (2S)-2-amino-4-oxobutanoate|Aspartate beta-semialdehyde|L-Aspartate 4-semialdehyde (2S)-2-amino-4-oxobutanoate (2S)-2-amino-4-oxobutanoate|Aspartate beta-semialdehyde|L-Aspartate 4-semialdehyde http://purl.obolibrary.org/obo/CHEBI_13086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:130910 biolink:ChemicalEntity (Z)-3-(4-iodophenyl)-2-mercaptoacrylic acid An organoiodine compound that is acrylic acid in which the vinylic hydrogens at positions 2 and 3 are replaced by mercapto and 4-iodophenyl groups respectively (the Z geoisomer). cas:179528-45-1|pubmed:25358543|pubmed:25546626|pubmed:25714701|pubmed:25813209|pubmed:25820375|pubmed:25874633|pubmed:26091952|pubmed:26138287|pubmed:26183016|pubmed:26269309|pubmed:26297661|pubmed:26974350|reaxys:10069045 Graph (2Z )-3-(4-iodophenyl)-2-sulfanylprop-2-enoic acid|3-(4-Iodophenyl)-2-mercapto-(Z)-2-propenoic acid|4'-iodo-2-mercaptocinnamic acid|PD 150,606|PD 150606|PD-150,606|PD-150606|PD150606 (2Z )-3-(4-iodophenyl)-2-sulfanylprop-2-enoic acid (2Z )-3-(4-iodophenyl)-2-sulfanylprop-2-enoic acid|3-(4-Iodophenyl)-2-mercapto-(Z)-2-propenoic acid|4'-iodo-2-mercaptocinnamic acid|PD 150,606|PD 150606|PD-150,606|PD-150606|PD150606 http://purl.obolibrary.org/obo/CHEBI_130910 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13115 biolink:ChemicalEntity L-gulonate The L-enantiomer of gulonate. kegg.compound:C00800 Graph Gulonate|L-Gulonate|L-gulonate L-gulonate Gulonate|L-Gulonate|L-gulonate http://purl.obolibrary.org/obo/CHEBI_13115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131174 biolink:ChemicalEntity navitoclax A N-sulfonylcarboxamide resulting from the formal condensation of the carboxy group of 4-{4-[(4'-chloro-4,4-dimethyl-3,4,5,6-tetrahydro[biphenyl]-2-yl)methyl]piperazin-1-yl}benzoic acid with the amino group of 4-{[(2R)-4-(morpholin-4-yl)-1-(phenylsulfanyl)butan-2-yl]amino}-3-[(trifluoromethyl)sulfonyl]benzenesulfonamide. It is a BH3-mimetic drug which targets the anti-apoptotic B-cell lymphoma-2 (BCL-2) family proteins, including BCL-2, BCL-xL, and BCL-w, and induces apoptosis in cancer cells. Currently under clinical investigation as treatment for solid tumors and hematologic malignancies. cas:923564-51-6|chemspider:21864722|drugbank:DB12340|kegg.drug:D09935|lincs.smallmolecule:LSM-42776|lincs.smallmolecule:LSM-4738|pdb-ccd:1XJ|pmc:PMC6011937|pubmed:18085673|pubmed:23291630|pubmed:26575826|pubmed:26958630|pubmed:28713162|pubmed:28947240|pubmed:29156797|pubmed:29237758|pubmed:29580266|pubmed:29753379|pubmed:29913235|pubmed:30224339|pubmed:30614795|pubmed:30721730|pubmed:30919222|pubmed:31276572|pubmed:31367332|pubmed:31399555|pubmed:31459977|pubmed:32247610|pubmed:32337074|pubmed:32446890|pubmed:32509782|pubmed:32611834|pubmed:32652830|pubmed:32675749|pubmed:32687646|wikipedia.en:Navitoclax Graph 4-{4-[(4'-chloro-4,4-dimethyl-3,4,5,6-tetrahydro[biphenyl]-2-yl)methyl]piperazin-1-yl}-N-[(4-{[(2R)-4-(morpholin-4-yl)-1-(phenylsulfanyl)butan-2-yl]amino}-3-[(trifluoromethyl)sulfonyl]phenyl)sulfonyl]benzamide|A-855071.0|ABT 263|ABT-263|ABT263|navitoclax|navitoclaxum 4-{4-[(4'-chloro-4,4-dimethyl-3,4,5,6-tetrahydro[biphenyl]-2-yl)methyl]piperazin-1-yl}-N-[(4-{[(2R)-4-(morpholin-4-yl)-1-(phenylsulfanyl)butan-2-yl]amino}-3-[(trifluoromethyl)sulfonyl]phenyl)sulfonyl]benzamide 4-{4-[(4'-chloro-4,4-dimethyl-3,4,5,6-tetrahydro[biphenyl]-2-yl)methyl]piperazin-1-yl}-N-[(4-{[(2R)-4-(morpholin-4-yl)-1-(phenylsulfanyl)butan-2-yl]amino}-3-[(trifluoromethyl)sulfonyl]phenyl)sulfonyl]benzamide|A-855071.0|ABT 263|ABT-263|ABT263|navitoclax|navitoclaxum http://purl.obolibrary.org/obo/CHEBI_131174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131183 biolink:ChemicalEntity N(gamma)-nitro-L-arginine methyl ester(1+) An organic cation that is the conjugate acid of Nγ-nitro-L-arginine methyl ester Graph http://purl.obolibrary.org/obo/CHEBI_131183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131186 biolink:ChemicalEntity IP3 receptor antagonist An antagonist that binds to and deactivates IP3 receptors. wikipedia.en:Inositol_trisphosphate_receptor Graph D-myo-inositol 1,4,5-trisphosphate receptor antagonist|D-myo-inositol 1,4,5-trisphosphate receptor antagonists|IP3 antagonist|IP3 antagonists|IP3 receptor antagonists|InsP3R antagonist|InsP3R antagonists|inositol trisphosphate receptor antagonist|inositol trisphosphate receptor antagonists D-myo-inositol 1,4,5-trisphosphate receptor antagonist|D-myo-inositol 1,4,5-trisphosphate receptor antagonists|IP3 antagonist|IP3 antagonists|IP3 receptor antagonists|InsP3R antagonist|InsP3R antagonists|inositol trisphosphate receptor antagonist|inositol trisphosphate receptor antagonists http://purl.obolibrary.org/obo/CHEBI_131186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131198 biolink:ChemicalEntity (Z)-1,2-ethenediol A diol that is ethene substituted at positions 1 and 2 by hydroxy groups (the Z-geoisomer). cas:65144-74-3|reaxys:1918635 Graph (Z)-ethene-1,2-diol|cis-1,2-Ethenediol (Z)-ethene-1,2-diol (Z)-ethene-1,2-diol|cis-1,2-Ethenediol http://purl.obolibrary.org/obo/CHEBI_131198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131327 biolink:ChemicalEntity amodiaquine(1+) An organic cation obtained by protonation of the tertiary amino group of amodiaquine; major species at pH 7.3. pubmed:26427316 Graph amodiaquine|amodiaquine cation amodiaquine|amodiaquine cation http://purl.obolibrary.org/obo/CHEBI_131327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131337 biolink:ChemicalEntity tricaine(1+) An organic cation obtained by protonation of the anilino function of tricaine. Graph 3-(ethoxycarbonyl)anilinium|tricaine cation 3-(ethoxycarbonyl)anilinium|tricaine cation http://purl.obolibrary.org/obo/CHEBI_131337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131358 biolink:ChemicalEntity BAY 60-6583 A member of the class of cyanopyridines that is 6-amino-3,5-dicyano-4-(4-hydroxyphenyl)-2-sulfanylpyridine in which the hydroxy and sulfanyl hydrogens are replaced by cyclopropylmethyl and carboxamidomethyl groups respectively. cas:910487-58-0|pubmed:24633424|pubmed:25704806|pubmed:25728851|pubmed:26161239|pubmed:26447087|reaxys:15017054|wikipedia.en:BAY_60-6583 Graph 2-({6-amino-3,5-dicyano-4-[4-(cyclopropylmethoxy)phenyl]pyridin-2-yl}sulfanyl)acetamide 2-({6-amino-3,5-dicyano-4-[4-(cyclopropylmethoxy)phenyl]pyridin-2-yl}sulfanyl)acetamide 2-({6-amino-3,5-dicyano-4-[4-(cyclopropylmethoxy)phenyl]pyridin-2-yl}sulfanyl)acetamide http://purl.obolibrary.org/obo/CHEBI_131358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131359 biolink:ChemicalEntity adenosine A2B receptor agonist An agonist at the A2B receptor. Graph A2B agonist|A2B agonists|A2B receptor agonist|A2B receptor agonists|adenosine A2B receptor agonists A2B agonist|A2B agonists|A2B receptor agonist|A2B receptor agonists|adenosine A2B receptor agonists http://purl.obolibrary.org/obo/CHEBI_131359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131367 biolink:ChemicalEntity 3-hydroxy-3-butenoic acid A 3-hydroxymonocarboxylic acid that is the 3-hydroxy derivative of 3-butenoic acid. chemspider:8637633 Graph 3-hydroxybut-3-enoic acid 3-hydroxybut-3-enoic acid 3-hydroxybut-3-enoic acid http://purl.obolibrary.org/obo/CHEBI_131367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131401 biolink:ChemicalEntity hexopyranosyl hexopyranoside A disaccharide formed by a (1↔1)-glycosidic bond between two hexopyranose units. Graph hexopyranosyl hexopyranoside hexopyranosyl hexopyranoside hexopyranosyl hexopyranoside http://purl.obolibrary.org/obo/CHEBI_131401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131429 biolink:ChemicalEntity carcinine A β-alanine derivative that is the amide obtained by formal condensation of the carboxy group of β-alanine with the primary amino group of histamine. cas:56897-53-1|hmdb:HMDB0249666|pubmed:15466447|pubmed:15541487|pubmed:16388826|pubmed:18069895|pubmed:20863274|pubmed:21756141|pubmed:21793899|pubmed:2214737|pubmed:2250571|pubmed:22577078|pubmed:2302959|pubmed:2421673|pubmed:24220875|pubmed:26372004|pubmed:26653853|pubmed:26713872|pubmed:26765065|pubmed:26923590|pubmed:30693765|pubmed:35716886|pubmed:6159857|pubmed:71093|pubmed:7820088|pubmed:7998987|pubmed:8298483|pubmed:8968274|reaxys:6804743 Graph N-[2-(1H-imidazol-4-yl)ethyl]-beta-alaninamide|beta-Alanylhistamine|beta-alaninylhistamine|beta-alanyl-histamine N-[2-(1H-imidazol-4-yl)ethyl]-beta-alaninamide N-[2-(1H-imidazol-4-yl)ethyl]-beta-alaninamide|beta-Alanylhistamine|beta-alaninylhistamine|beta-alanyl-histamine http://purl.obolibrary.org/obo/CHEBI_131429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131444 biolink:ChemicalEntity guanidinoacetate A monocarboxylic acid anion that is the conjugate base of guanidinoacetic acid, obtained by deprotonation of the carboxy group. chemspider:18748017 Graph carbamimidamidoacetate carbamimidamidoacetate carbamimidamidoacetate http://purl.obolibrary.org/obo/CHEBI_131444 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131487 biolink:ChemicalEntity 1,2-diacyl-3-(alpha-D-6-sulfoquinovosyl)-sn-glycerol(1-) An organosulfonate oxoanion obtained by deprotonation of the sulfo group of any 1,2-diacyl-3-(6-deoxy-6-sulfo-α-D-glucopyranosyl)-sn-glycerol; major species at pH 7.3. metacyc.compound:SULFOQUINOVOSYLDIACYLGLYCEROL Graph 1,2-di-O-acyl-3-O-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl)-sn-glycerol(1-)|1,2-diacyl-3-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl)-sn-glycerol(1-)|SQDG|a 6-sulfo-alpha-D-quinovosyldiacylglycerol|sulfoquinovosyldiacylglycerol 1,2-di-O-acyl-3-O-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl)-sn-glycerol(1-)|1,2-diacyl-3-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl)-sn-glycerol(1-)|SQDG|a 6-sulfo-alpha-D-quinovosyldiacylglycerol|sulfoquinovosyldiacylglycerol http://purl.obolibrary.org/obo/CHEBI_131487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131492 biolink:ChemicalEntity Wnt signalling activator A substance that activates any of the Wnt signalling pathway, a group of signal transduction pathways made of proteins that pass signals from outside of a cell through cell surface receptors to the inside of the cell. wikipedia.en:Wnt_signaling_pathway Graph Wnt signaling activator|Wnt signaling activators|Wnt signalling activators Wnt signaling activator|Wnt signaling activators|Wnt signalling activators http://purl.obolibrary.org/obo/CHEBI_131492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131496 biolink:ChemicalEntity BW 245C A racemate comprising equimolar amounts of (3R,4S)- and (3S,4R)-BW 245C. A hydantoin-based prostglandin analogue. pubmed:25218962|pubmed:6302737|pubmed:6344895|pubmed:6727564|pubmed:7473146|pubmed:7498323|reaxys:4846687 Graph (+-)-BW 245C|rac-7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid|rac-BW 245C rac-7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid (+-)-BW 245C|rac-7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid|rac-BW 245C http://purl.obolibrary.org/obo/CHEBI_131496 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131500 biolink:ChemicalEntity (3R,4S)-BW 245C A 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid that is the (3R,4S)-enantiomer of BW 245C. cas:72880-75-2|reaxys:964619 Graph (R-(R*,S*))-3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid 7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid (R-(R*,S*))-3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-{(4S)-3-[(3R)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid http://purl.obolibrary.org/obo/CHEBI_131500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131501 biolink:ChemicalEntity (3S,4R)-BW 245C A 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid that is the (3S,4R)-enantiomer of BW 245C. cas:78420-16-3|reaxys:5304906 Graph (S-(R*,S*))-3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-{(4R)-3-[(3S)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid 7-{(4R)-3-[(3S)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid (S-(R*,S*))-3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-{(4R)-3-[(3S)-3-cyclohexyl-3-hydroxypropyl]-2,5-dioxoimidazolidin-4-yl}heptanoic acid http://purl.obolibrary.org/obo/CHEBI_131501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131502 biolink:ChemicalEntity 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid A imidazolidine-2,4-dione that is 7-(2,5-dioxoimidazolidin-4-yl)heptanoic acid in which the imidazoline ring as substituted at position 3 by a 3-(3-cyclohexyl-3-hydroxypropyl) group. cas:75693-75-3|reaxys:964618 Graph 3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid 7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid 3-(3-Cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoic acid|7-[3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidin-4-yl]heptanoic acid http://purl.obolibrary.org/obo/CHEBI_131502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131509 biolink:ChemicalEntity EC 1.14.99.66 (lysine-specific histone demethylase 1A) inhibitor An EC 1.14.99.* (miscellaneous oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor that interferes with the action of lysine-specific histone demethylase 1A (EC 1.14.99.66). wikipedia.en:KDM1A Graph AOF2 inhibitor|AOF2 inhibitors|BHC110 inhibitor|BHC110 inhibitors|CPRF inhibitor|CPRF inhibitors|EC 1.14.99.66 (lysine-specific histone demethylase 1A) inhibitors|EC 1.14.99.66 inhibitor|EC 1.14.99.66 inhibitors|KDM1A inhibitor|KDM1A inhibitors|KIAA0601 inhibitor|KIAA0601 inhibitors|LSD1 inhibitor|LSD1 inhibitors|[histone H3]-dimethyl-L-lysine(4)FAD-dependent demethylase 1A inhibitor|[histone H3]-dimethyl-L-lysine(4)FAD-dependent demethylase 1A inhibitors|amine oxidase (flavin containing) domain 2 inhibitor|amine oxidase (flavin containing) domain 2 inhibitors|lysine (K)-specific demethylase 1A inhibitor|lysine (K)-specific demethylase 1A inhibitors|lysine demethylase 1A inhibitor|lysine demethylase 1A inhibitors|lysine-specific demethylase 1A inhibitor|lysine-specific demethylase 1A inhibitors|lysine-specific histone demethylase 1A inhibitor|lysine-specific histone demethylase 1A inhibitors AOF2 inhibitor|AOF2 inhibitors|BHC110 inhibitor|BHC110 inhibitors|CPRF inhibitor|CPRF inhibitors|EC 1.14.99.66 (lysine-specific histone demethylase 1A) inhibitors|EC 1.14.99.66 inhibitor|EC 1.14.99.66 inhibitors|KDM1A inhibitor|KDM1A inhibitors|KIAA0601 inhibitor|KIAA0601 inhibitors|LSD1 inhibitor|LSD1 inhibitors|[histone H3]-dimethyl-L-lysine(4)FAD-dependent demethylase 1A inhibitor|[histone H3]-dimethyl-L-lysine(4)FAD-dependent demethylase 1A inhibitors|amine oxidase (flavin containing) domain 2 inhibitor|amine oxidase (flavin containing) domain 2 inhibitors|lysine (K)-specific demethylase 1A inhibitor|lysine (K)-specific demethylase 1A inhibitors|lysine demethylase 1A inhibitor|lysine demethylase 1A inhibitors|lysine-specific demethylase 1A inhibitor|lysine-specific demethylase 1A inhibitors|lysine-specific histone demethylase 1A inhibitor|lysine-specific histone demethylase 1A inhibitors http://purl.obolibrary.org/obo/CHEBI_131509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131510 biolink:ChemicalEntity (1R,2S)-tranylcypromine A 2-phenylcyclopropan-1-amine that is the (1R,2S)-enantiomer of tranylcypromine. cas:3721-28-6|lincs.smallmolecule:LSM-5578|metacyc.compound:CPD-17678|pubmed:27882656|pubmed:29542357|reaxys:2206146 Graph (+)-(R)-Tranylcypromine|(+)-Tranylcypromine|(1R,2S)-2-phenyl-1-cyclopropanamine|(1R,2S)-2-phenylcyclopropan-1-amine|(1R,2S)-trans-tranylcypromine|d-Tranylcypromine|trans-2-Phenylcyclopropylamine|trans-2-phenylcyclopropan-1-amine (1R,2S)-2-phenylcyclopropan-1-amine (+)-(R)-Tranylcypromine|(+)-Tranylcypromine|(1R,2S)-2-phenyl-1-cyclopropanamine|(1R,2S)-2-phenylcyclopropan-1-amine|(1R,2S)-trans-tranylcypromine|d-Tranylcypromine|trans-2-Phenylcyclopropylamine|trans-2-phenylcyclopropan-1-amine http://purl.obolibrary.org/obo/CHEBI_131510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131511 biolink:ChemicalEntity (1S,2R)-tranylcypromine A 2-phenylcyclopropan-1-amine that is the (1S,2R)-enantiomer of tranylcypromine. cas:3721-26-4|lincs.smallmolecule:LSM-5943|metacyc.compound:CPD-17679 Graph (-)-Tranylcypromine|(1S,2R)-2-phenyl-1-cyclopropanamine|(1S,2R)-2-phenylcyclopropan-1-amine|(1S,2R)-trans-tranylcypromine|l-Tranylcypromine|trans-(-)-2-Phenylcyclopropanamine|trans-2-phenylcyclopropan-1-amine (1S,2R)-2-phenylcyclopropan-1-amine (-)-Tranylcypromine|(1S,2R)-2-phenyl-1-cyclopropanamine|(1S,2R)-2-phenylcyclopropan-1-amine|(1S,2R)-trans-tranylcypromine|l-Tranylcypromine|trans-(-)-2-Phenylcyclopropanamine|trans-2-phenylcyclopropan-1-amine http://purl.obolibrary.org/obo/CHEBI_131511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131512 biolink:ChemicalEntity 2-phenylcyclopropan-1-amine A member of the class of cyclopropanes carrying amino and phenyl substituents at positions 1 and 2 respectively. Graph 2-phenylcyclopropan-1-amine 2-phenylcyclopropan-1-amine 2-phenylcyclopropan-1-amine http://purl.obolibrary.org/obo/CHEBI_131512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131517 biolink:ChemicalEntity (1R,2S)-tranylcypromine(1+) A primary ammonium ion obtained by protonation of the primary amino function of (1R,2S)-tranylcypromine. Graph (1R,2S)-2-phenylcyclopropan-1-aminium (1R,2S)-2-phenylcyclopropan-1-aminium (1R,2S)-2-phenylcyclopropan-1-aminium http://purl.obolibrary.org/obo/CHEBI_131517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131520 biolink:ChemicalEntity (1S,2R)-tranylcypromine(1+) A primary ammonium ion obtained by protonation of the primary amino function of (1S,2R)-tranylcypromine. pdb-ccd:TPA|pubmed:7634078 Graph (1S,2R)-2-phenylcyclopropan-1-aminium (1S,2R)-2-phenylcyclopropan-1-aminium (1S,2R)-2-phenylcyclopropan-1-aminium http://purl.obolibrary.org/obo/CHEBI_131520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131530 biolink:ChemicalEntity pyridoxal(1+) A pyridinium ion obtained by protonation of the ring nitrogen of pyridoxal. Graph 4-formyl-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium|pyridoxal cation 4-formyl-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium 4-formyl-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium|pyridoxal cation http://purl.obolibrary.org/obo/CHEBI_131530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131533 biolink:ChemicalEntity pyridoxamine(2+) A pyridinium ion obtained by protonation of both nitrogens of pyridoxamine. Graph 4-(azaniumylmethyl)-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium|pyridoxamine cation|pyridoxamine dication 4-(azaniumylmethyl)-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium 4-(azaniumylmethyl)-3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium|pyridoxamine cation|pyridoxamine dication http://purl.obolibrary.org/obo/CHEBI_131533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131561 biolink:ChemicalEntity hyaluronic acid synthesis inhibitor Any compound that inhibits one or more steps in the pathway leading to the synthesis of hyaluronic acid. Graph HA inhibitor|HA inhibitors|HA synthesis inhibitor|HA synthesis inhibitors|hyaluronic acid inhibitor|hyaluronic acid inhibitors|hyaluronic acid synthesis inhibitors HA inhibitor|HA inhibitors|HA synthesis inhibitor|HA synthesis inhibitors|hyaluronic acid inhibitor|hyaluronic acid inhibitors|hyaluronic acid synthesis inhibitors http://purl.obolibrary.org/obo/CHEBI_131561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131565 biolink:ChemicalEntity steroid aldehyde Any steroid substituted by a formyl group. Graph steroid aldehydes steroid aldehydes http://purl.obolibrary.org/obo/CHEBI_131565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131579 biolink:ChemicalEntity pApA A 5'-phospho-(3'→5')-dinucleotide composed from two AMP residues. reaxys:955294 Graph 5'-O-phosphonoadenylyl-(3'->5')-adenosine|Ap-Ap 5'-O-phosphonoadenylyl-(3'->5')-adenosine 5'-O-phosphonoadenylyl-(3'->5')-adenosine|Ap-Ap http://purl.obolibrary.org/obo/CHEBI_131579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131603 biolink:ChemicalEntity sucrose 6(G)-phosphate A disaccharide phosphate that is sucrose carrying a single monophosphate substituent at position 6 on the glucose ring. cas:22372-29-8|kegg.compound:C16688|knapsack:C00007452|metacyc.compound:CPD-15716|pubmed:25577257|pubmed:26826371|reaxys:8136715 Graph 6-O-Phosphonosucrose|6-Phosphosucrose|Sucrose 6-phosphate|Sucrose-6-phosphate|alpha-D-glucopyranosyl-(1<->2)-beta-D-fructofuranoside 6-phosphate|beta-D-Fructofuranosyl-6-O-phosphono-alpha-D-glucopyranoside|beta-D-fructofuranosyl-(1<->2)-alpha-D-glucopyranoside 6-phosphate 6-O-Phosphonosucrose|6-Phosphosucrose|Sucrose 6-phosphate|Sucrose-6-phosphate|alpha-D-glucopyranosyl-(1<->2)-beta-D-fructofuranoside 6-phosphate|beta-D-Fructofuranosyl-6-O-phosphono-alpha-D-glucopyranoside|beta-D-fructofuranosyl-(1<->2)-alpha-D-glucopyranoside 6-phosphate http://purl.obolibrary.org/obo/CHEBI_131603 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131604 biolink:ChemicalEntity Mycoplasma genitalium metabolite Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium. Graph Mycoplasma genitalium metabolites Mycoplasma genitalium metabolites http://purl.obolibrary.org/obo/CHEBI_131604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131605 biolink:ChemicalEntity dicarboxylic acid monoester(1-) A carboxylic acid anion resulting from the deprotonation of the carboxy group of a dicarboxylic acid monoester. Graph http://purl.obolibrary.org/obo/CHEBI_131605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131609 biolink:ChemicalEntity pneumocandin B0 An echinocandin initially isolated as a very minor bioactive fermentation product of Glarea lozoyensis (originally known as Zalerion arboricola). Subsequent random mutagenesis work and optimisation of the fermentation medium permitted the industrial production of pneumocandin B0, which is used as the starting point for the synthesis of the antifungal drug caspofungin. cas:135575-42-7|pubmed:24086376|pubmed:24270605|pubmed:25527531|reaxys:9316734|wikipedia.en:Pneumocandin_Bo Graph (10R,12S)-N-{(2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[(1R)-3-amino-1-hydroxy-3-oxopropyl]-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6-[(1R)-1-hydroxyethyl]-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}-10,12-dimethyltetradecanamide|L 688,786|L-688,786|L-688786|pneumocandin B(0)|pneumocardin B(0) (10R,12S)-N-{(2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[(1R)-3-amino-1-hydroxy-3-oxopropyl]-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6-[(1R)-1-hydroxyethyl]-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}-10,12-dimethyltetradecanamide (10R,12S)-N-{(2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-[(1R)-3-amino-1-hydroxy-3-oxopropyl]-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6-[(1R)-1-hydroxyethyl]-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}-10,12-dimethyltetradecanamide|L 688,786|L-688,786|L-688786|pneumocandin B(0)|pneumocardin B(0) http://purl.obolibrary.org/obo/CHEBI_131609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131610 biolink:ChemicalEntity O-(beta-L-arabinofuranosyl)-trans-4-hydroxy-L-proline residue An L-α-amino acid residue derived from O-(β-L-arabinofuranosyl)-trans-4-hydroxy-L-proline. metacyc.compound:Proteins-hydroxyproline-arabinofuranoses|pubmed:24036508 Graph O-(beta-L-arabinofuranosyl)-trans-4-hydroxy-L-proline residue O-(beta-L-arabinofuranosyl)-trans-4-hydroxy-L-proline residue http://purl.obolibrary.org/obo/CHEBI_131610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131617 biolink:ChemicalEntity 18-oxoresolvin E1 A nonclassic icosanoid that is (6Z,8E,10E,14Z,16E)-icosa-6,8,10,14,16-pentaenoic acid carrying two hydroxy groups at positions 5 and 12 as well as an oxo group at position 18. lipidmaps:LMFA03070044|pubmed:16757471|pubmed:18292578 Graph (5S,6Z,8E,10E,12R,14Z,16E)-5,12-dihydroxy-18-oxoicosa-6,8,10,14,16-pentaenoic acid|18-oxo-5S,12R-dihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid|18-oxo-Resolvin E1|18-oxo-RvE1 (5S,6Z,8E,10E,12R,14Z,16E)-5,12-dihydroxy-18-oxoicosa-6,8,10,14,16-pentaenoic acid (5S,6Z,8E,10E,12R,14Z,16E)-5,12-dihydroxy-18-oxoicosa-6,8,10,14,16-pentaenoic acid|18-oxo-5S,12R-dihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid|18-oxo-Resolvin E1|18-oxo-RvE1 http://purl.obolibrary.org/obo/CHEBI_131617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131619 biolink:ChemicalEntity C27-steroid A steroid compound with a structure based on a 27-carbon (cholestane) skeleton. Graph C27-steroids C27-steroids http://purl.obolibrary.org/obo/CHEBI_131619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131620 biolink:ChemicalEntity C24-steroid A steroid compound with a structure based on a 24-carbon (cholane) skeleton. Graph C24-steroids C24-steroids http://purl.obolibrary.org/obo/CHEBI_131620 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131621 biolink:ChemicalEntity C19-steroid A steroid compound with a structure based on a 19-carbon (androstane) skeleton. Graph C19-steroids C19-steroids http://purl.obolibrary.org/obo/CHEBI_131621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131622 biolink:ChemicalEntity steroidal acyl-CoA(4-) An acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any steroidal acyl-CoA; major species at pH 7.3. Graph steroidal acyl-coenzyme A(4-)|steryl-CoA|steryl-coenzyme A(4-) steroidal acyl-coenzyme A(4-)|steryl-CoA|steryl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_131622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131632 biolink:ChemicalEntity lanostane derivative Any steroid (or derivative) based on a lanostane skeleton. Graph lanostane derivatives lanostane derivatives http://purl.obolibrary.org/obo/CHEBI_131632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131634 biolink:ChemicalEntity pregnane derivative Any steroid (or derivative) based on a pregnane skeleton. Graph pregnane derivatives pregnane derivatives http://purl.obolibrary.org/obo/CHEBI_131634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131635 biolink:ChemicalEntity estrane derivative Any steroid (or derivative) based on an estrane skeleton. Graph estrane derivatives estrane derivatives http://purl.obolibrary.org/obo/CHEBI_131635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131637 biolink:ChemicalEntity lanostane sterol Any sterol based on a lanostane skeleton and its derivatives. Graph lanostane sterols lanostane sterols http://purl.obolibrary.org/obo/CHEBI_131637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131652 biolink:ChemicalEntity cholestanoyl-CoA(4-) A steroidal acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any cholestanoyl-CoA; major species at pH 7.3. Graph http://purl.obolibrary.org/obo/CHEBI_131652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131657 biolink:ChemicalEntity cholane derivative Any steroid (or derivative) based on a cholane skeleton. Graph cholane derivatives cholane derivatives http://purl.obolibrary.org/obo/CHEBI_131657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13166 biolink:ChemicalEntity Sec-tRNA(Sec) kegg.compound:C06482 Graph Sec-tRNA(Sec) Sec-tRNA(Sec) http://purl.obolibrary.org/obo/CHEBI_13166 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131667 biolink:ChemicalEntity 8,11,14-icosatrien-5-ynoic acid A trienoic fatty acid, that is icosanoic acid containing double bonds at positions 8, 11 and 14 and a triple bond at position 5. chemspider:1712 Graph 8,11,14-eicosatrien-5-ynoic acid|eicosa-8,11,14-trien-5-ynoic acid|icosa-8,11,14-trien-5-ynoic acid icosa-8,11,14-trien-5-ynoic acid 8,11,14-eicosatrien-5-ynoic acid|eicosa-8,11,14-trien-5-ynoic acid|icosa-8,11,14-trien-5-ynoic acid http://purl.obolibrary.org/obo/CHEBI_131667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131686 biolink:ChemicalEntity CFTRinh-172 A thiazolidinone that is 2-thioxo-4-thiazolidinone which is substituted at position 3 by a (m--trifluoromethyl)phenyl group and at position 5 by a p-carboxybenzylidene group. It is an inhibitor of cystic fibrosis transmembrane conductance regulator, a membrane protein and chloride channel in vertebrates that is encoded by the CFTR gene. cas:307510-92-5|pubmed:15131065|pubmed:18366345|pubmed:20051483|pubmed:21940661|pubmed:21998142|pubmed:24758416|reaxys:9949257 Graph (inh)-172|3-[(3-trifluoromethyl)phenyl]-5-[(3-carboxyphenyl)methylene]-2-thioxo-4-thiazolidinone|4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)benzoic acid|5-[(4-carboxyphenyl)methylene]-2-thioxo-3-[(3-trifluoromethyl)phenyl]-4-thiazolidinone|CFTR(inh)-172|Cystic fibrosis transmembrane conductance regulator inhibitor CFTR(inh)-172|cystic fibrosis transmembrane regulator inhibitor 172 4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)benzoic acid (inh)-172|3-[(3-trifluoromethyl)phenyl]-5-[(3-carboxyphenyl)methylene]-2-thioxo-4-thiazolidinone|4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)benzoic acid|5-[(4-carboxyphenyl)methylene]-2-thioxo-3-[(3-trifluoromethyl)phenyl]-4-thiazolidinone|CFTR(inh)-172|Cystic fibrosis transmembrane conductance regulator inhibitor CFTR(inh)-172|cystic fibrosis transmembrane regulator inhibitor 172 http://purl.obolibrary.org/obo/CHEBI_131686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131696 biolink:ChemicalEntity cholestane ester Any steroid ester based on a cholestane skeleton. Graph cholestane esters cholestane esters http://purl.obolibrary.org/obo/CHEBI_131696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131697 biolink:ChemicalEntity pyrimidotriazine Any organic heterobicyclic compound containing ortho-fused pyrimidine and triazine rings. Graph pyrimidotriazines pyrimidotriazines http://purl.obolibrary.org/obo/CHEBI_131697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131699 biolink:ChemicalEntity EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor A DNA polymerase inhibitor that interferes with the action of a DNA-directed DNA polymerase (EC 2.7.7.7). wikipedia.en:DNA_polymerase Graph DNA duplicase inhibitor|DNA duplicase inhibitors|DNA nucleotidyltransferase (DNA-directed) inhibitor|DNA nucleotidyltransferase (DNA-directed) inhibitors|DNA nucleotidyltransferase inhibitor|DNA nucleotidyltransferase inhibitors|DNA polymerase I inhibitor|DNA polymerase I inhibitors|DNA polymerase II inhibitor|DNA polymerase II inhibitors|DNA polymerase III inhibitor|DNA polymerase III inhibitors|DNA polymerase alpha inhibitor|DNA polymerase alpha inhibitors|DNA polymerase beta inhibitor|DNA polymerase beta inhibitors|DNA polymerase gamma inhibitor|DNA polymerase gamma inhibitors|DNA polymerase inhibitor|DNA polymerase inhibitors|DNA replicase inhibitor|DNA replicase inhibitors|DNA-dependent DNA polymerase inhibitor|DNA-dependent DNA polymerase inhibitors|DNA-directed DNA polymerase (EC 2.7.7.7) inhibitor|DNA-directed DNA polymerase (EC 2.7.7.7) inhibitors|EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitors|EC 2.7.7.7 inhibitor|EC 2.7.7.7 inhibitors|Klenow fragment inhibitor|Klenow fragment inhibitors|Taq DNA polymerase inhibitor|Taq DNA polymerase inhibitors|Taq Pol I inhibitor|Taq Pol I inhibitors|Tca DNA polymerase inhibitor|Tca DNA polymerase inhibitors|deoxynucleate polymerase inhibitor|deoxynucleate polymerase inhibitors|deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitor|deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitors|deoxyribonucleate nucleotidyltransferase inhibitor|deoxyribonucleate nucleotidyltransferase inhibitors|deoxyribonucleic acid duplicase inhibitor|deoxyribonucleic acid duplicase inhibitors|deoxyribonucleic acid polymerase inhibitor|deoxyribonucleic acid polymerase inhibitors|deoxyribonucleic duplicase inhibitor|deoxyribonucleic duplicase inhibitors|deoxyribonucleic polymerase I inhibitor|deoxyribonucleic polymerase I inhibitors|deoxyribonucleic polymerase inhibitor|deoxyribonucleic polymerase inhibitors|duplicase inhibitor|duplicase inhibitors|sequenase inhibitor|sequenase inhibitors DNA duplicase inhibitor|DNA duplicase inhibitors|DNA nucleotidyltransferase (DNA-directed) inhibitor|DNA nucleotidyltransferase (DNA-directed) inhibitors|DNA nucleotidyltransferase inhibitor|DNA nucleotidyltransferase inhibitors|DNA polymerase I inhibitor|DNA polymerase I inhibitors|DNA polymerase II inhibitor|DNA polymerase II inhibitors|DNA polymerase III inhibitor|DNA polymerase III inhibitors|DNA polymerase alpha inhibitor|DNA polymerase alpha inhibitors|DNA polymerase beta inhibitor|DNA polymerase beta inhibitors|DNA polymerase gamma inhibitor|DNA polymerase gamma inhibitors|DNA polymerase inhibitor|DNA polymerase inhibitors|DNA replicase inhibitor|DNA replicase inhibitors|DNA-dependent DNA polymerase inhibitor|DNA-dependent DNA polymerase inhibitors|DNA-directed DNA polymerase (EC 2.7.7.7) inhibitor|DNA-directed DNA polymerase (EC 2.7.7.7) inhibitors|EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitors|EC 2.7.7.7 inhibitor|EC 2.7.7.7 inhibitors|Klenow fragment inhibitor|Klenow fragment inhibitors|Taq DNA polymerase inhibitor|Taq DNA polymerase inhibitors|Taq Pol I inhibitor|Taq Pol I inhibitors|Tca DNA polymerase inhibitor|Tca DNA polymerase inhibitors|deoxynucleate polymerase inhibitor|deoxynucleate polymerase inhibitors|deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitor|deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitors|deoxyribonucleate nucleotidyltransferase inhibitor|deoxyribonucleate nucleotidyltransferase inhibitors|deoxyribonucleic acid duplicase inhibitor|deoxyribonucleic acid duplicase inhibitors|deoxyribonucleic acid polymerase inhibitor|deoxyribonucleic acid polymerase inhibitors|deoxyribonucleic duplicase inhibitor|deoxyribonucleic duplicase inhibitors|deoxyribonucleic polymerase I inhibitor|deoxyribonucleic polymerase I inhibitors|deoxyribonucleic polymerase inhibitor|deoxyribonucleic polymerase inhibitors|duplicase inhibitor|duplicase inhibitors|sequenase inhibitor|sequenase inhibitors http://purl.obolibrary.org/obo/CHEBI_131699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13170 biolink:ChemicalEntity Ser-tRNA(Sec) kegg.compound:C06481 Graph Ser-tRNA(Sec) Ser-tRNA(Sec) http://purl.obolibrary.org/obo/CHEBI_13170 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131702 biolink:ChemicalEntity stigmastane derivative Any steroid (or derivative) based on a stigmastane skeleton. Graph stigmastane derivatives stigmastane derivatives http://purl.obolibrary.org/obo/CHEBI_131702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131703 biolink:ChemicalEntity stigmastane sterol Any sterol based on a stigmastane skeleton. Graph stigmastane sterols stigmastane sterols http://purl.obolibrary.org/obo/CHEBI_131703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131705 biolink:ChemicalEntity 2'-deoxynucleoside 3'-monophosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of any 2'-deoxynucleoside 3'-monophosphate; major species at pH 7.3. metacyc.compound:Deoxy-Ribonucleoside-3P Graph a 2'-deoxyribonucleoside 3'-phosphate a 2'-deoxyribonucleoside 3'-phosphate http://purl.obolibrary.org/obo/CHEBI_131705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131716 biolink:ChemicalEntity garenoxacin A quinolinemonocarboxylic acid that is 1,4-dihydroquinoline-3-carboxylic acid that is substituted by a cyclopropyl group at position 1, an oxo group at position 4, a (1R)-1-methyl-2,3-dihydro-1H-isoindol-5-yl group at position 7, and a difluoromethoxy group at position 8. cas:194804-75-6|drugcentral:4053|pubmed:11711258|pubmed:11892932|pubmed:12572531|pubmed:21762685|pubmed:21796376|pubmed:22088660|pubmed:25327090|pubmed:25989991|pubmed:26097813|pubmed:26349115|pubmed:26597933|reaxys:8878492|wikipedia.en:Garenoxacin Graph BMS 284756|BMS-284756|BMS284756|T 3811|T-3811|garenoxacin|garenoxacine|garenoxacino|garenoxacinum BMS 284756|BMS-284756|BMS284756|T 3811|T-3811|garenoxacin|garenoxacine|garenoxacino|garenoxacinum http://purl.obolibrary.org/obo/CHEBI_131716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13172 biolink:ChemicalEntity keto-L-sorbose beilstein:1724554|beilstein:3588863 Graph (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|keto-L-sorbose keto-L-sorbose (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|keto-L-sorbose http://purl.obolibrary.org/obo/CHEBI_13172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131727 biolink:ChemicalEntity hydroxylipid Any lipid carrying one or more hydroxy substituents. Graph a hydroxy-fatty acid|hydroxy lipid|hydroxy lipids|hydroxylipids a hydroxy-fatty acid|hydroxy lipid|hydroxy lipids|hydroxylipids http://purl.obolibrary.org/obo/CHEBI_131727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131728 biolink:ChemicalEntity [Glu(-Cys)]n-Gly(1-) An ionic polymer derived from [Glu(-Cys)]n-Gly. Graph [Glu(-Cys)]n-Gly [Glu(-Cys)]n-Gly http://purl.obolibrary.org/obo/CHEBI_131728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13173 biolink:ChemicalEntity L-tagatose 6-phosphate Graph 6-O-phosphono-L-lyxo-hex-2-ulose|6-O-phosphono-L-tagatose|L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|L-tagatose 6-(dihydrogen phosphate) 6-O-phosphono-L-lyxo-hex-2-ulose|6-O-phosphono-L-tagatose|L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|L-tagatose 6-(dihydrogen phosphate) 6-O-phosphono-L-lyxo-hex-2-ulose|6-O-phosphono-L-tagatose|L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|L-tagatose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_13173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131738 biolink:ChemicalEntity 2-tetradecanoyl-sn-glycero-3-phosphocholine A 2-acyl-sn-glycero-3-phosphocholine in which the acyl group is specified as tertadecanoyl (myristoyl). lipidmaps:LMGP01050073|pubmed:21510612|pubmed:26860358|reaxys:9670780 Graph (2R)-3-hydroxy-2-(tetradecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate|2-myristoyl-sn-glycero-3-phosphocholine|2-tetradecanoyl-sn-glycero-3-phosphocholine|PC(0:0/14:0) (2R)-3-hydroxy-2-(tetradecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate (2R)-3-hydroxy-2-(tetradecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate|2-myristoyl-sn-glycero-3-phosphocholine|2-tetradecanoyl-sn-glycero-3-phosphocholine|PC(0:0/14:0) http://purl.obolibrary.org/obo/CHEBI_131738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131766 biolink:ChemicalEntity (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate(4-) An organophosphate oxoanion obtained by deprotonation of the triphosphate OH groups of (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate; major species at pH 7.3. metacyc.compound:CPD-19179|pubmed:25941396 Graph (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate http://purl.obolibrary.org/obo/CHEBI_131766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131767 biolink:ChemicalEntity D-erythrulose 1-phosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of D-erythrulose 1-phosphate; major species at pH 7.3. metacyc.compound:CPD-19135|pubmed:25453104 Graph (3R)-3,4-dihydroxy-2-oxobutyl phosphate|D-erythrulose 1-phosphate (3R)-3,4-dihydroxy-2-oxobutyl phosphate (3R)-3,4-dihydroxy-2-oxobutyl phosphate|D-erythrulose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_131767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131770 biolink:ChemicalEntity EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor A EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor that interferes with the action of channel-conductance-controlling ATPase (EC 3.6.3.49, also known as cystic fibrosis conductance regulator, CFCR). wikipedia.en:Cystic_fibrosis_transmembrane_conductance_regulator Graph ATP phosphohydrolase (channel-conductance-controlling) inhibitor|ATP phosphohydrolase (channel-conductance-controlling) inhibitors|CFTR inhibitor|CFTR inhibitors|EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitors|EC 3.6.3.49 inhibitor|EC 3.6.3.49 inhibitors|channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitor|channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitors|channel-conductance-controlling ATPase inhibitor|channel-conductance-controlling ATPase inhibitors|cystic fibrosis conductance regulator inhibitor|cystic fibrosis conductance regulator inhibitors|cystic fibrosis transmembrane conductance regulator inhibitor|cystic fibrosis transmembrane conductance regulator inhibitors|cystic-fibrosis membrane-conductance-regulating protein inhibitor|cystic-fibrosis membrane-conductance-regulating protein inhibitors ATP phosphohydrolase (channel-conductance-controlling) inhibitor|ATP phosphohydrolase (channel-conductance-controlling) inhibitors|CFTR inhibitor|CFTR inhibitors|EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitors|EC 3.6.3.49 inhibitor|EC 3.6.3.49 inhibitors|channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitor|channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitors|channel-conductance-controlling ATPase inhibitor|channel-conductance-controlling ATPase inhibitors|cystic fibrosis conductance regulator inhibitor|cystic fibrosis conductance regulator inhibitors|cystic fibrosis transmembrane conductance regulator inhibitor|cystic fibrosis transmembrane conductance regulator inhibitors|cystic-fibrosis membrane-conductance-regulating protein inhibitor|cystic-fibrosis membrane-conductance-regulating protein inhibitors http://purl.obolibrary.org/obo/CHEBI_131770 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131780 biolink:ChemicalEntity 2-hydroxyisobutanoyl-CoA(4-) An acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of 2-hydroxyisobutanoyl-CoA; major species at pH 7.3 metacyc.compound:CPD-19040|pubmed:22433853 Graph 2-hydroxyisobutanoyl-CoA|2-hydroxyisobutanoyl-coenzyme A(4-)|2-hydroxyisobutyryl-CoA(4-)|2-hydroxyisobutyryl-coenzyme A(4-) 2-hydroxyisobutanoyl-CoA|2-hydroxyisobutanoyl-coenzyme A(4-)|2-hydroxyisobutyryl-CoA(4-)|2-hydroxyisobutyryl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_131780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131784 biolink:ChemicalEntity xestospongin C An organic heteropentacyclic compound that is isolated from the marine sponge Xestospongia exigua. cas:88903-69-9|pubmed:10821794|pubmed:25580621|pubmed:26912139|pubmed:27031052|pubmed:27038234|pubmed:27062708|reaxys:7626600|reaxys:9307275 Graph (4aR,11R,12aS,16aS,23R,24aS)-icosahydro-2H,5H,12aH,14H-1,23:11,13-diethano[1,11]dioxacycloicosino[10,9-b:20,19-b']dipyridine|Araguspongin E|Araguspongine E (4aR,11R,12aS,16aS,23R,24aS)-icosahydro-2H,5H,12aH,14H-1,23:11,13-diethano[1,11]dioxacycloicosino[10,9-b:20,19-b']dipyridine (4aR,11R,12aS,16aS,23R,24aS)-icosahydro-2H,5H,12aH,14H-1,23:11,13-diethano[1,11]dioxacycloicosino[10,9-b:20,19-b']dipyridine|Araguspongin E|Araguspongine E http://purl.obolibrary.org/obo/CHEBI_131784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131787 biolink:ChemicalEntity dopamine receptor D2 antagonist An antagonist that binds to and deactivates the dopamine receptor D2, the main receptor for all antipsychotic drugs. pubmed:23323533|wikipedia.en:Dopamine_receptor_D2 Graph D2 receptor antagonist|D2R antagonist D2 receptor antagonist|D2R antagonist http://purl.obolibrary.org/obo/CHEBI_131787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131793 biolink:ChemicalEntity SKF 38393 A racemate comprising equimolar amounts of (R)- and (S)-SKF 38393 cas:67287-49-4|lincs.smallmolecule:LSM-21649|pubmed:21901319|pubmed:22387069|pubmed:22573387|pubmed:22702101|pubmed:23074829|pubmed:23499830|pubmed:23531471|pubmed:23700659|pubmed:24140426|pubmed:24261116|pubmed:24768642|pubmed:2566489|pubmed:2577061|pubmed:26319554|pubmed:26639424|pubmed:26658514|pubmed:26772761|pubmed:26801827|pubmed:26975318|pubmed:27041647|reaxys:1543419|wikipedia.en:SKF-38,393 Graph (+-)-SKF 38393|(RS)-SKF 38393|2,3,4,5-Tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|2,3,4,5-Tetrahydro-7,8-dihydroxy-1-phenyl-1H-3-benzazepine|SK&F 38393|SK&F-38393|SKF 38,393|SKF-38,393|SKF-38393|rac-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol rac-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (+-)-SKF 38393|(RS)-SKF 38393|2,3,4,5-Tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|2,3,4,5-Tetrahydro-7,8-dihydroxy-1-phenyl-1H-3-benzazepine|SK&F 38393|SK&F-38393|SKF 38,393|SKF-38,393|SKF-38393|rac-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol http://purl.obolibrary.org/obo/CHEBI_131793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131794 biolink:ChemicalEntity EC 2.7.11.17 (Ca(2+)/calmodulin-dependent protein kinase) inhibitor Any EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of a Ca2+/calmodulin-dependent protein kinase (EC 2.7.11.17). wikipedia.en:CAMK Graph ATP:caldesmon O-phosphotransferase inhibitor|ATP:caldesmon O-phosphotransferase inhibitors|ATP:protein phosphotransferase ((2+)/calmodulin-dependent) inhibitor|ATP:protein phosphotransferase ((2+)/calmodulin-dependent) inhibitors|CAM PKII inhibitor|CAM PKII inhibitors|Ca(2+)/calmodulin-dependent microtubule-associated protein 2 kinase inhibitor|Ca(2+)/calmodulin-dependent microtubule-associated protein 2 kinase inhibitors|Ca(2+)/calmodulin-dependent protein kinase (EC 2.7.11.17) inhibitor|Ca(2+)/calmodulin-dependent protein kinase (EC 2.7.11.17) inhibitors|Ca(2+)/calmodulin-dependent protein kinase 1 inhibitor|Ca(2+)/calmodulin-dependent protein kinase 1 inhibitors|Ca(2+)/calmodulin-dependent protein kinase II inhibitor|Ca(2+)/calmodulin-dependent protein kinase II inhibitors|Ca(2+)/calmodulin-dependent protein kinase IV inhibitor|Ca(2+)/calmodulin-dependent protein kinase IV inhibitors|Ca(2+)/calmodulin-dependent protein kinase inhibitor|Ca(2+)/calmodulin-dependent protein kinase inhibitors|Ca(2+)/calmodulin-dependent protein kinase kinase beta inhibitor|Ca(2+)/calmodulin-dependent protein kinase kinase beta inhibitors|Ca(2+)/calmodulin-dependent protein kinase kinase inhibitor|Ca(2+)/calmodulin-dependent protein kinase kinase inhibitors|CaM kinase II inhibitor|CaM kinase II inhibitors|CaM kinase inhibitor|CaM kinase inhibitors|CaM-regulated serine/threonine kinase inhibitor|CaM-regulated serine/threonine kinase inhibitors|CaMKI inhibitor|CaMKI inhibitors|CaMKII inhibitor|CaMKII inhibitors|CaMKIV inhibitor|CaMKIV inhibitors|CaMKKalpha inhibitor|CaMKKalpha inhibitors|CaMKKbeta inhibitor|CaMKKbeta inhibitors|EC 2.7.11.17 (Ca(2+)/calmodulin-dependent protein kinase) inhibitors|EC 2.7.11.17 inhibitor|EC 2.7.11.17 inhibitors|STK20 inhibitor|STK20 inhibitors|caldesmon kinase (phosphorylating) inhibitor|caldesmon kinase (phosphorylating) inhibitors|caldesmon kinase inhibitor|caldesmon kinase inhibitors|calmodulin-dependent kinase II inhibitor|calmodulin-dependent kinase II inhibitors|microtubule-associated protein 2 kinase inhibitor|microtubule-associated protein 2 kinase inhibitors ATP:caldesmon O-phosphotransferase inhibitor|ATP:caldesmon O-phosphotransferase inhibitors|ATP:protein phosphotransferase ((2+)/calmodulin-dependent) inhibitor|ATP:protein phosphotransferase ((2+)/calmodulin-dependent) inhibitors|CAM PKII inhibitor|CAM PKII inhibitors|Ca(2+)/calmodulin-dependent microtubule-associated protein 2 kinase inhibitor|Ca(2+)/calmodulin-dependent microtubule-associated protein 2 kinase inhibitors|Ca(2+)/calmodulin-dependent protein kinase (EC 2.7.11.17) inhibitor|Ca(2+)/calmodulin-dependent protein kinase (EC 2.7.11.17) inhibitors|Ca(2+)/calmodulin-dependent protein kinase 1 inhibitor|Ca(2+)/calmodulin-dependent protein kinase 1 inhibitors|Ca(2+)/calmodulin-dependent protein kinase II inhibitor|Ca(2+)/calmodulin-dependent protein kinase II inhibitors|Ca(2+)/calmodulin-dependent protein kinase IV inhibitor|Ca(2+)/calmodulin-dependent protein kinase IV inhibitors|Ca(2+)/calmodulin-dependent protein kinase inhibitor|Ca(2+)/calmodulin-dependent protein kinase inhibitors|Ca(2+)/calmodulin-dependent protein kinase kinase beta inhibitor|Ca(2+)/calmodulin-dependent protein kinase kinase beta inhibitors|Ca(2+)/calmodulin-dependent protein kinase kinase inhibitor|Ca(2+)/calmodulin-dependent protein kinase kinase inhibitors|CaM kinase II inhibitor|CaM kinase II inhibitors|CaM kinase inhibitor|CaM kinase inhibitors|CaM-regulated serine/threonine kinase inhibitor|CaM-regulated serine/threonine kinase inhibitors|CaMKI inhibitor|CaMKI inhibitors|CaMKII inhibitor|CaMKII inhibitors|CaMKIV inhibitor|CaMKIV inhibitors|CaMKKalpha inhibitor|CaMKKalpha inhibitors|CaMKKbeta inhibitor|CaMKKbeta inhibitors|EC 2.7.11.17 (Ca(2+)/calmodulin-dependent protein kinase) inhibitors|EC 2.7.11.17 inhibitor|EC 2.7.11.17 inhibitors|STK20 inhibitor|STK20 inhibitors|caldesmon kinase (phosphorylating) inhibitor|caldesmon kinase (phosphorylating) inhibitors|caldesmon kinase inhibitor|caldesmon kinase inhibitors|calmodulin-dependent kinase II inhibitor|calmodulin-dependent kinase II inhibitors|microtubule-associated protein 2 kinase inhibitor|microtubule-associated protein 2 kinase inhibitors http://purl.obolibrary.org/obo/CHEBI_131794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131795 biolink:ChemicalEntity dopamine receptor D1 agonist A dopamine agonist that binds to and activates the dopamine receptor D1. wikipedia.en:Dopamine_receptor_D1 Graph D1 agonist|D1 agonists|dopamine D1 receptor agonist|dopamine D1 receptor agonists|dopamine receptor D1 agonists D1 agonist|D1 agonists|dopamine D1 receptor agonist|dopamine D1 receptor agonists|dopamine receptor D1 agonists http://purl.obolibrary.org/obo/CHEBI_131795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131796 biolink:ChemicalEntity (S)-SKF 38393 A 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol that is the S-enantiomer of SKF 38393. cas:81702-43-4|pubmed:24171673|reaxys:5287503 Graph (1S)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol|(1S)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|(S)-SKF-38393 (1S)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (1S)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol|(1S)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|(S)-SKF-38393 http://purl.obolibrary.org/obo/CHEBI_131796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131800 biolink:ChemicalEntity (R)-SKF 38393 A 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol that is the R-enantiomer of SKF 38393. cas:62751-59-1|lincs.smallmolecule:LSM-37178|pubmed:12644268|pubmed:7714795|reaxys:3619270 Graph (1R)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol|(1R)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|(R)-SKF-38393|R-(+)-SKF-38393 (1R)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (1R)-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol|(1R)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol|(R)-SKF-38393|R-(+)-SKF-38393 http://purl.obolibrary.org/obo/CHEBI_131800 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131801 biolink:ChemicalEntity 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol A benzazepine that is 2,3,4,5-tetrahydro-3-benzazepine bearing a phenyl substituent at position 1 and two hydroxy substituents at positions 7 and 8. Graph 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol http://purl.obolibrary.org/obo/CHEBI_131801 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131803 biolink:ChemicalEntity L-allysine residue An L-α-amino acid residue derived from L-allysine. metacyc.compound:CPD-8649 Graph (S)-2-amino-6-oxohexanoate residue|(S)-2-amino-6-oxohexanoyl residue (S)-2-amino-6-oxohexanoate residue|(S)-2-amino-6-oxohexanoyl residue http://purl.obolibrary.org/obo/CHEBI_131803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131806 biolink:ChemicalEntity (R)-SKF 38393(1+) An organic cation obtained by protonation of the secondary amino function of (R)-SKF 38393. Graph (1R)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium (1R)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium (1R)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium http://purl.obolibrary.org/obo/CHEBI_131806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131807 biolink:ChemicalEntity (S)-SKF 38393(1+) An organic cation obtained by protonation of the secondary amino function of (S)-SKF 38393. Graph (1S)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium (1S)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium (1S)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium http://purl.obolibrary.org/obo/CHEBI_131807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131809 biolink:ChemicalEntity SMO receptor agonist An agonist that enhances the action of smoothened (SMO) receptor. pubmed:12437772|pubmed:20439738|wikipedia.en:Smoothened Graph SMO receptor agonists|smoothened agonist|smoothened agonists|smoothened receptor agonist|smoothened receptor agonists SMO receptor agonists|smoothened agonist|smoothened agonists|smoothened receptor agonist|smoothened receptor agonists http://purl.obolibrary.org/obo/CHEBI_131809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131822 biolink:ChemicalEntity sulfamate An organosulfonate oxoanion obtained by deprotonation of the N-sulfo group of any sulfamic acid; major species at pH 7.3. Graph a sulfamate a sulfamate http://purl.obolibrary.org/obo/CHEBI_131822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131825 biolink:ChemicalEntity 8,5'-cyclo-2'-deoxyadenosine An organic heterotetracyclic compound obtained by intramolecular formation of a C-C bond between positions 8 and 5' of 2'-deoxyadenosine. cas:117182-88-4|pubmed:22817898|pubmed:23961697|pubmed:24471831|pubmed:25034731|pubmed:25605892|pubmed:26344223|reaxys:8118367 Graph (6R,7S,8S,10R)-4-amino-7,8,9,10-tetrahydro-6H-7,10-epoxyazepino[1,2-e]purine-6,8-diol|2'-Deoxy-8,5'-cycloadenosine|8,5'-Cda|cyclo-dA|cyclodA (6R,7S,8S,10R)-4-amino-7,8,9,10-tetrahydro-6H-7,10-epoxyazepino[1,2-e]purine-6,8-diol (6R,7S,8S,10R)-4-amino-7,8,9,10-tetrahydro-6H-7,10-epoxyazepino[1,2-e]purine-6,8-diol|2'-Deoxy-8,5'-cycloadenosine|8,5'-Cda|cyclo-dA|cyclodA http://purl.obolibrary.org/obo/CHEBI_131825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131843 biolink:ChemicalEntity meldonium An ammonium betaine that is β-alaninate in which one of the amino hydrogens is replaced by a trimethylamino group. A clinically used cardioprotective drug that is used for treatment of heart failure, myocardial infarction, arrhythmia, atherosclerosis and diabetes. cas:76144-81-5|drugcentral:3995|kegg.drug:D10504|metacyc.compound:CPD-10661|pdb-ccd:REE|pubmed:23238051|pubmed:24124882|pubmed:24273007|pubmed:24571165|pubmed:24729295|pubmed:24754070|pubmed:24864465|pubmed:25001658|pubmed:25177785|pubmed:25177814|pubmed:25177815|pubmed:25446926|pubmed:25675721|pubmed:25702409|pubmed:25847280|pubmed:25902653|pubmed:26697890|pubmed:26761970|pubmed:26850121|pubmed:26961537|pubmed:27015859|reaxys:3938272|wikipedia.en:Meldonium Graph 2-(2-carboxyethyl)-1,1,1-trimethyldiazanium|3-(2,2,2-Trimethyldiazaniumyl)propanoate|3-(2,2,2-Trimethylhydrazine)propionate|3-(2,2,2-trimethyldiazan-2-ium-1-yl)propanoate|meldonium|mildronate 3-(2,2,2-trimethyldiazan-2-ium-1-yl)propanoate 2-(2-carboxyethyl)-1,1,1-trimethyldiazanium|3-(2,2,2-Trimethyldiazaniumyl)propanoate|3-(2,2,2-Trimethylhydrazine)propionate|3-(2,2,2-trimethyldiazan-2-ium-1-yl)propanoate|meldonium|mildronate http://purl.obolibrary.org/obo/CHEBI_131843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131844 biolink:ChemicalEntity EC 1.14.11.1 (gamma-butyrobetaine dioxygenase) inhibitor An EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor that interferes with the action of γ-butyrobetaine dioxygenase (EC 1.14.11.1). wikipedia.en:Gamma-butyrobetaine_dioxygenase Graph 4-trimethylammoniobutanoate,2-oxoglutarate:oxygen oxidoreductase (3-hydroxylating) inhibitor|4-trimethylammoniobutanoate,2-oxoglutarate:oxygen oxidoreductase (3-hydroxylating) inhibitors|BBOX inhibitor|BBOX inhibitors|EC 1.14.11.1 (gamma-butyrobetaine dioxygenase) inhibitors|EC 1.14.11.1 inhibitor|EC 1.14.11.1 inhibitors|alpha-butyrobetaine hydroxylase inhibitor|alpha-butyrobetaine hydroxylase inhibitors|butyrobetaine hydroxylase inhibitor|butyrobetaine hydroxylase inhibitors|gamma-butyrobetaine hydroxylase inhibitor|gamma-butyrobetaine hydroxylase inhibitors 4-trimethylammoniobutanoate,2-oxoglutarate:oxygen oxidoreductase (3-hydroxylating) inhibitor|4-trimethylammoniobutanoate,2-oxoglutarate:oxygen oxidoreductase (3-hydroxylating) inhibitors|BBOX inhibitor|BBOX inhibitors|EC 1.14.11.1 (gamma-butyrobetaine dioxygenase) inhibitors|EC 1.14.11.1 inhibitor|EC 1.14.11.1 inhibitors|alpha-butyrobetaine hydroxylase inhibitor|alpha-butyrobetaine hydroxylase inhibitors|butyrobetaine hydroxylase inhibitor|butyrobetaine hydroxylase inhibitors|gamma-butyrobetaine hydroxylase inhibitor|gamma-butyrobetaine hydroxylase inhibitors http://purl.obolibrary.org/obo/CHEBI_131844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131848 biolink:ChemicalEntity fotemustine A racemate comprising equimolar amounts of (R)- and (S)-fotemustine. It is an alkylating agent used in the treatment of malignant melanoma. cas:92118-27-9|kegg.drug:D07255|patent:FR2536075|patent:US4567169|pubmed:15020614|pubmed:23560594|pubmed:24023343|pubmed:24800248|pubmed:25538176|pubmed:25702193|pubmed:2627116|pubmed:26458240|pubmed:26542177|pubmed:26750128|pubmed:26951379|pubmed:27057436|reaxys:8626774|wikipedia.en:Fotemustine Graph (+-)-diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate|Muphoran|Mustoforan|S 10036|Servier-10036|diethyl-1-(3-(2-chloroethyl)-3-nitrosoureido)ethylphosphonate|fotemustina|fotemustine|fotemustinum|rac-fotemustine (+-)-diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate|Muphoran|Mustoforan|S 10036|Servier-10036|diethyl-1-(3-(2-chloroethyl)-3-nitrosoureido)ethylphosphonate|fotemustina|fotemustine|fotemustinum|rac-fotemustine http://purl.obolibrary.org/obo/CHEBI_131848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131852 biolink:ChemicalEntity diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate A member of the class of N-nitrosoureas that is ethyl diethylphosphonate in the hydrogen at position 1 of the ethyl group attached to the phosphorus has been replaced by a [(2-chloroethyl)(nitroso)carbamoyl]amino group. Graph diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate http://purl.obolibrary.org/obo/CHEBI_131852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131853 biolink:ChemicalEntity (R)-fotemustine A diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate that has R configuration. Graph diethyl [(1R)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate diethyl [(1R)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate diethyl [(1R)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate http://purl.obolibrary.org/obo/CHEBI_131853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131854 biolink:ChemicalEntity (S)-fotemustine A diethyl (1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl)phosphonate that has S configuration. Graph diethyl [(1S)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate diethyl [(1S)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate diethyl [(1S)-1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}ethyl]phosphonate http://purl.obolibrary.org/obo/CHEBI_131854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131858 biolink:ChemicalEntity HETE anion An icosanoid anion arising from deprotonation of the carboxylic acid function of any hydroxyicosatetraenoic acid. Graph HETE anions|hydroxyeicosatetraenoate|hydroxyeicosatetraenoates|hydroxyicosatetraenoate|hydroxyicosatetraenoates HETE anions|hydroxyeicosatetraenoate|hydroxyeicosatetraenoates|hydroxyicosatetraenoate|hydroxyicosatetraenoates http://purl.obolibrary.org/obo/CHEBI_131858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131859 biolink:ChemicalEntity oxo-ETE anion An icosanoid anion arising from deprotonation of the carboxylic acid function of any oxoicosatetraenoic acid. Graph an oxoeicosatetraenoate|oxo-ETE anions|oxoeicosatetraenoate|oxoeicosatetraenoates|oxoicosatetraenoate|oxoicosatetraenoates an oxoeicosatetraenoate|oxo-ETE anions|oxoeicosatetraenoate|oxoeicosatetraenoates|oxoicosatetraenoate|oxoicosatetraenoates http://purl.obolibrary.org/obo/CHEBI_131859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131860 biolink:ChemicalEntity octadecanoid anion An unsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any octadecanoid. Graph anionic octadecanoid|anionic octadecanoids|octadecanoid anions anionic octadecanoid|anionic octadecanoids|octadecanoid anions http://purl.obolibrary.org/obo/CHEBI_131860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131861 biolink:ChemicalEntity HODE(1-) An unsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any hydroxyoctadecadienoic acid. Graph HODE anion|HODE anions|hydroxyoctadecadienoates HODE anion|HODE anions|hydroxyoctadecadienoates http://purl.obolibrary.org/obo/CHEBI_131861 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131862 biolink:ChemicalEntity HPODE(1-) An octadecanoid anion anion obtained by the deprotonation of the carboxy group of any hydroperoxyoctadecadienoic acid. Graph HPODE anion|HPODE anions|hydroperoxyoctadecadienoate|hydroperoxyoctadecadienoates HPODE anion|HPODE anions|hydroperoxyoctadecadienoate|hydroperoxyoctadecadienoates http://purl.obolibrary.org/obo/CHEBI_131862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131863 biolink:ChemicalEntity docosanoid Any oxygenated derivative of C22 polyunsaturated fatty acids, such as docosapentaenoic acid (DPA) and docosahexaenoic acid (DHA). Graph http://purl.obolibrary.org/obo/CHEBI_131863 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131864 biolink:ChemicalEntity docosanoid anion A polyunsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any docosanoid. Graph docosanoid anions docosanoid anions http://purl.obolibrary.org/obo/CHEBI_131864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131865 biolink:ChemicalEntity EET(1-) An icosanoid anion obtained by the deprotonation of the carboxy group of any epoxyicosatrienoic acid. Graph EET anion|EET anions|epoxyeicosatrienoate|epoxyeicosatrienoates|epoxyicosatrienoate|epoxyicosatrienoates EET anion|EET anions|epoxyeicosatrienoate|epoxyeicosatrienoates|epoxyicosatrienoate|epoxyicosatrienoates http://purl.obolibrary.org/obo/CHEBI_131865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131867 biolink:ChemicalEntity hydroxydocosahexaenoate A hydroxy polyunsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any hydroxydocosahexaenoic acid. Graph HDoHE anion|HDoHE anions|hydroxy-DHA anions|hydroxydocosahexaenoates HDoHE anion|HDoHE anions|hydroxy-DHA anions|hydroxydocosahexaenoates http://purl.obolibrary.org/obo/CHEBI_131867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131868 biolink:ChemicalEntity hydroperoxydocosahexaenoate A docosanoid anion arising from deprotonation of the carboxylic acid function of any hydroperoxydocosahexaenoic acid. Graph HPDHE anion|HPDHE anions|HPDHE(1-)|hydroperoxydocosahexaenoates HPDHE anion|HPDHE anions|HPDHE(1-)|hydroperoxydocosahexaenoates http://purl.obolibrary.org/obo/CHEBI_131868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131869 biolink:ChemicalEntity hydroxy monounsaturated fatty acid Any monounsaturated fatty acid carrying one or more hydroxy substituents. Graph hydroxy MUFA|hydroxy monounsaturated fatty acids hydroxy MUFA|hydroxy monounsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_131869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131870 biolink:ChemicalEntity hydroxy monounsaturated fatty acid anion Any monounsaturated fatty acid anion carrying one or more hydroxy substituents. Graph hydroxy MUFA anions|hydroxy monounsaturated fatty acid anions hydroxy MUFA anions|hydroxy monounsaturated fatty acid anions http://purl.obolibrary.org/obo/CHEBI_131870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131871 biolink:ChemicalEntity hydroxy polyunsaturated fatty acid anion Any polyunsaturated fatty acid anion carrying one or more hydroxy substituents. Graph a hydroxy polyunsaturated fatty acid|hydroxy PUFA|hydroxy polyunsaturated fatty acid anions a hydroxy polyunsaturated fatty acid|hydroxy PUFA|hydroxy polyunsaturated fatty acid anions http://purl.obolibrary.org/obo/CHEBI_131871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131872 biolink:ChemicalEntity hydroxy saturated fatty acid anion Any saturated fatty acid anion carrying one or more hydroxy substituents. Graph hydroxy saturated fatty acid anions hydroxy saturated fatty acid anions http://purl.obolibrary.org/obo/CHEBI_131872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131873 biolink:ChemicalEntity EpETE(1-) An unsaturated fatty acid anion arising from deprotonation of the carboxylic acid function of any epoxyicosatetraenoic acid. Graph EpETE anion|EpETE anions|epoxyeicosatetraenoate|epoxyicosatetraenoate|epoxyicosatetraenoates EpETE anion|EpETE anions|epoxyeicosatetraenoate|epoxyicosatetraenoate|epoxyicosatetraenoates http://purl.obolibrary.org/obo/CHEBI_131873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131874 biolink:ChemicalEntity HEPE(1-) An unsaturated fatty acid anion arising from deprotonation of the carboxylic acid function of any hydroxyicosapentaenoic acid (HEPE). Graph HEPE anion|HEPE anions|hydroxyeicosapentaenoate|hydroxyicosapentaenoate|hydroxyicosapentaenoates HEPE anion|HEPE anions|hydroxyeicosapentaenoate|hydroxyicosapentaenoate|hydroxyicosapentaenoates http://purl.obolibrary.org/obo/CHEBI_131874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131876 biolink:ChemicalEntity hydroperoxyicosapentaenoate An icosanoid anion arising from deprotonation of the carboxylic acid function of any hydroperoxyicosapentaenoic acid. Graph HpEPE anion|HpEPE anions|HpEPE(1-)|hydroperoxyeicosapentaenoate|hydroperoxyeicosapentaenoates|hydroperoxyicosapentaenoates HpEPE anion|HpEPE anions|HpEPE(1-)|hydroperoxyeicosapentaenoate|hydroperoxyeicosapentaenoates|hydroperoxyicosapentaenoates http://purl.obolibrary.org/obo/CHEBI_131876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131878 biolink:ChemicalEntity cholanic acid anion Any steroid acid anion based on a cholanic acid skeleton. Graph cholanic acid anions|cholanoic acid anions cholanic acid anions|cholanoic acid anions http://purl.obolibrary.org/obo/CHEBI_131878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131879 biolink:ChemicalEntity cholanic acid conjugate anion An organic anion obtained by deprotonation of any cholanic acid conjugate. Graph cholanic acid conjugate anions|cholanoic acid conjugate anion|cholanoic acid conjugate anions cholanic acid conjugate anions|cholanoic acid conjugate anion|cholanoic acid conjugate anions http://purl.obolibrary.org/obo/CHEBI_131879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131880 biolink:ChemicalEntity N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine A ketoxime that is the oxime of indan-1-one in which the hydrogen at position 5 has been replaced by an imidazol-5-yl group which has itself been substituted at positions 2 and 4 by p-[2-(dimethylamino)ethoxy]phenyl and pyridin-4-yl groups, respectively. Graph N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine http://purl.obolibrary.org/obo/CHEBI_131880 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131881 biolink:ChemicalEntity (E)-SB-590885 An N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine in which the oxime group has E configuration. reaxys:15567360 Graph (1E)-N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine|(E)-SB 590885|(E)-SB590885 (1E)-N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine (1E)-N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine|(E)-SB 590885|(E)-SB590885 http://purl.obolibrary.org/obo/CHEBI_131881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131882 biolink:ChemicalEntity SB-590885 A mixture of (E)- and (Z)-SB-590885. cas:405554-55-4|pubmed:16260133|pubmed:17145850|pubmed:24821574|pubmed:26081844|reaxys:18849081 Graph SB 590885|SB590885 SB 590885|SB590885 http://purl.obolibrary.org/obo/CHEBI_131882 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131906 biolink:ChemicalEntity 4-pyranones A pyranone based on the structure of 4H-pyran-4-one and its substituted derivatives. Graph pyran-4-ones pyran-4-ones http://purl.obolibrary.org/obo/CHEBI_131906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131907 biolink:ChemicalEntity 3-pyrones A pyranone based on the structure of 2H-pyran-3(4H)-one or 2H-pyran-3(6H)-one, and their substituted derivatives. Graph pyran-3-ones pyran-3-ones http://purl.obolibrary.org/obo/CHEBI_131907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131914 biolink:ChemicalEntity violacein A member of the class of hydroxyindoles resulting from the formal oxidative coupling between the 3-position of 1,3-dihydro-2H-indol-2-one and the 3-position of 1,3-dihydro-2H-pyrrol-2-one, which is substituted at the 5 position by a 5-hydroxy-1H-indol-3-yl group, where the newly-formed double bond has E configuration. It is a purple chromobacterial pigment that has antibacterial, antifungal, antiprotozoan, and anticancer properties. cas:548-54-9|kegg.compound:C21136|metacyc.compound:VIOLACEIN|pubmed:21779844|pubmed:25592762|pubmed:25652759|pubmed:26339614|pubmed:26428920|pubmed:26521020|pubmed:26916415|reaxys:49923 Graph (3E)-3-[5-(5-hydroxy-1H-indol-3-yl)-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]-1,3-dihydro-2H-indol-2-one|violacein (3E)-3-[5-(5-hydroxy-1H-indol-3-yl)-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]-1,3-dihydro-2H-indol-2-one (3E)-3-[5-(5-hydroxy-1H-indol-3-yl)-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]-1,3-dihydro-2H-indol-2-one|violacein http://purl.obolibrary.org/obo/CHEBI_131914 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131916 biolink:ChemicalEntity proviolacein A hydroxyindole that is 2H-pyrrol-2-one which is substituted at positions 3 and 5 by 1H-indol-3-yl and 5-hydroxy-1H-indol-3-yl groups, respectively. It is an intermediate in the biosynthesis of the purple chromobacterial pigment violacein from L-tryptophan. metacyc.compound:CPD-14321|pubmed:17176066|pubmed:21779844|pubmed:25664787|reaxys:7340743 Graph 5-(5-hydroxy-1H-indol-3-yl)-3-(1H-indol-3-yl)-2H-pyrrol-2-one|proviolacein 5-(5-hydroxy-1H-indol-3-yl)-3-(1H-indol-3-yl)-2H-pyrrol-2-one 5-(5-hydroxy-1H-indol-3-yl)-3-(1H-indol-3-yl)-2H-pyrrol-2-one|proviolacein http://purl.obolibrary.org/obo/CHEBI_131916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131923 biolink:ChemicalEntity salubrinal A member of the class of quinolines that is a mixed aminal resulting from the formal condensation oftrichloroacetaldehyde with the amide nitrogen of trans-cinnamamide and the primary amino group of 1-quinolin-8-ylthiourea. It is a selective inhibitor of cellular complexes that dephosphorylate eukaryotic translation initiation factor 2 subunit α (eIF2α). cas:405060-95-9|patent:EP2589593|pubmed:15705855|pubmed:22610062|pubmed:23178987|pubmed:23473976|pubmed:23603983|pubmed:23816340|pubmed:23824972|pubmed:24418467|pubmed:24728926|pubmed:25030410|pubmed:25157407|pubmed:25230871|pubmed:25435425|pubmed:25582550|pubmed:25619567|pubmed:25816071|pubmed:25882497|pubmed:25977571|pubmed:26021511|pubmed:26193263|pubmed:26328492|pubmed:26505387|pubmed:26743901|pubmed:26889171|pubmed:27123756|pubmed:27131989|reaxys:13925629|wikipedia.en:Salubrinal Graph (2E)-3-phenyl-N-{2,2,2-trichloro-1-[(quinolin-8-ylcarbamothioyl)amino]ethyl}acrylamide (2E)-3-phenyl-N-{2,2,2-trichloro-1-[(quinolin-8-ylcarbamothioyl)amino]ethyl}acrylamide (2E)-3-phenyl-N-{2,2,2-trichloro-1-[(quinolin-8-ylcarbamothioyl)amino]ethyl}acrylamide http://purl.obolibrary.org/obo/CHEBI_131923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131927 biolink:ChemicalEntity dicarboxylic acids and O-substituted derivatives A class of carbonyl compound encompassing dicarboxylic acids and any derivatives obtained by substitution of either one or both of the carboxy hydrogens. Graph dicarboxylic acids and derivatives dicarboxylic acids and derivatives http://purl.obolibrary.org/obo/CHEBI_131927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13193 biolink:ChemicalEntity hydrogen acceptor A molecular entity that can undergo reduction by the gain of hydrogen atom(s). Graph A A http://purl.obolibrary.org/obo/CHEBI_13193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131958 biolink:ChemicalEntity (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate A polyunsaturated fatty acid anion that is the conjugate base of 13S,14S-epoxy-DHA, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(13S,14S)-epoxy-DHA(1-)|(13S,14S)-epoxy-maresin(1-)|(4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoate (4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoate (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(13S,14S)-epoxy-DHA(1-)|(13S,14S)-epoxy-maresin(1-)|(4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoate http://purl.obolibrary.org/obo/CHEBI_131958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131960 biolink:ChemicalEntity fluoroindole An organofluorine compound that is a compound based on an indole skeleton, containing one or more fluorine atoms. Graph fluoroindoles fluoroindoles http://purl.obolibrary.org/obo/CHEBI_131960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131968 biolink:ChemicalEntity tyrphostin B42 A monocarboxylic acid amide obtained by formal condensation of the carboxy group of (2E)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoic acid with the amino group of benzylamine. cas:133550-30-8|lincs.smallmolecule:LSM-42880|pubmed:10929036|pubmed:22363408|pubmed:26190257|pubmed:26438799|pubmed:26487394|pubmed:26750536|pubmed:26919242|pubmed:27011172|pubmed:27044832|pubmed:27101310|pubmed:27107220|pubmed:27274711|reaxys:4323263 Graph (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide|AG 490|AG-490|AG490|tyrphostin AG-490 (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide|AG 490|AG-490|AG490|tyrphostin AG-490 http://purl.obolibrary.org/obo/CHEBI_131968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13197 biolink:ChemicalEntity ribonucleoside 3'-monophosphate(2-) A ribonucleoside 3'-monophosphate(2−) oxoanion in which both of the acidic hydroxy groups from the phosphate moiety are deprotonated. Graph a ribonucleoside 3'-phosphate a ribonucleoside 3'-phosphate http://purl.obolibrary.org/obo/CHEBI_13197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131982 biolink:ChemicalEntity 1-icosenoyl-sn-glycero-3-phosphocholine A lysophosphatidylcholine 20:1 in which the acyl group is located at position 1. Graph 1-eicosenoyl-GPC|1-eicosenoyl-GPC (20:1)|1-eicosenoyl-sn-glycero-3-phosphocholine|GPC(20:1)|GPC(20:1/0:0)|LPC(20:1/0:0)|PC(20:1/0:0)|lysophosphatidylcholine (20:1/0:0) 1-eicosenoyl-GPC|1-eicosenoyl-GPC (20:1)|1-eicosenoyl-sn-glycero-3-phosphocholine|GPC(20:1)|GPC(20:1/0:0)|LPC(20:1/0:0)|PC(20:1/0:0)|lysophosphatidylcholine (20:1/0:0) http://purl.obolibrary.org/obo/CHEBI_131982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:131992 biolink:ChemicalEntity 5,6-EET(1-) An EET(1−) that is the conjugate base of 5,6-EET, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:8631948 Graph 4-{3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trien-1-yl]oxiran-2-yl}butanoate|5,6-EpETrE|5,6-epoxy-(8Z,11Z,14Z)-eicosatrienoate|5,6-epoxy-(8Z,11Z,14Z)-icosatrienoate 4-{3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trien-1-yl]oxiran-2-yl}butanoate 4-{3-[(2Z,5Z,8Z)-tetradeca-2,5,8-trien-1-yl]oxiran-2-yl}butanoate|5,6-EpETrE|5,6-epoxy-(8Z,11Z,14Z)-eicosatrienoate|5,6-epoxy-(8Z,11Z,14Z)-icosatrienoate http://purl.obolibrary.org/obo/CHEBI_131992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132007 biolink:ChemicalEntity cholesteryl icosapentaenoate A cholesterol ester in which the acyl group contains 20 carbons and 5 double bonds. Graph CE(20:5)|cholesteryl eicosapentaenoate CE(20:5)|cholesteryl eicosapentaenoate http://purl.obolibrary.org/obo/CHEBI_132007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132016 biolink:ChemicalEntity 17-HETE(1-) A HETE anion that is the conjugate base of 17-HETE, arising from deprotonation of the carboxy group; major species at pH 7.3. pubmed:15041462 Graph (5Z,8Z,11Z,14Z)-17-hydroxyeicosatetraenoate|(5Z,8Z,11Z,14Z)-17-hydroxyicosa-5,8,11,14-tetraenoate|(5Z,8Z,11Z,14Z)-17-hydroxyicosatetraenoate|17-hydroxy-(5Z,8Z,11Z,14Z)-eicosatetraenoate|17-hydroxy-(5Z,8Z,11Z,14Z)-icosatetraenoate|17-hydroxyarachidonate (5Z,8Z,11Z,14Z)-17-hydroxyicosa-5,8,11,14-tetraenoate (5Z,8Z,11Z,14Z)-17-hydroxyeicosatetraenoate|(5Z,8Z,11Z,14Z)-17-hydroxyicosa-5,8,11,14-tetraenoate|(5Z,8Z,11Z,14Z)-17-hydroxyicosatetraenoate|17-hydroxy-(5Z,8Z,11Z,14Z)-eicosatetraenoate|17-hydroxy-(5Z,8Z,11Z,14Z)-icosatetraenoate|17-hydroxyarachidonate http://purl.obolibrary.org/obo/CHEBI_132016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132019 biolink:ChemicalEntity 16-HETE(1-) A HETE anion that is the conjugate base of 16-HETE, arising from deprotonation of the carboxy group; major species at pH 7.3. pubmed:15041462 Graph (5Z,8Z,11Z,14Z)-16-hydroxyeicosatetraenoate|(5Z,8Z,11Z,14Z)-16-hydroxyicosa-5,8,11,14-tetraenoate|(5Z,8Z,11Z,14Z)-16-hydroxyicosatetraenoate|(all-cis)-16-hydroxy-5,8,11,14-eicosatetraenoate|(all-cis)-16-hydroxy-5,8,11,14-icosatetraenoate|16-hydroxy -(5Z,8Z,11Z,14Z)-icosatetraenoate|16-hydroxy-(5Z,8Z,11Z,14Z)-eicosatetraenoate|16-hydroxyarachidonate (5Z,8Z,11Z,14Z)-16-hydroxyicosa-5,8,11,14-tetraenoate (5Z,8Z,11Z,14Z)-16-hydroxyeicosatetraenoate|(5Z,8Z,11Z,14Z)-16-hydroxyicosa-5,8,11,14-tetraenoate|(5Z,8Z,11Z,14Z)-16-hydroxyicosatetraenoate|(all-cis)-16-hydroxy-5,8,11,14-eicosatetraenoate|(all-cis)-16-hydroxy-5,8,11,14-icosatetraenoate|16-hydroxy -(5Z,8Z,11Z,14Z)-icosatetraenoate|16-hydroxy-(5Z,8Z,11Z,14Z)-eicosatetraenoate|16-hydroxyarachidonate http://purl.obolibrary.org/obo/CHEBI_132019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132023 biolink:ChemicalEntity S-acyl-4'-phosphopantetheine(2-) A phosphopantetheine anion obtained by deprotonation of the phosphate OH groups of any S-acyl-4'-phosphopantetheine; major species at pH 7.3. pubmed:18799520 Graph S-acyl-D-pantetheine 4'-phosphate(2-)|an acyl-4'-phosphopantetheine S-acyl-D-pantetheine 4'-phosphate(2-)|an acyl-4'-phosphopantetheine http://purl.obolibrary.org/obo/CHEBI_132023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132028 biolink:ChemicalEntity tauroursodeoxycholate An organosulfonate oxoanion that is the conjugate base of tauroursodeoxycholic acid arising from deprotonation of the sulfonate OH group; major species at pH 7.3. metacyc.compound:CPD-18799|pubmed:16332456|reaxys:3919128 Graph 2-[(3alpha,7beta-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate|2-{[(3alpha,5beta,7beta)-3,7-dihydroxy-24-oxocholan-24-yl]amino}ethane-1-sulfonate|N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)taurine(1-)|N-ursodeoxycholoyltaurine(1-)|tauroursodeoxycholate 2-[(3alpha,7beta-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate 2-[(3alpha,7beta-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate|2-{[(3alpha,5beta,7beta)-3,7-dihydroxy-24-oxocholan-24-yl]amino}ethane-1-sulfonate|N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)taurine(1-)|N-ursodeoxycholoyltaurine(1-)|tauroursodeoxycholate http://purl.obolibrary.org/obo/CHEBI_132028 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132040 biolink:ChemicalEntity fatty acid-taurine conjugate(1-) An organosulfonate oxoanion obtained by deprotonation of the sulfonate group of any fatty acid-taurine conjugate; major species at pH 7.3. Graph an N-fatty acyl-taurine|fatty acid-taurine conjugate anion an N-fatty acyl-taurine|fatty acid-taurine conjugate anion http://purl.obolibrary.org/obo/CHEBI_132040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132041 biolink:ChemicalEntity perindoprilat A dipeptide obtained by formal condensation of one of the carboxy groups of N-[(1S)-1-carboxyethyl]-L-norvaline with the amino group of (2S,3aS,7aS)-octahydroindole-2-carboxylic acid. The major active metabolite of perindopril. cas:95153-31-4|hmdb:HMDB0060574|pdb-ccd:X94|pubmed:1457697|pubmed:14730103|pubmed:16094492|pubmed:16709467|pubmed:17901571|pubmed:18156630|pubmed:19641692|pubmed:1995891|pubmed:20195579|pubmed:21411099|pubmed:21650082|pubmed:22935500|pubmed:23124459|pubmed:24588464|pubmed:24799074|pubmed:25485905|pubmed:26365335|pubmed:26794937|pubmed:26988149|pubmed:27422988|pubmed:27803936|reaxys:4207072 Graph (2S,3aS,7aS)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid|N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline|S 9780|S-9780|perindoprilate|perindoprilato|perindoprilatum|perondropilat N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline (2S,3aS,7aS)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid|N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline|S 9780|S-9780|perindoprilate|perindoprilato|perindoprilatum|perondropilat http://purl.obolibrary.org/obo/CHEBI_132041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132047 biolink:ChemicalEntity N-stearoyltaurine(1-) A fatty acid-taurine conjugate obtained by deprotonation of the sulfonate group of N-stearoyltaurine; major species at pH 7.3. pubmed:17116739 Graph 2-(octadecanoylamino)ethane-1-sulfonate|N-octadecanoyl-taurine|N-octadecanoyltaurine(1-)|N-stearoyltaurine(1-) 2-(octadecanoylamino)ethane-1-sulfonate 2-(octadecanoylamino)ethane-1-sulfonate|N-octadecanoyl-taurine|N-octadecanoyltaurine(1-)|N-stearoyltaurine(1-) http://purl.obolibrary.org/obo/CHEBI_132047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132058 biolink:ChemicalEntity N-pentacosanoylsphingosine-1-phosphocholine A sphingomyelin d18:1 obtained by formal condensation of the carboxy group of pentacosanoic acid with the amino group of sphingosine. lipidmaps:LMSP03010027 Graph (2S,3R,4E)-3-hydroxy-2-(pentacosanoylamino)octadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate|C25-Sphingomyelin|N-(pentacosanoyl)-sphing-4-enine-1-phosphocholine|N-pentacosanoylsphing-4-enine-1-phosphocholine|SM(d18:1/25:0)|sphingomyelin d18:1/25:0 (2S,3R,4E)-3-hydroxy-2-(pentacosanoylamino)octadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate (2S,3R,4E)-3-hydroxy-2-(pentacosanoylamino)octadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate|C25-Sphingomyelin|N-(pentacosanoyl)-sphing-4-enine-1-phosphocholine|N-pentacosanoylsphing-4-enine-1-phosphocholine|SM(d18:1/25:0)|sphingomyelin d18:1/25:0 http://purl.obolibrary.org/obo/CHEBI_132058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132059 biolink:ChemicalEntity sphingomyelin 43:1 A sphingomyelin in which the total number of carbons in the sphingoid base and fatty acyl groups is 43 with 1 double bond. Graph SM 43:1|SM(43:1)|sphingomyelin(43:1) SM 43:1|SM(43:1)|sphingomyelin(43:1) http://purl.obolibrary.org/obo/CHEBI_132059 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132069 biolink:ChemicalEntity (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate A cyclic purine nucleotide obtained by formation of a bond between positions 3' and 8 of guanosine 5'-triphosphate. metacyc.compound:CPD-19179|pubmed:25941396|reaxys:28243020 Graph 3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate 3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate http://purl.obolibrary.org/obo/CHEBI_132069 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132070 biolink:ChemicalEntity eoxin A4(1-) A polyunsaturated fatty acid anion that is the conjugate base of eoxin A4, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:23242647 Graph (14S,15S)-epoxy-(5Z,8Z,10E,12E)-eicosatetraenoate|(14S,15S)-epoxy-(5Z,8Z,10E,12E)-icosatetraenoate|(5Z,8Z,10E,12E)-13-[(2S,3S)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoate|14(S),15(S)-EETeTr(1-)|14(S),15(S)-EpETE(1-) (5Z,8Z,10E,12E)-13-[(2S,3S)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoate (14S,15S)-epoxy-(5Z,8Z,10E,12E)-eicosatetraenoate|(14S,15S)-epoxy-(5Z,8Z,10E,12E)-icosatetraenoate|(5Z,8Z,10E,12E)-13-[(2S,3S)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoate|14(S),15(S)-EETeTr(1-)|14(S),15(S)-EpETE(1-) http://purl.obolibrary.org/obo/CHEBI_132070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132079 biolink:ChemicalEntity resolvin D1(1-) A polyunsaturated fatty acid anion that is the conjugate base of resolvin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. hmdb:HMDB0003733|pubmed:17244615 Graph (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoate|RvD1(1-)|resolvin D1 (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoate (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoate|RvD1(1-)|resolvin D1 http://purl.obolibrary.org/obo/CHEBI_132079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132080 biolink:ChemicalEntity 8-oxoresolvin D1(1-) A polyunsaturated fatty acid anion that is the conjugate base of 8-oxoresolvin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoate|8-oxoresolvin D1 (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoate (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoate|8-oxoresolvin D1 http://purl.obolibrary.org/obo/CHEBI_132080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132081 biolink:ChemicalEntity 17-oxoresolvin D1(1-) A polyunsaturated fatty acid that is the conjugate base of 17-oxoresolvin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:17244615 Graph (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoate|17-oxo-RvD1(1-)|17-oxoresolvin D1 (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoate (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoate|17-oxo-RvD1(1-)|17-oxoresolvin D1 http://purl.obolibrary.org/obo/CHEBI_132081 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132082 biolink:ChemicalEntity entinostat A member of the class of benzamides resulting from the formal condensation of the carboxy group of the pyridin-3-ylmethyl carbamate derivative of p-(aminomethyl)benzoic acid with one of the amino groups of benzene-1,2-diamine. It is an inhibitor of histone deacetylase isoform 1 (HDAC1) and isoform 3 (HDAC3). cas:209783-80-2|kegg.drug:D09338|lincs.smallmolecule:LSM-4811|pubmed:10200307|pubmed:12414635|pubmed:21767511|pubmed:23247046|pubmed:23410027|pubmed:24147654|pubmed:25610877|pubmed:26098363|pubmed:26464689|pubmed:26614912|pubmed:26711240|pubmed:27151994|reaxys:8442710|wikipedia.en:Entinostat Graph BAY 86-5274|BAY86-5274|MS 27-275|MS 275|MS-27-275|MS-275|N-(2-aminophenyl)-4-(N-(pyridin-3-ylmethoxycarbonyl)aminomethyl)benzamide|N-[[4-[(2-aminoanilino)-oxomethyl]phenyl]methyl]carbamic acid 3-pyridinylmethyl ester|SNDX 275|SNDX-275|entinostat|entinostatum|pyridin-3-ylmethyl {4-[(2-aminophenyl)carbamoyl]benzyl}carbamate pyridin-3-ylmethyl {4-[(2-aminophenyl)carbamoyl]benzyl}carbamate BAY 86-5274|BAY86-5274|MS 27-275|MS 275|MS-27-275|MS-275|N-(2-aminophenyl)-4-(N-(pyridin-3-ylmethoxycarbonyl)aminomethyl)benzamide|N-[[4-[(2-aminoanilino)-oxomethyl]phenyl]methyl]carbamic acid 3-pyridinylmethyl ester|SNDX 275|SNDX-275|entinostat|entinostatum|pyridin-3-ylmethyl {4-[(2-aminophenyl)carbamoyl]benzyl}carbamate http://purl.obolibrary.org/obo/CHEBI_132082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132083 biolink:ChemicalEntity 18(S)-HEPE(1-) An 18-HEPE(1−) that is the conjugate base of 18(S)-HEPE, arising from deprotonation of the carboxylic acid group; major species at pH 7.3. pubmed:21206090 Graph (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-eicosapentaenoate|(18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-icosapentaenoate|(5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoate (5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoate (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-eicosapentaenoate|(18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-icosapentaenoate|(5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoate http://purl.obolibrary.org/obo/CHEBI_132083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132085 biolink:ChemicalEntity O(3)-(beta-D-xylosyl)-L-serine residue An L-α-amino acid residue derived from O3-(β-D-xylosyl)-L-serine. metacyc.compound:Core-Protein-L-Ser-Xyl Graph O(3)-(beta-D-xylosyl)-L-serine residue O(3)-(beta-D-xylosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_132085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132088 biolink:ChemicalEntity O(3)-(beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue An L-α-amino acid residue derived from O3-(β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine. metacyc.compound:CPD-8202 Graph O(3)-(4-beta-D-galactosyl-beta-D-xylosyl)-L-serine residue O(3)-(4-beta-D-galactosyl-beta-D-xylosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_132088 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13209 biolink:ChemicalEntity long-chain fatty acid ethyl ester A fatty acid ethyl ester resulting from the formal condensation of the carboxy group of a long-chain fatty acid with the hydroxy group of ethanol. Graph a long-chain fatty acyl ethyl ester|long-chain fatty acid ethyl esters|long-chain fatty acyl ethyl ester|long-chain fatty acyl ethyl esters a long-chain fatty acyl ethyl ester|long-chain fatty acid ethyl esters|long-chain fatty acyl ethyl ester|long-chain fatty acyl ethyl esters http://purl.obolibrary.org/obo/CHEBI_13209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132090 biolink:ChemicalEntity O(3)-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue An L-α-amino acid residue derived from O3-(β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine metacyc.compound:Gal-Gal-Xyl-Proteins Graph O(3)-(beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser residue|O(3)-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue O(3)-(beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser residue|O(3)-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_132090 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132091 biolink:ChemicalEntity (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate An icosanoid anion that is the conjugate base of (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid, arising from deprotonation of the carboxylic acid group; major species at pH 7.3. Graph (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate|18(S)-hydroxy-5(S)-HpEPE(1-)|18S-hydroxy-5S-HpEPE(1-) (5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate|18(S)-hydroxy-5(S)-HpEPE(1-)|18S-hydroxy-5S-HpEPE(1-) http://purl.obolibrary.org/obo/CHEBI_132091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132093 biolink:ChemicalEntity O(3)-(beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue An organic anionic group obtained by deprotonation of the glucuronosyl carboxy group of O3-(β-D-glucuronosyl-(1→3)-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine residue; major species at pH 7.3. metacyc.compound:GlcA-Gal-Gal-Xyl-Proteins Graph 3-O-(beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser(1-) residue 3-O-(beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser(1-) residue http://purl.obolibrary.org/obo/CHEBI_132093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132097 biolink:ChemicalEntity methoxyacetate A monocarboxylic acid anion that is the conjugate base of methoxyacetic acid, obtained by deprotonation of the carboxy group. metacyc.compound:CPD-12993|reaxys:3536277 Graph methoxyacetate methoxyacetate methoxyacetate http://purl.obolibrary.org/obo/CHEBI_132097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132098 biolink:ChemicalEntity methoxyacetic acid A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is replaced by a methoxy group. cas:625-45-6|hmdb:HMDB0041929|metacyc.compound:CPD-12993|pubmed:23290149|pubmed:23290947|pubmed:24798094|pubmed:25606576|pubmed:26001161|pubmed:26006246|pubmed:26802500|reaxys:635800 Graph 2-Methoxyacetic acid|CH3OCH2COOH|Methoxyethanoic acid|methoxyacetic acid methoxyacetic acid 2-Methoxyacetic acid|CH3OCH2COOH|Methoxyethanoic acid|methoxyacetic acid http://purl.obolibrary.org/obo/CHEBI_132098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132102 biolink:ChemicalEntity buspirone(1+) An ammonium ion resulting from the addition of a proton to the piperazine nitrogen that is not attached to the pyrimidinyl group. The major species at pH 7.3. Graph 1-[4-(7,9-dioxo-8-azaspiro[4.5]decan-8-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium 1-[4-(7,9-dioxo-8-azaspiro[4.5]decan-8-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium 1-[4-(7,9-dioxo-8-azaspiro[4.5]decan-8-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium http://purl.obolibrary.org/obo/CHEBI_132102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132104 biolink:ChemicalEntity O(3)-(N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue An organic anionic group obtained by deprotonation of the glucuronosyl carboxy group of O3-(N-acetyl-α-D-glucosaminyl-(1→4)-β-D-glucuronosyl-(1→3)-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine residue. metacyc.compound:GlcNAc-GlcA-Gal-Gal-Xyl-Protein Graph 3-O-(N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(alpha-D-GlcNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser(1-) residue 3-O-(N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(alpha-D-GlcNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-Ser(1-) residue http://purl.obolibrary.org/obo/CHEBI_132104 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132105 biolink:ChemicalEntity O(3)-(N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue An organic anionic group obtained by deprotonation of the glucuronosyl carboxy group of O3-(N-acetyl-β-D-glucosaminyl-(1→4)-β-D-glucuronosyl-(1→3)-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine residue. metacyc.compound:GalNAc-GlcA-Gal-Gal-Xyl-Proteins Graph O(3)-(N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine(1-) residue O(3)-(N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue|O(3)-(beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine(1-) residue http://purl.obolibrary.org/obo/CHEBI_132105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132106 biolink:ChemicalEntity sodium propionate An organic sodium salt comprising equal numbers of sodium and propionate ions. cas:137-40-6|kegg.drug:D08440|pubmed:26141376|pubmed:27173555|reaxys:3566934|wikipedia.en:Sodium_propionate Graph E281|Natriumpropionat|Propanoic acid, sodium salt|Propionic acid sodium salt|Sodium propionate anhydrous|sodium propanoate sodium propanoate E281|Natriumpropionat|Propanoic acid, sodium salt|Propionic acid sodium salt|Sodium propionate anhydrous|sodium propanoate http://purl.obolibrary.org/obo/CHEBI_132106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132111 biolink:ChemicalEntity syringate A methoxybenzoate that is the conjugate base of syringic acid, obtained by deprotonation of the carboxy group. reaxys:3675103 Graph 4-hydroxy-3,5-dimethoxybenzoate|syringate 4-hydroxy-3,5-dimethoxybenzoate 4-hydroxy-3,5-dimethoxybenzoate|syringate http://purl.obolibrary.org/obo/CHEBI_132111 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132112 biolink:ChemicalEntity sodium thiosulfate An inorganic sodium salt composed of sodium and thiosulfate ions in a 2:1 ratio. cas:7772-98-7|foodb.food:FDB015436|pubmed:26269005|pubmed:26494591|pubmed:26623950|pubmed:26723482|pubmed:26799451|pubmed:26856696|pubmed:26871829|pubmed:27051974|pubmed:27094188|pubmed:27163355|reaxys:11323704|wikipedia.en:Sodium_thiosulfate Graph Disodium thiosulfate|Sodium hyposulfite|Sodium oxide sulfide|Sodium thiosulphate|Thiosulfuric acid, disodium salt|anhydrous sodium thiosulfate|disodium sulfurothioate|sodium thiosulfate (anhydrous) disodium sulfurothioate Disodium thiosulfate|Sodium hyposulfite|Sodium oxide sulfide|Sodium thiosulphate|Thiosulfuric acid, disodium salt|anhydrous sodium thiosulfate|disodium sulfurothioate|sodium thiosulfate (anhydrous) http://purl.obolibrary.org/obo/CHEBI_132112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132114 biolink:ChemicalEntity UDP-N-acetyl-alpha-D-galactosamine 4-sulfate(3-) A UDP-N-acetyl-D-galactosamine 4-sulfate(4−) in which the anomeric centre of the galactosamine fragment has α-configuration Graph UDP-N-acetyl-alpha-D-galactosamine 4-sulfate UDP-N-acetyl-alpha-D-galactosamine 4-sulfate http://purl.obolibrary.org/obo/CHEBI_132114 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132115 biolink:ChemicalEntity UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate(4-) A UDP-N-acetyl-D-galactosamine 4,6-bissulfate(4−) in which the anomeric centre of the galactosamine fragment has α-configuration Graph UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate http://purl.obolibrary.org/obo/CHEBI_132115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132116 biolink:ChemicalEntity 2-hydroxyisobutanoyl-CoA A hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-hydroxyisobutanoic acid. metacyc.compound:CPD-19040|pubmed:22433853|pubmed:25720495|pubmed:25911482|reaxys:22539664 Graph 2-hydroxyisobutanoyl-coenzyme A|2-hydroxyisobutyryl-CoA|2-hydroxyisobutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-hydroxyisobutanoyl-coenzyme A|2-hydroxyisobutyryl-CoA|2-hydroxyisobutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_132116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132120 biolink:ChemicalEntity resolvin Hydroxy fatty acids that are di- or trihydroxy metabolites of the polyunsaturated ω-3 fatty acids, particularly icosapentaenoic acid, docosahexaenoic acid and docosapentaenoic acid. pubmed:25359497|pubmed:26546247|pubmed:26986653|wikipedia.en:Resolvin Graph resolution phase interaction product|resolution phase interaction products|resolvins resolution phase interaction product|resolution phase interaction products|resolvins http://purl.obolibrary.org/obo/CHEBI_132120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132123 biolink:ChemicalEntity 1,2-benzoquinones Any member of the class of orthoquinones that is 1,2-benzoquinone or its C-substituted derivatives. Graph a 1,2-benzoquinone|o-benzoquinones|ortho-benzoquinones a 1,2-benzoquinone|o-benzoquinones|ortho-benzoquinones http://purl.obolibrary.org/obo/CHEBI_132123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132124 biolink:ChemicalEntity 1,4-benzoquinones Any member of the class of benzoquinones that is 1,4-benzoquinone or its C-substituted derivatives. Graph a quinone|p-benzoquinones|para-benzoquinones a quinone|p-benzoquinones|para-benzoquinones http://purl.obolibrary.org/obo/CHEBI_132124 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132126 biolink:ChemicalEntity dihydroxy-1,4-benzoquinones A hydroxybenzoquinone that is any 1,4-benzoquinone in which two of the substituents on the quinone ring are hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_132126 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132127 biolink:ChemicalEntity hepoxilin A3(1-) A hepoxilin anion that is the conjugate base of hepoxilin A3, arising from deprotonation of the carboxylic acid group; major species at pH 7.3. Graph (5Z,9E)-8-hydroxy-10-{(2S,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoate|8-hydroxy-(11S,12S)-epoxy-(5Z,9E,14Z)-eicosatrienoate|8-hydroxy-(11S,12S)-epoxy-(5Z,9E,14Z)-icosatrienoate (5Z,9E)-8-hydroxy-10-{(2S,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoate (5Z,9E)-8-hydroxy-10-{(2S,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoate|8-hydroxy-(11S,12S)-epoxy-(5Z,9E,14Z)-eicosatrienoate|8-hydroxy-(11S,12S)-epoxy-(5Z,9E,14Z)-icosatrienoate http://purl.obolibrary.org/obo/CHEBI_132127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132130 biolink:ChemicalEntity hydroxyquinone Any quinone in which one or more of the carbons making up the quinone moiety is substituted by a hydroxy group. Graph hydroxyquinones hydroxyquinones http://purl.obolibrary.org/obo/CHEBI_132130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132141 biolink:ChemicalEntity 1,2-naphthoquinones Any napthoquinone in which the oxo groups of the quinone moiety are at the 1 and 2 positions of the naphthalene ring. Graph http://purl.obolibrary.org/obo/CHEBI_132141 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132142 biolink:ChemicalEntity 1,4-naphthoquinones A naphthoquinone in which the oxo groups of the quinone moiety are at positions 1 and 4 of the parent naphthalene ring. Graph http://purl.obolibrary.org/obo/CHEBI_132142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132151 biolink:ChemicalEntity beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc(1-) A monocarboxylic acid anion obtained by deprotonation of the carboxy group of β-D-4-deoxy-Δ4-GlcpA-(1→3)-D-GlcpNAc; major species at pH 7.3. metacyc.compound:CPD-13473 Graph 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-D-glucopyranose|3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine|3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine(1-)|4-deoxy-beta-D-gluc-4-enuronosyl-(1->3)-N-acetyl-D-glucosamine|beta-D-4-deoxy-Delta(4)-GlcA-(1->3)-D-GlcNAc(1-) 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-D-glucopyranose 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranuronosyl)-D-glucopyranose|3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine|3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine(1-)|4-deoxy-beta-D-gluc-4-enuronosyl-(1->3)-N-acetyl-D-glucosamine|beta-D-4-deoxy-Delta(4)-GlcA-(1->3)-D-GlcNAc(1-) http://purl.obolibrary.org/obo/CHEBI_132151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132153 biolink:ChemicalEntity hyaluronate A carbohydrate acid derivative anion obtained by deprotonation of the carboxy groups of hyaluronic acid; major species at pH 7.3. Graph hyaluronan|hyaluronate polyanion hyaluronan|hyaluronate polyanion http://purl.obolibrary.org/obo/CHEBI_132153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132154 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminyl-(1->4)-[hyaluronate] A carbohydrate acid derivative anion obtained by deprotonation of the carboxy groups of N-acetyl-β-D-glucosaminyl-(1→4)-[hyaluronic acid]; major species at pH 7.3. metacyc.compound:Hyaluronan-NAc-glucosaminide Graph N-acetyl-beta-D-glucosaminyl-(1->4)-[hyaluronan] N-acetyl-beta-D-glucosaminyl-(1->4)-[hyaluronan] http://purl.obolibrary.org/obo/CHEBI_132154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132155 biolink:ChemicalEntity hydroxynaphthoquinone Any naphthoquinone in which the naphthaoquinone moiety is substituted by at least one hydroxy group. wikipedia.en:Hydroxynaphthoquinone Graph hydroxynaphthoquinones hydroxynaphthoquinones http://purl.obolibrary.org/obo/CHEBI_132155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132157 biolink:ChemicalEntity hydroxy-1,4-naphthoquinone Any member of the class of 1,4-naphthoquinones in which the naphthoquinone moiety is substituted by at least one hydroxy group. Graph hydroxy-1,4-naphthoquinones hydroxy-1,4-naphthoquinones http://purl.obolibrary.org/obo/CHEBI_132157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132174 biolink:ChemicalEntity beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(2-) A β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) in which the anomeric centre connected to the diphosphate group has α-configuration. Graph 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|Glc-GlcNAc-PP-undecaprenol(2-)|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(2-) 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|Glc-GlcNAc-PP-undecaprenol(2-)|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(2-) http://purl.obolibrary.org/obo/CHEBI_132174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132177 biolink:ChemicalEntity 2-hydroxy-3-methyl-2-butenoic acid An α,β-unsaturated monocarboxylic acid that is 3-methylbut-2-enoic acid in which the hydrogen at position 2 has been replaced by a hydroxy group. chemspider:28716810 Graph 2-hydroxy-3-methylbut-2-enoic acid 2-hydroxy-3-methylbut-2-enoic acid 2-hydroxy-3-methylbut-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_132177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132188 biolink:ChemicalEntity methionine sulfone A methionine derivative in which the sulfur has been oxidised to the corresponding sulfone. cas:820-10-0|chemspider:63154|reaxys:1725512 Graph 2-amino-4-(methanesulfonyl)butanoic acid|methionine S,S-dioxide|methionine sulfone 2-amino-4-(methanesulfonyl)butanoic acid 2-amino-4-(methanesulfonyl)butanoic acid|methionine S,S-dioxide|methionine sulfone http://purl.obolibrary.org/obo/CHEBI_132188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132198 biolink:ChemicalEntity pentahydroxyanthraquinone An anthraquinone in which the anthraquinone moiety is substituted by a five hydroxy groups. Graph pentahydroxyanthraquinones pentahydroxyanthraquinones http://purl.obolibrary.org/obo/CHEBI_132198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132202 biolink:ChemicalEntity (2R)-CDP-glycerol A CDP-glycerol in which the 2-postion of the glycerol portion has R-configuration. kegg.compound:C00513|metacyc.compound:CPD-606|reaxys:69438 Graph (2R)-cytidine 5'-diphosphate glycerol|(2R)-cytidine diphosphate glycerol|5'-O-[({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine|cytidine 5'-{3-[(2R)-2,3-dihydroxypropyl] dihydrogen diphosphate} 5'-O-[({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine (2R)-cytidine 5'-diphosphate glycerol|(2R)-cytidine diphosphate glycerol|5'-O-[({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]cytidine|cytidine 5'-{3-[(2R)-2,3-dihydroxypropyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_132202 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132210 biolink:ChemicalEntity N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(2-) An N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2−) in which the anomeric centre connected to the diphosphate group has α-configuration. metacyc.compound:ACETYL-ETCETERA-GLUCOSAMINYLDIPHOSPHOUND Graph 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|ManNAc-GlcNAc-PP-undecaprenol(2-)|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(2-) 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|ManNAc-GlcNAc-PP-undecaprenol(2-)|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(2-) http://purl.obolibrary.org/obo/CHEBI_132210 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132211 biolink:ChemicalEntity 4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(3-) An organophosphate oxoanion obtained by deprotonation of the phosphate and diphosphate functions of 4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-5802 Graph 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy]phosphinato}-beta-D-glucopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|4-O-((2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(3-) 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy]phosphinato}-beta-D-glucopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy]phosphinato}-beta-D-glucopyranosyl)-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-glucopyranose|4-O-((2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate|4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate(3-) http://purl.obolibrary.org/obo/CHEBI_132211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132218 biolink:ChemicalEntity 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate An icosanoid anion arising from deprotonation of the carboxylic acid function of 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid; major species at pH 7.3. pubmed:21206090 Graph (5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate|18(R)-hydroxy-5(S)-HpEPE(1-)|5(S)-Hp-18(R)-HEPE(1-) (5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate (5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoate|18(R)-hydroxy-5(S)-HpEPE(1-)|5(S)-Hp-18(R)-HEPE(1-) http://purl.obolibrary.org/obo/CHEBI_132218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132224 biolink:ChemicalEntity 4-O-({poly[(2R)-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate polyanion A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate functions of 4-O-({poly[(2R)-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3. metacyc.compound:Teichoic-P-Gro Graph 4-O-({poly[(2R)-glycerylphospho]}-(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate 4-O-({poly[(2R)-glycerylphospho]}-(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132224 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132228 biolink:ChemicalEntity (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid An epoxy fatty acid consisting of (4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid having an epoxy group at the 13,14-position. An intermediate lipid in specialized proresolving mediators pubmed:23504711|pubmed:27791009 Graph (13S,14S)-epoxy-DHA|(13S,14S)-epoxymaresin|(4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoic acid|13(S),14(S)-epoxy-DHA|13(S),14(S)-epoxydocoshexaenoic acid (4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoic acid (13S,14S)-epoxy-DHA|(13S,14S)-epoxymaresin|(4Z,7Z,9E,11E)-12-{(2S,3S)-3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,9,11-tetraenoic acid|13(S),14(S)-epoxy-DHA|13(S),14(S)-epoxydocoshexaenoic acid http://purl.obolibrary.org/obo/CHEBI_132228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132230 biolink:ChemicalEntity marbofloxacin A fluoroquinolone antibiotic that is 7-oxo-2,3-dihydro-7H-[1,3,4]oxadiazino[6,5,4-ij]quinoline substituted at positions 6, 9 and 10 by carboxy, fluoro and 4-methylpiperazin-1-yl groups, respectively. A synthetic, broad spectrum bactericidal agent, it is used in veterinary medicine, although its mechanism of action is not thoroughly understood. cas:115550-35-1|lincs.smallmolecule:LSM-5799|pubmed:25470431|pubmed:25567298|pubmed:25694049|pubmed:25823453|pubmed:26257726|pubmed:26498102|pubmed:26626889|pubmed:26631082|pubmed:26706558|pubmed:26859613|pubmed:26920300|pubmed:26963935|pubmed:26973615|pubmed:27029676|wikipedia.en:Marbofloxacin Graph 9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,3,4]oxadiazino[6,5,4-ij]quinoline-6-carboxylic acid|marbofloxacin|marbofloxacine|marbofloxacino|marbofloxacinum 9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,3,4]oxadiazino[6,5,4-ij]quinoline-6-carboxylic acid 9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,3,4]oxadiazino[6,5,4-ij]quinoline-6-carboxylic acid|marbofloxacin|marbofloxacine|marbofloxacino|marbofloxacinum http://purl.obolibrary.org/obo/CHEBI_132230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132233 biolink:ChemicalEntity 1-phenylpropan-2-amine A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl groups has been replaced by a phenyl group. Graph 1-phenylpropan-2-amine 1-phenylpropan-2-amine 1-phenylpropan-2-amine http://purl.obolibrary.org/obo/CHEBI_132233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132246 biolink:ChemicalEntity all-trans-3,4-didehydroretinol A retinoid derived from 3,4-desaturation of the β-ionone ring of all-trans-retinol. agr:IND601142190|cas:79-80-1|chemspider:4940721|foodb.food:FDB013830|hmdb:HMDB0013117|kegg.compound:C21797|lipidmaps:LMPR01090008|metacyc.compound:CPD-20073|pubmed:12584011|pubmed:1768425|pubmed:1789986|pubmed:19043141|pubmed:2087172|pubmed:21895779|pubmed:22307745|pubmed:22959581|pubmed:24330939|pubmed:26549260|pubmed:27059013|pubmed:2856858|pubmed:28701464|pubmed:28776449|pubmed:31548472|pubmed:3367238|pubmed:3390455|pubmed:3654104|pubmed:3874747|pubmed:4067325|pubmed:7371787|pubmed:7720529|pubmed:7803489|pubmed:8032128|pubmed:8352734|pubmed:8592069|pubmed:9080660|reaxys:1881707 Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraen-1-ol|3,4-didehydro-all-trans-retinol|3,4-didehydro-retinol|3,4-didehydroretinol|3-dehydoretinol|all-trans-3,4-didehydroretinol|all-trans-3-Dehydroretinol|dehydroretinol|vitamin A2 3,4-didehydroretinol (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraen-1-ol|3,4-didehydro-all-trans-retinol|3,4-didehydro-retinol|3,4-didehydroretinol|3-dehydoretinol|all-trans-3,4-didehydroretinol|all-trans-3-Dehydroretinol|dehydroretinol|vitamin A2 http://purl.obolibrary.org/obo/CHEBI_132246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132248 biolink:ChemicalEntity N(4)-(N-acetyl-beta-D-glucosyl)-L-asparagine residue An L-α-amino acid residue derived from N4-(N-acetyl-β-D-glucosyl)-L-asparagine. metacyc.compound:CPD-8541 Graph N(4)-(N-acetyl-beta-D-glucosyl)-L-asparagine residue N(4)-(N-acetyl-beta-D-glucosyl)-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_132248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132267 biolink:ChemicalEntity triptonide A diterpene triepoxide that is triptobenzene K in which the acylhydroquinone moiety has undergone oxidation to the corresponding triepoxyketone derivative. It has been isolated from the roots of Tripterygium wilfordii. cba:292103|pubmed:10774048|pubmed:12903464|pubmed:24346247|pubmed:25296383|pubmed:25308753|pubmed:5072337|pubmed:8237400|pubmed:9863222|reaxys:5313008 Graph (-)-triptonide|(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione (3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione (-)-triptonide|(3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione http://purl.obolibrary.org/obo/CHEBI_132267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132294 biolink:ChemicalEntity phenylephrine(1+) An organic cation obtained by protonation of the secondary amino function of phenylephrine. Graph (2R)-2-hydroxy-2-(3-hydroxyphenyl)-N-methylethan-1-aminium|phenylephrine cation (2R)-2-hydroxy-2-(3-hydroxyphenyl)-N-methylethan-1-aminium (2R)-2-hydroxy-2-(3-hydroxyphenyl)-N-methylethan-1-aminium|phenylephrine cation http://purl.obolibrary.org/obo/CHEBI_132294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132296 biolink:ChemicalEntity pseudoephedrine(1+) An organic cation obtained by protonation of the secondary amino function of pseudoephedrine. Graph (1S,2S)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium|(1S,2S)-pseudoephedrine|pseudoephedrine cation (1S,2S)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium (1S,2S)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium|(1S,2S)-pseudoephedrine|pseudoephedrine cation http://purl.obolibrary.org/obo/CHEBI_132296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132297 biolink:ChemicalEntity methamphetamine(1+) An organic cation obtained by protonation of the secondary amino function of methamphetamine. Graph (2S)-N-methyl-1-phenylpropan-2-aminium|methamphetamine cation (2S)-N-methyl-1-phenylpropan-2-aminium (2S)-N-methyl-1-phenylpropan-2-aminium|methamphetamine cation http://purl.obolibrary.org/obo/CHEBI_132297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132310 biolink:ChemicalEntity S-acyl-4'-phosphopantetheine A thioester obtained by formal condensation of the thiol group of D-pantetheine 4'-phosphate with the carboxy group of any carboxylic acid. Graph S-acyl-D-pantetheine 4'-phosphate S-acyl-D-pantetheine 4'-phosphate http://purl.obolibrary.org/obo/CHEBI_132310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132356 biolink:ChemicalEntity 4-O-({poly[(2R)-2-glucosyl-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate polyanion A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate functions of 4-O-({poly[(2R)-2-glucosyl-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3. Graph 4-O-((poly((2R)-2-alpha-D-glycosyl-glycerylphospho))-(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate 4-O-((poly((2R)-2-alpha-D-glycosyl-glycerylphospho))-(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132362 biolink:ChemicalEntity citrate(4-) A citrate anion obtained by deprotonation of the three carboxy groups as well as the hydroxy group of citric acid. chemspider:34552020 Graph 2-oxido-1,2,3-propanetricarboxylate|2-oxidopropane-1,2,3-tricarboxylate|citric acid tetraanion 2-oxidopropane-1,2,3-tricarboxylate 2-oxido-1,2,3-propanetricarboxylate|2-oxidopropane-1,2,3-tricarboxylate|citric acid tetraanion http://purl.obolibrary.org/obo/CHEBI_132362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132365 biolink:ChemicalEntity EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor An EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor that interferes with the action of procollagen-proline dioxygenase (EC 1.14.11.2). wikipedia.en:Procollagen-proline_dioxygenase Graph EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitors|EC 1.14.11.2 inhibitor|EC 1.14.11.2 inhibitors|collagen proline hydroxylase inhibitor|collagen proline hydroxylase inhibitors|hydroxylase, collagen proline inhibitor|hydroxylase, collagen proline inhibitors|peptidyl proline hydroxylase inhibitor|peptidyl proline hydroxylase inhibitors|procollagen-L-proline,2-oxoglutarate:oxygen oxidoreductase (4-hydroxylating) inhibitor|procollagen-L-proline,2-oxoglutarate:oxygen oxidoreductase (4-hydroxylating) inhibitors|procollagen-proline 4-dioxygenase inhibitor|procollagen-proline 4-dioxygenase inhibitors|procollagen-proline dioxygenase (EC 1.14.11.2) inhibitor|procollagen-proline dioxygenase (EC 1.14.11.2) inhibitors|procollagen-proline dioxygenase inhibitor|procollagen-proline dioxygenase inhibitors|procollagen-proline,2-oxoglutarate-4-dioxygenase inhibitor|procollagen-proline,2-oxoglutarate-4-dioxygenase inhibitors|proline hydroxylase inhibitor|proline hydroxylase inhibitors|proline protocollagen hydroxylase inhibitor|proline protocollagen hydroxylase inhibitors|proline, 2-oxoglutarate dioxygenase inhibitor|proline, 2-oxoglutarate dioxygenase inhibitors|proline,2-oxoglutarate 4-dioxygenase inhibitor|proline,2-oxoglutarate 4-dioxygenase inhibitors|prolyl 4-hydroxylase inhibitor|prolyl 4-hydroxylase inhibitors|prolyl hydroxylase inhibitor|prolyl hydroxylase inhibitors|prolyl-glycyl-peptide, 2-oxoglutarate:oxygen oxidoreductase, 4-hydroxylating inhibitor|prolyl-glycyl-peptide, 2-oxoglutarate:oxygen oxidoreductase, 4-hydroxylating inhibitors|prolylprotocollagen dioxygenase inhibitor|prolylprotocollagen dioxygenase inhibitors|prolylprotocollagen hydroxylase inhibitor|prolylprotocollagen hydroxylase inhibitors|protocollagen hydroxylase inhibitor|protocollagen hydroxylase inhibitors|protocollagen proline 4-hydroxylase inhibitor|protocollagen proline 4-hydroxylase inhibitors|protocollagen proline dioxygenase inhibitor|protocollagen proline dioxygenase inhibitors|protocollagen proline hydroxylase inhibitor|protocollagen proline hydroxylase inhibitors|protocollagen prolyl hydroxylase inhibitor|protocollagen prolyl hydroxylase inhibitors EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitors|EC 1.14.11.2 inhibitor|EC 1.14.11.2 inhibitors|collagen proline hydroxylase inhibitor|collagen proline hydroxylase inhibitors|hydroxylase, collagen proline inhibitor|hydroxylase, collagen proline inhibitors|peptidyl proline hydroxylase inhibitor|peptidyl proline hydroxylase inhibitors|procollagen-L-proline,2-oxoglutarate:oxygen oxidoreductase (4-hydroxylating) inhibitor|procollagen-L-proline,2-oxoglutarate:oxygen oxidoreductase (4-hydroxylating) inhibitors|procollagen-proline 4-dioxygenase inhibitor|procollagen-proline 4-dioxygenase inhibitors|procollagen-proline dioxygenase (EC 1.14.11.2) inhibitor|procollagen-proline dioxygenase (EC 1.14.11.2) inhibitors|procollagen-proline dioxygenase inhibitor|procollagen-proline dioxygenase inhibitors|procollagen-proline,2-oxoglutarate-4-dioxygenase inhibitor|procollagen-proline,2-oxoglutarate-4-dioxygenase inhibitors|proline hydroxylase inhibitor|proline hydroxylase inhibitors|proline protocollagen hydroxylase inhibitor|proline protocollagen hydroxylase inhibitors|proline, 2-oxoglutarate dioxygenase inhibitor|proline, 2-oxoglutarate dioxygenase inhibitors|proline,2-oxoglutarate 4-dioxygenase inhibitor|proline,2-oxoglutarate 4-dioxygenase inhibitors|prolyl 4-hydroxylase inhibitor|prolyl 4-hydroxylase inhibitors|prolyl hydroxylase inhibitor|prolyl hydroxylase inhibitors|prolyl-glycyl-peptide, 2-oxoglutarate:oxygen oxidoreductase, 4-hydroxylating inhibitor|prolyl-glycyl-peptide, 2-oxoglutarate:oxygen oxidoreductase, 4-hydroxylating inhibitors|prolylprotocollagen dioxygenase inhibitor|prolylprotocollagen dioxygenase inhibitors|prolylprotocollagen hydroxylase inhibitor|prolylprotocollagen hydroxylase inhibitors|protocollagen hydroxylase inhibitor|protocollagen hydroxylase inhibitors|protocollagen proline 4-hydroxylase inhibitor|protocollagen proline 4-hydroxylase inhibitors|protocollagen proline dioxygenase inhibitor|protocollagen proline dioxygenase inhibitors|protocollagen proline hydroxylase inhibitor|protocollagen proline hydroxylase inhibitors|protocollagen prolyl hydroxylase inhibitor|protocollagen prolyl hydroxylase inhibitors http://purl.obolibrary.org/obo/CHEBI_132365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132367 biolink:ChemicalEntity beta-D-glucuronoside(1-) A carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of any β-D-glucuronoside. Graph acceptor beta-D-glucuronoside acceptor beta-D-glucuronoside http://purl.obolibrary.org/obo/CHEBI_132367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132368 biolink:ChemicalEntity glucuronate acceptor Any organic molecular entity that acts as a glucuronate acceptor. Graph glucuronate acceptor glucuronate acceptor http://purl.obolibrary.org/obo/CHEBI_132368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132415 biolink:ChemicalEntity O(3)-(poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue An L-α-amino acid residue derived from O3-(poly[(1→4)-β-D-glucuronosyl-(1→4)-N-acetyl-α-D-glucosaminyl]-(1→4)-β-D-glucuronosyl-(1→3)-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine. Graph O(3)-(poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue O(3)-(poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_132415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132416 biolink:ChemicalEntity O(3)-(N-acetyl-alpha-D-glucosaminyl-poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue An α-amino acid residue anion derived from O3-(N-acetyl-α-D-glucosaminyl-poly[(1→4)-β-D-glucuronosyl-(1→4)-N-acetyl-α-D-glucosaminyl]-(1→4)-β-D-glucuronosyl-(1→3)-β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-xylosyl)-L-serine Graph O(3)-(N-acetyl-alpha-D-glucosaminyl-poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue O(3)-(N-acetyl-alpha-D-glucosaminyl-poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_132416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132471 biolink:ChemicalEntity (+)-schisandrin B An organic heterotetracyclic compound that is found in Fructus Schisandrae and Schisandra chinensis. cas:61281-37-6|pubmed:24155209|pubmed:25756908|pubmed:25944533|pubmed:26349966|pubmed:26492645|pubmed:26666831|pubmed:26832323|pubmed:26916957|pubmed:26930483|pubmed:27085037|pubmed:27195753|pubmed:27213323|pubmed:28577438|pubmed:28601638|pubmed:28748322|pubmed:28794616|pubmed:28827665|pubmed:28833320|pubmed:28837807|pubmed:28846887|pubmed:28860616|pubmed:29031142|pubmed:29115607|pubmed:29166724|pubmed:29393335|pubmed:29405807|pubmed:29423034|reaxys:5775836 Graph (+)-gamma-schizandrin|(+)-schizandrin B|(6R,7S13aR)-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydro-11H-benzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole|Schizandrin B|Wuweizisu B|gamma-schisandrin|gamma-schizandrin|schisandrin B (6R,7S13aR)-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydro-11H-benzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole (+)-gamma-schizandrin|(+)-schizandrin B|(6R,7S13aR)-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydro-11H-benzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxole|Schizandrin B|Wuweizisu B|gamma-schisandrin|gamma-schizandrin|schisandrin B http://purl.obolibrary.org/obo/CHEBI_132471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132474 biolink:ChemicalEntity fatty acid-taurine conjugate A monocarboxylic acid amide obtained by formal condensation of the carboxy group of any fatty acid with the amino group of taurine. pubmed:17116739 Graph N-fatty acyl-taurine N-fatty acyl-taurine http://purl.obolibrary.org/obo/CHEBI_132474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132479 biolink:ChemicalEntity N-stearoyltaurine A fatty acid-taurine conjugate derived from stearic acid. lipidmaps:LMFA08020078|reaxys:17116739 Graph 2-(octadecanoylamino)ethane-1-sulfonic acid|N-octadecanoyl-taurine|N-octadecanoyltaurine|N-stearoyl taurine|N-stearoyl-taurine 2-(octadecanoylamino)ethane-1-sulfonic acid 2-(octadecanoylamino)ethane-1-sulfonic acid|N-octadecanoyl-taurine|N-octadecanoyltaurine|N-stearoyl taurine|N-stearoyl-taurine http://purl.obolibrary.org/obo/CHEBI_132479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13248 biolink:ChemicalEntity anilide Any aromatic amide obtained by acylation of aniline. kegg.compound:C01402|pubmed:23535982|pubmed:23968552|pubmed:24273122|pubmed:6205897 Graph N-phenyl amide|N-phenyl amides|an anilide N-phenyl amide|N-phenyl amides|an anilide http://purl.obolibrary.org/obo/CHEBI_13248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132494 biolink:ChemicalEntity fatty acid 16:2 Any polyunsaturated fatty acid containing 16 carbons and 2 double bonds. Graph FA 16:2|free fatty acid 16:2 FA 16:2|free fatty acid 16:2 http://purl.obolibrary.org/obo/CHEBI_132494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132499 biolink:ChemicalEntity fatty acid 16:3 Any trienoic fatty acid containing 16 carbons. Graph FA 16:3|free fatty acid 16:3 FA 16:3|free fatty acid 16:3 http://purl.obolibrary.org/obo/CHEBI_132499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132502 biolink:ChemicalEntity fatty acid 18:3 Any trienoic fatty acid containing 18 carbons. Graph FA 18:3|free fatty acid 18:3 FA 18:3|free fatty acid 18:3 http://purl.obolibrary.org/obo/CHEBI_132502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132503 biolink:ChemicalEntity fatty acid 18:4 Any polyunsaturated fatty acid containing 18 carbons and 4 double bonds. Graph FA 18:4|free fatty acid 18:4 FA 18:4|free fatty acid 18:4 http://purl.obolibrary.org/obo/CHEBI_132503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132510 biolink:ChemicalEntity alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→3)-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5161 Graph alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol(2-)|alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol(2-)|alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132511 biolink:ChemicalEntity alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5162 Graph alpha-D-Man-(1->3)-(alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol(2-)|alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->3)-(alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol(2-)|alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132515 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5164 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132516 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→3)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5165 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-)|alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-)|alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132517 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5166 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132519 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5167 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132520 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5168 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132521 biolink:ChemicalEntity alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. Graph alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132522 biolink:ChemicalEntity alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Glc-(1→3)-α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. Graph alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132523 biolink:ChemicalEntity alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) An α-D-Glc-(1→2)-α-D-Glc-(1→3)-α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol)(2−) in which the anomeric centre has α-configuration. metacyc.compound:CPD-18076 Graph alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132525 biolink:ChemicalEntity oligosaccharide-(1->4)-N-acetyl-beta-D-glucosamine-(1->4)-N-acetyl-alpha-D-glucosamine 1-phosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate group of any oligosaccharide-(1→4)-N-acetyl-β-D-glucosamine-(1→4)-N-acetyl-α-D-glucosamine 1-phosphate; major species at pH 7.3. Graph an oligosaccharide-(1->4)-N-acetyl-beta-D-glucosamine-(1->4)-N-acetyl-alpha-D-glucosamine 1-phosphate an oligosaccharide-(1->4)-N-acetyl-beta-D-glucosamine-(1->4)-N-acetyl-alpha-D-glucosamine 1-phosphate http://purl.obolibrary.org/obo/CHEBI_132525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132529 biolink:ChemicalEntity N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine residue An L-α-amino acid residue derived from any N4-(oligosaccharide-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-β-D-glucosaminyl)-L-asparagine. Graph an N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine residue an N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_132529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13253 biolink:ChemicalEntity Asp-tRNA(Asx) Graph L-aspartyl-tRNA(Asx) L-aspartyl-tRNA(Asx) http://purl.obolibrary.org/obo/CHEBI_13253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132537 biolink:ChemicalEntity N(4)-(alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-asparaginyl residue An N4-(oligosaccharide-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-β-D-glucosaminyl)-L-asparagine residue that is derived from N4-(α-D-Glc-(1→2)-α-D-Glc-(1→3)-α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc)-L-asparagine metacyc.compound:CPD-18077 Graph N(4)-(alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->6))-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-asparaginyl residue N(4)-(alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->6))-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-asparaginyl residue http://purl.obolibrary.org/obo/CHEBI_132537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132538 biolink:ChemicalEntity fatty acid 20:1 Any monounsaturated fatty acid containing 20 carbons and 1 double bond. Graph FA 20:1|FA(20:1)|free fatty acid 20:1 FA 20:1|FA(20:1)|free fatty acid 20:1 http://purl.obolibrary.org/obo/CHEBI_132538 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132539 biolink:ChemicalEntity fatty acid 20:4 Any polyunsaturated fatty acid containing 20 carbons and 4 double bonds. Graph FA 20:4|free fatty acid 20:4 FA 20:4|free fatty acid 20:4 http://purl.obolibrary.org/obo/CHEBI_132539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132540 biolink:ChemicalEntity fatty acid 20:5 Any polyunsaturated fatty acid containing 20 carbons and 5 double bonds. Graph FA 20:5|free fatty acid 20:5 FA 20:5|free fatty acid 20:5 http://purl.obolibrary.org/obo/CHEBI_132540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132541 biolink:ChemicalEntity fatty acid 22:1 Any monounsaturated fatty acid containing 22 carbons. Graph FA 22:1|free fatty acid 22:1 FA 22:1|free fatty acid 22:1 http://purl.obolibrary.org/obo/CHEBI_132541 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:132542 biolink:ChemicalEntity fatty acid 22:4 Any polyunsaturated fatty acid containing 22 carbons and 4 double bonds. Graph FA 22:4|FA(22:4)|free fatty acid 22:4 FA 22:4|FA(22:4)|free fatty acid 22:4 http://purl.obolibrary.org/obo/CHEBI_132542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132543 biolink:ChemicalEntity fatty acid 22:5 Any polyunsaturated fatty acid containing 22 carbons and 5 double bonds. Graph FA 22:5|free fatty acid 22:5 FA 22:5|free fatty acid 22:5 http://purl.obolibrary.org/obo/CHEBI_132543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132544 biolink:ChemicalEntity fatty acid 22:6 Any polyunsaturated fatty acid containing 22 carbons and 6 double bonds. Graph FA 22:6|FA(22:6)|free fatty acid 22:6 FA 22:6|FA(22:6)|free fatty acid 22:6 http://purl.obolibrary.org/obo/CHEBI_132544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132546 biolink:ChemicalEntity 3-cyanoalanine An alanine derivative obtained by replacement of one of the methyl hydrogens in alanine with a cyano group cas:923-01-3|pubmed:26714205|pubmed:27979192|reaxys:2410687 Graph 2-amino-3-cyanopropanoic acid|beta-Cyanoalanine|beta-cyanoalanine|cyanoalanine|propargylglycine 2-amino-3-cyanopropanoic acid 2-amino-3-cyanopropanoic acid|beta-Cyanoalanine|beta-cyanoalanine|cyanoalanine|propargylglycine http://purl.obolibrary.org/obo/CHEBI_132546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132554 biolink:ChemicalEntity oligomer A molecule of intermediate relative molecular mass, the structure of which essentially comprises a small plurality of units derived, actually or conceptually, from molecules of lower relative molecular mass. pubmed:26399226|pubmed:26453210|pubmed:26915902|pubmed:27077449|pubmed:27281682|pubmed:27363332|wikipedia.en:Oligomer Graph oligomers oligomers http://purl.obolibrary.org/obo/CHEBI_132554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132569 biolink:ChemicalEntity O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue An O-(S-acylpantetheine-4'-phosphoryl)serine(1−) residue obatined by deprotonation of the phosphate group of any O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue; major species at pH 7.3. Graph O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine residue http://purl.obolibrary.org/obo/CHEBI_132569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132601 biolink:ChemicalEntity phosphatidylethanolamine 42:7 zwitterion A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the two acyl groups contain 42 carbons in total with 7 double bonds. Graph PE 42:7|PE(42:7)|phosphatidylethanolamine(42:7) PE 42:7|PE(42:7)|phosphatidylethanolamine(42:7) http://purl.obolibrary.org/obo/CHEBI_132601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132608 biolink:ChemicalEntity TRPM4 channel inhibitor An inhibitor of transient receptor potential cation channel subfamily M member 4. wikipedia.en:TRPM4 Graph TRPM4 channel inhibitors|Transient receptor potential cation channel subfamily M member 4 inhibitor|Transient receptor potential cation channel subfamily M member 4 inhibitors|melastatin 4 inhibitor|melastatin 4 inhibitors TRPM4 channel inhibitors|Transient receptor potential cation channel subfamily M member 4 inhibitor|Transient receptor potential cation channel subfamily M member 4 inhibitors|melastatin 4 inhibitor|melastatin 4 inhibitors http://purl.obolibrary.org/obo/CHEBI_132608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132610 biolink:ChemicalEntity phthalic acid monoester A dicarboxylic acid monoester resulting from the formal condensation of an alcoholic or aromatic hydroxy group with just one of the two carboxy groups of phthalic acid. Graph monoester of phthalic acid|monoesters of phthalic acid|phthalic acid monoesters monoester of phthalic acid|monoesters of phthalic acid|phthalic acid monoesters http://purl.obolibrary.org/obo/CHEBI_132610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132623 biolink:ChemicalEntity nodakenetin A marmesin with R-configuration. beilstein:85845|cas:495-32-9|kegg.compound:C09278|knapsack:C00002485|pubmed:17703773|pubmed:18058380|pubmed:18661821|pubmed:19431019|pubmed:19572262|pubmed:20822011|pubmed:22715728|pubmed:24696544|pubmed:25068578|pubmed:25340301|pubmed:26152875|pubmed:27444348|reaxys:85845 Graph (-)-Marmesin|(2R)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one|(R)-2-(1-Hydroxy-1-methylethyl)-2,3-dihydro-7H-furo(3,2-g)(1)benzopyran-7-one (2R)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one (-)-Marmesin|(2R)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one|(R)-2-(1-Hydroxy-1-methylethyl)-2,3-dihydro-7H-furo(3,2-g)(1)benzopyran-7-one http://purl.obolibrary.org/obo/CHEBI_132623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132672 biolink:ChemicalEntity phosphatidylethanolamine P-36:3 A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 3 additional double bonds. Graph PE P-36:3|PE(P-36:3)|phosphatidylethanolamine P-36:3 zwitterion|phosphatidylethanolamine(P-36:3) PE P-36:3|PE(P-36:3)|phosphatidylethanolamine P-36:3 zwitterion|phosphatidylethanolamine(P-36:3) http://purl.obolibrary.org/obo/CHEBI_132672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132673 biolink:ChemicalEntity phosphatidylethanolamine P-36:4 A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 36 carbon atoms in total with 4 additional double bonds. Graph PE P-36:4|PE(P-36:4)|phosphatidylethanolamine P-36:4 zwitterion|phosphatidylethanolamine(P-36:4) PE P-36:4|PE(P-36:4)|phosphatidylethanolamine P-36:4 zwitterion|phosphatidylethanolamine(P-36:4) http://purl.obolibrary.org/obo/CHEBI_132673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132674 biolink:ChemicalEntity phosphatidylethanolamine P-38:5 A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alk-1-enyl and acyl groups at positions 1 and 2 contain 38 carbon atoms in total with 5 additional double bonds. Graph PE P-38:5|PE(P-38:5)|phosphatidylethanolamine(P-38:5) PE P-38:5|PE(P-38:5)|phosphatidylethanolamine(P-38:5) http://purl.obolibrary.org/obo/CHEBI_132674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132717 biolink:ChemicalEntity bleaching agent A reagent that lightens or whitens a substrate through chemical reaction. Bleaching reactions usually involve oxidative or reductive processes that degrade colour systems. Bleaching can occur by destroying one or more of the double bonds in the conjugated chain, by cleaving the conjugated chain, or by oxidation of one of the other moieties in the conjugated chain. Their reactivity results in many bleaches having strong bactericidal, disinfecting, and sterilising properties. wikipedia.en:Bleach Graph http://purl.obolibrary.org/obo/CHEBI_132717 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132742 biolink:ChemicalEntity lysophosphatidic acid A member of the class of lysophosphatidic acids obtained by hydrolytic removal of one of the two acyl groups of any phosphatidic acid. A 'closed' class. Graph lysophosphatidic acids lysophosphatidic acids http://purl.obolibrary.org/obo/CHEBI_132742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132749 biolink:ChemicalEntity (S)-nandinine A berberine alkaloid that is 5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline carrying hydroxy and methoxy substituents at positions 9 and 10 respectively. cas:572-76-9|cba:618457|kegg.compound:C21370|metacyc.compound:CPD-16783|pubmed:27462872|pubmed:28085967|reaxys:21963851 Graph (+)-Nandinin|(+)-Tetrahydroberberrubine|(+)-nandinine|(13aS)-10-methoxy-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-9-ol|(S)-nandinine|10-Methoxy-2,3-(methylenedioxy)berbin-9-ol|Nandinine|S-Tetrahydroberberrubine (13aS)-10-methoxy-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-9-ol (+)-Nandinin|(+)-Tetrahydroberberrubine|(+)-nandinine|(13aS)-10-methoxy-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-9-ol|(S)-nandinine|10-Methoxy-2,3-(methylenedioxy)berbin-9-ol|Nandinine|S-Tetrahydroberberrubine http://purl.obolibrary.org/obo/CHEBI_132749 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132767 biolink:ChemicalEntity ferric pyrophosphate An iron coordination entity composed from Fe(3+) cations and diphosphate(4−) anions in a 4:3 ratio. cas:10058-44-3|pubmed:26928401|pubmed:27053382|pubmed:27132828|pubmed:27153768|pubmed:27267429|reaxys:11322214|reaxys:28495693 Graph Iron pyrophosphate|Iron(3+) pyrophosphate|Iron(III) diphosphate|Iron(III) pyrophosphate|Tetrairon tris(pyrophosphate)|ferric diphosphate|iron(3+) diphosphate|iron(3+) diphosphate (4/3)|tetrairon tris(diphosphate) iron(3+) diphosphate (4/3) Iron pyrophosphate|Iron(3+) pyrophosphate|Iron(III) diphosphate|Iron(III) pyrophosphate|Tetrairon tris(pyrophosphate)|ferric diphosphate|iron(3+) diphosphate|iron(3+) diphosphate (4/3)|tetrairon tris(diphosphate) http://purl.obolibrary.org/obo/CHEBI_132767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132771 biolink:ChemicalEntity EC 3.6.5.* (hydrolases acting on GTP; involved in cellular and subcellular movement) inhibitor Any EC 3.6.* (hydrolases acting on acid anhydrides) inhibitor that interferes with the action of any such enzyme acting on GTP that is involved in cellular and subcellular movement (EC 3.6.5.*). Graph EC 3.6.5.* (hydrolases acting on GTP; involved in cellular and subcellular movement) inhibitors EC 3.6.5.* (hydrolases acting on GTP; involved in cellular and subcellular movement) inhibitors http://purl.obolibrary.org/obo/CHEBI_132771 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132793 biolink:ChemicalEntity albiflorin A monoterpene glycoside with formula C23H28O11, originally isolated from the roots of Paeonia lactiflora. cas:39011-90-0|kegg.compound:C17457|knapsack:C00033623|pubmed:22674837|pubmed:22782934|pubmed:23695964|pubmed:23707745|pubmed:24422408|pubmed:24646307|pubmed:24907546|pubmed:25042570|pubmed:25423839|pubmed:25507561|pubmed:25938872|pubmed:26058364|pubmed:26080568|pubmed:26089940|pubmed:26475043|pubmed:26719283|pubmed:27038516|pubmed:27070118|pubmed:27313650|pubmed:27376264|pubmed:27429639|pubmed:27608949|pubmed:27633302|pubmed:27646789|pubmed:27975815|pubmed:27993636|reaxys:18602070 Graph [(1R,3R,4R,6S,9S)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0(3,9)]nonan-9-yl]methyl benzoate [(1R,3R,4R,6S,9S)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0(3,9)]nonan-9-yl]methyl benzoate [(1R,3R,4R,6S,9S)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0(3,9)]nonan-9-yl]methyl benzoate http://purl.obolibrary.org/obo/CHEBI_132793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132797 biolink:ChemicalEntity 8-oxoresolvin D1 A resolvin that is docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid which is substituted by hydroxy groups at the 7 and 17 positions as well as an oxo group at the 8-position (the 7S,17S-stereoisomer). lipidmaps:LMFA04000079|pubmed:17244615 Graph (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoic acid|8-oxo-(7S,17S)-dihydroxy-(4Z,9E,11E,13Z,15E,19Z)-docosahexaenoic acid|8-oxo-7S,17S-dihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|8-oxo-RvD1 (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoic acid (4Z,7S,9E,11E,13Z,15E,17S,19Z)-7,17-dihydroxy-8-oxodocosa-4,9,11,13,15,19-hexaenoic acid|8-oxo-(7S,17S)-dihydroxy-(4Z,9E,11E,13Z,15E,19Z)-docosahexaenoic acid|8-oxo-7S,17S-dihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|8-oxo-RvD1 http://purl.obolibrary.org/obo/CHEBI_132797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132800 biolink:ChemicalEntity 17-oxoresolvin D1 A resolvin that is docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid which is substituted by hydroxy groups at the 7 and 8 positions as well as an oxo group at the 17-position (the 7S,8R-stereoisomer). lipidmaps:LMFA04000080|pubmed:17244615 Graph (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoic acid|17-oxo-(7S,8R)-dihydroxy-(4Z,9E,11E,13Z,15E,19Z)-docosahexaenoic acid|17-oxo-7S,8R-dihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|17-oxo-RvD1 (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoic acid (4Z,7S,8R,9E,11E,13Z,15E,19Z)-7,8-dihydroxy-17-oxodocosa-4,9,11,13,15,19-hexaenoic acid|17-oxo-(7S,8R)-dihydroxy-(4Z,9E,11E,13Z,15E,19Z)-docosahexaenoic acid|17-oxo-7S,8R-dihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|17-oxo-RvD1 http://purl.obolibrary.org/obo/CHEBI_132800 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132801 biolink:ChemicalEntity 18(S)-HEPE An 18-HEPE that consists of (5Z,8Z,11Z,14Z,16E)-icosapentaenoic in which the 18-hydroxy group has S-configuration. lipidmaps:LMFA03070038|pubmed:21206090|pubmed:25187667 Graph (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoic acid|18S-HEPE|18S-hydroxy-5Z,8Z,11Z,14Z,16E-eicosapentaenoic acid (5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoic acid (18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(18S)-hydroxy-(5Z,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5Z,8Z,11Z,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoic acid|18S-HEPE|18S-hydroxy-5Z,8Z,11Z,14Z,16E-eicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_132801 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132802 biolink:ChemicalEntity (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid A polyunsaturated fatty acid that is (6E,8Z,11Z,14Z,16E)-icosapentaenoic acid substituted at positions 5 and 18 by hydroperoxy and hydroxy groups respectively (the 5S, 18S-stereoisomer). pubmed:21206090 Graph (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid|18(S)-OH-5(S)-HpEPE|18(S)-hydroxy-5(S)-HpEPE (5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid|18(S)-OH-5(S)-HpEPE|18(S)-hydroxy-5(S)-HpEPE http://purl.obolibrary.org/obo/CHEBI_132802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132803 biolink:ChemicalEntity UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate A UDP-N-acetyl-D-galactosamine 4,6-bissulfate in which the anomeric centre of the galactosamine fragment has α-configuration. kegg.compound:C04589 Graph UDP-N-acetyl-D-galactosamine 4,6-bissulfate UDP-N-acetyl-D-galactosamine 4,6-bissulfate http://purl.obolibrary.org/obo/CHEBI_132803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132804 biolink:ChemicalEntity UDP-N-acetyl-alpha-D-galactosamine 4-sulfate A UDP-N-acetyl-D-galactosamine 4-sulfate in which the anomeric centre of the galactosamine fragment has α-configuration. cas:3863-56-7|kegg.compound:C04426 Graph UDP-N-acetyl-D-galactosamine 4-sulfate|Udp-Ga1NAc-S|Udp-N-acetylgalactosamine 4-sulfate|Uridine diphosphate-N-acetylgalactosamine 4-sulfate UDP-N-acetyl-D-galactosamine 4-sulfate|Udp-Ga1NAc-S|Udp-N-acetylgalactosamine 4-sulfate|Uridine diphosphate-N-acetylgalactosamine 4-sulfate http://purl.obolibrary.org/obo/CHEBI_132804 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132814 biolink:ChemicalEntity beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-D-Glcp An amino tetrasaccharide consisting of β-D-galactose, N-acetyl-β-D-galactosamine, β-D-galactose and D-glucose residues in a linear (1→3), (1→4), (1→4) sequence. glygen:G00407UJ|glytoucan:G00407UJ|pubmed:16406213 Graph Galbeta1-3GalNAcbeta1-4Galbeta1-4Glc|beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-D-Glc|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose|beta-D-galactosyl-(1-3)-N-acetyl-beta-D-galactosaminyl-(1-4)-beta-D-galactosyl-(1-4)-D-glucose|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-D-glucose beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose Galbeta1-3GalNAcbeta1-4Galbeta1-4Glc|beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-D-Glc|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose|beta-D-galactosyl-(1-3)-N-acetyl-beta-D-galactosaminyl-(1-4)-beta-D-galactosyl-(1-4)-D-glucose|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-D-glucose http://purl.obolibrary.org/obo/CHEBI_132814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132818 biolink:ChemicalEntity apigenin 7-O-beta-L-glucoside A glycosyloxyflavone that is apigenin substituted by a β-L-glucopyranosyl moiety at position 7 via a glycosidic linkage. reaxys:1359341 Graph 5,4'-dihydroxy-7-O-beta-L-glucopyranosyloxyflavone|5,4'-dihydroxy-7-O-beta-L-glucosyloxyflavone|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl beta-L-glucopyranoside|7-O-beta-L-(beta-L-glucopyranosyl)apigenin|7-O-beta-L-(beta-L-glucosyl)apigenin|7-O-beta-L-glucosyl-5,7,4'-trihydroxyflavone 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl beta-L-glucopyranoside 5,4'-dihydroxy-7-O-beta-L-glucopyranosyloxyflavone|5,4'-dihydroxy-7-O-beta-L-glucosyloxyflavone|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl beta-L-glucopyranoside|7-O-beta-L-(beta-L-glucopyranosyl)apigenin|7-O-beta-L-(beta-L-glucosyl)apigenin|7-O-beta-L-glucosyl-5,7,4'-trihydroxyflavone http://purl.obolibrary.org/obo/CHEBI_132818 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132823 biolink:ChemicalEntity clionasterol A member of the class of phytosterols that is poriferast-5-ene carrying a β-hydroxy substituent at position 3. cas:83-47-6|hmdb:HMDB0000649|knapsack:C00023769|lipidmaps:LMST01040122|pubmed:22863942|pubmed:24417147|pubmed:24831420|pubmed:26710827|pubmed:27694009|reaxys:2061922 Graph (24S)-stigmast-5-en-3beta-ol|(3beta,24S)-stigmast-5-en-3-ol|22,23-Dihydroporiferasterol|24-Ethylcholest-5-en-3 beta-ol|24S-ethylcholest-5-en-3beta-ol|24beta-ethyl-5-cholesten-3beta-ol|24beta-ethylcholesterol|beta-dihydrofucosterol|gamma-Sitosterol|gamma-sitosterol|poriferast-5-en-3beta-ol (24S)-stigmast-5-en-3beta-ol (24S)-stigmast-5-en-3beta-ol|(3beta,24S)-stigmast-5-en-3-ol|22,23-Dihydroporiferasterol|24-Ethylcholest-5-en-3 beta-ol|24S-ethylcholest-5-en-3beta-ol|24beta-ethyl-5-cholesten-3beta-ol|24beta-ethylcholesterol|beta-dihydrofucosterol|gamma-Sitosterol|gamma-sitosterol|poriferast-5-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_132823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132841 biolink:ChemicalEntity clodinafop An aromatic ether that is (R)-lactic acid in which the hydroxy group at position 2 has been converted to the corresponding p-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenyl ether. It is the parent acid of the herbicide clodinafop-propargyl. agr:IND43870723|agr:IND44076496|cas:114420-56-3|pesticides:clodinafop|ppdb:1416|pubmed:10557330|pubmed:16047877|pubmed:16977528|pubmed:19290455|pubmed:19594140|pubmed:19756846|pubmed:19784963|pubmed:24121741|pubmed:26065513|reaxys:10562170 Graph (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoic acid (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoic acid (2R)-2-{4-[(5-chloro-3-fluoropyridin-2-yl)oxy]phenoxy}propanoic acid http://purl.obolibrary.org/obo/CHEBI_132841 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132842 biolink:ChemicalEntity sulfapyridine A sulfonamide consisting of pyridine with a 4-aminobenzenesulfonamido group at the 2-position. cas:144-83-2|drugbank:DB00891|drugcentral:2524|gmelin:219135|hmdb:HMDB0015028|kegg.drug:D02434|lincs.smallmolecule:LSM-5531|patent:GB512145|patent:US2275354|pubmed:11431418|pubmed:17964793|pubmed:6136612|pubmed:6993682|pubmed:7021831|reaxys:222065|vsdb:1922|wikipedia.en:Sulfapyridine Graph 2-(p-Aminobenzenesulphonamido)pyridine|2-Sulfanilamidopyridin|2-Sulfanilamidopyridine|2-Sulfanilylaminopyridine|2-Sulfapyridine|4-(2-Pyridinylsulfonyl)aniline|4-Amino-N,2-pyridinylbenzenesulfonamide|4-Amino-N-pyridin-2-yl-benzenesulfonamide|4-[(2-Pyridylamino)sulfonyl]aniline|4-amino-N-(pyridin-2-yl)benzenesulfonamide|N(1)-2-Pyridylsulfanilamide|N(1)-Pyridylsulfanilamide|N-2-Pyridylsulfanilamide|Solfapiridina|Sulphapyridine|sulfapiridina|sulfapyridine|sulfapyridinum 4-amino-N-(pyridin-2-yl)benzenesulfonamide 2-(p-Aminobenzenesulphonamido)pyridine|2-Sulfanilamidopyridin|2-Sulfanilamidopyridine|2-Sulfanilylaminopyridine|2-Sulfapyridine|4-(2-Pyridinylsulfonyl)aniline|4-Amino-N,2-pyridinylbenzenesulfonamide|4-Amino-N-pyridin-2-yl-benzenesulfonamide|4-[(2-Pyridylamino)sulfonyl]aniline|4-amino-N-(pyridin-2-yl)benzenesulfonamide|N(1)-2-Pyridylsulfanilamide|N(1)-Pyridylsulfanilamide|N-2-Pyridylsulfanilamide|Solfapiridina|Sulphapyridine|sulfapiridina|sulfapyridine|sulfapyridinum http://purl.obolibrary.org/obo/CHEBI_132842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132853 biolink:ChemicalEntity acteoside A glycoside that is the α-L-rhamnosyl-(1→3)-β-D-glucoside of hydroxytyrosol in which the hydroxy group at position 4 of the glucopyranosyl moiety has undergone esterification by formal condensation with trans-caffeic acid. cas:61276-17-3|hmdb:HMDB0034843|kegg.compound:C10501|knapsack:C00002783|pubmed:10432210|pubmed:25628651|pubmed:25900014|pubmed:25900087|pubmed:26427909|pubmed:26453510|pubmed:26700563|pubmed:26827721|pubmed:26856531|pubmed:26981096|pubmed:26990576|pubmed:27096224|pubmed:27125592|pubmed:27191581|pubmed:27223850|pubmed:27326537|pubmed:27428333|reaxys:1278646|wikipedia.en:Verbascoside Graph 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside|2-(3,4-dihydroxyphenyl)ethyl 3-O-(alpha-L-rhamnopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside|kusaginin|verbascoside 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside|2-(3,4-dihydroxyphenyl)ethyl 3-O-(alpha-L-rhamnopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside|kusaginin|verbascoside http://purl.obolibrary.org/obo/CHEBI_132853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132873 biolink:ChemicalEntity meadowlactone A δ-lactone obtained by intramolecular condensation of the 5-hydroxy and carboxy groups of 5-hydroxyicosanoic acid. A nonenzymatic oxidation product of arachidonic acid. cas:110071-67-5|patent:US2007092465|patent:US7615231|pubmed:15772423|pubmed:17935296|reaxys:7639766 Graph 5-hydroxy-eicosatetraenoic acid 1,5-lactone|5-hydroxyicosatetraenoic acid 1,5-lactone|6-pentadecyloxan-2-one|Meadowfoam delta-lactone|delta-eicosalactone|delta-icosalactone 6-pentadecyloxan-2-one 5-hydroxy-eicosatetraenoic acid 1,5-lactone|5-hydroxyicosatetraenoic acid 1,5-lactone|6-pentadecyloxan-2-one|Meadowfoam delta-lactone|delta-eicosalactone|delta-icosalactone http://purl.obolibrary.org/obo/CHEBI_132873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132875 biolink:ChemicalEntity N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate An N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate in which the anomeric centre connected to the diphosphate group has α-configuration. kegg.compound:C04881|metacyc.compound:ACETYL-ETCETERA-GLUCOSAMINYLDIPHOSPHOUND Graph 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|ManNAc-GlcNAc-PP-undecaprenol|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose 2-acetamido-4-O-(2-acetamido-2-deoxy-beta-D-mannopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|ManNAc-GlcNAc-PP-undecaprenol|N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132876 biolink:ChemicalEntity beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate A β-D-glucosyl-(1→4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate in which the anomeric centre connected to the diphosphate group has α-configuration. kegg.compound:C04830|metacyc.compound:BETA-D-GLUCOSYL-14-N-ACETYL-D-GLUCOSAMI Graph 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|Glc-GlcNAc-PP-undecaprenol|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose 2-acetamido-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|Glc-GlcNAc-PP-undecaprenol|beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132877 biolink:ChemicalEntity 4-O-[(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate A polyprenyl glycosyl diphosphate having eleven prenyl units and with 4-O-[(2R)-1-glycerylphosphono]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosamine as the glycosyl fragment. metacyc.compound:CPD-5802 Graph 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}-beta-D-glucopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|4-O-[(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}-beta-D-glucopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}-beta-D-glucopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|4-O-[(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_132877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132889 biolink:ChemicalEntity graphene oxide A single carbon layer of the graphite oxide structure. pmc:PMC8540551|pmc:PMC8582055|pmc:PMC8585176|pubmed:20023850|pubmed:33668189|pubmed:34270266|pubmed:34327598|pubmed:34371431|pubmed:34443964|pubmed:34668901 Graph GO GO http://purl.obolibrary.org/obo/CHEBI_132889 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:132893 biolink:ChemicalEntity fangchinoline A bisbenzylisoquinoline alkaloid that is (1β)- berbaman which has been substituted by methyl groups at the 2 and 2' positions, by methoxy groups at the 6, 6', and 12 positions, and by a hydroxy group at position 7. Isolated from Stephania tetrandra, it has been found to possess neuroprotective and anti-tumour activity. cas:436-77-1|pubmed:18161288|pubmed:19428795|pubmed:19764054|pubmed:20030508|pubmed:20208355|pubmed:21418191|pubmed:22130369|pubmed:22720080|pubmed:23112944|pubmed:23401195|pubmed:23452799|pubmed:23596478|pubmed:24568493|pubmed:24856768|pubmed:25539072|pubmed:25645647|pubmed:25754692|pubmed:25872479|pubmed:26408176|pubmed:26512898|pubmed:26893655|reaxys:78975|wikipedia.en:Fangchinoline Graph (+)-fangchinoline|(+)-limacine|(1beta)-2,2'-dimethyl-6,6',12-trimethoxyberbaman-7-ol|(1beta)-6,6',12-trimethoxy-2,2'-dimethylberbaman-7-ol|7-O-demethyltetrandrine (1beta)-6,6',12-trimethoxy-2,2'-dimethylberbaman-7-ol (+)-fangchinoline|(+)-limacine|(1beta)-2,2'-dimethyl-6,6',12-trimethoxyberbaman-7-ol|(1beta)-6,6',12-trimethoxy-2,2'-dimethylberbaman-7-ol|7-O-demethyltetrandrine http://purl.obolibrary.org/obo/CHEBI_132893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132908 biolink:ChemicalEntity 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid A polyunsaturated fatty acid that is (6E,8Z,11Z,14Z,16E)-icosapentaenoic acid substituted at positions 5 and 18 by hydroperoxy and hydroxy groups respectively (the 5S, 18R-stereoisomer). pubmed:21206090|reaxys:14535272 Graph (5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid|18(R)-hydroxy-5(S)-HpEPE|5(S)-Hp-18(R)-HEPE|5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid (5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid (5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S)-hydroperoxy-(18R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18R)-5-hydroperoxy-18-hydroxyicosa-6,8,11,14,16-pentaenoic acid|18(R)-hydroxy-5(S)-HpEPE|5(S)-Hp-18(R)-HEPE|5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_132908 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132915 biolink:ChemicalEntity (R,S,S,S)-nebivolol(1+) An organic cation obtained by protonation of the secondary amino function of (R,S,S,S)-nebivolol. Graph (2S)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2S)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium|(R,S,S,S)-nebivolol cation (2S)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2S)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium (2S)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2S)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium|(R,S,S,S)-nebivolol cation http://purl.obolibrary.org/obo/CHEBI_132915 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132916 biolink:ChemicalEntity (S,R,R,R)-nebivolol(1+) An organic cation obtained by protonation of the secondary amino function of (S,R,R,R)-nebivolol. Graph (2R)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2R)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium|(S,R,R,R)-nebivolol cation (2R)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2R)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium (2R)-2-[(2S)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-N-{(2R)-2-[(2R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl}-2-hydroxyethan-1-aminium|(S,R,R,R)-nebivolol cation http://purl.obolibrary.org/obo/CHEBI_132916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132917 biolink:ChemicalEntity 2-isopropylmalate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of 2-isopropylmalic acid. Graph 2-isopropylmalate anion|2-isopropylmalic acid anion 2-isopropylmalate anion|2-isopropylmalic acid anion http://purl.obolibrary.org/obo/CHEBI_132917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132922 biolink:ChemicalEntity ibuprofen(1-) A monocarboxylic acid anion that is the conjugate base of ibuprofen, obtained by deprotonation of the carboxy group; major species at pH 7.3. reaxys:4784081 Graph 2-[4-(2-methylpropyl)phenyl]propanoate|ibuprofen|ibuprofen anion 2-[4-(2-methylpropyl)phenyl]propanoate 2-[4-(2-methylpropyl)phenyl]propanoate|ibuprofen|ibuprofen anion http://purl.obolibrary.org/obo/CHEBI_132922 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132923 biolink:ChemicalEntity salicylurate A monocarboxylic acid anion that is the conjugate base of salicyluric acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. reaxys:3673294 Graph (2-hydroxybenzamido)acetate|2-hydroxyhippurate|o-hydroxyhippurate|ortho-hydroxyhippurate|salicyloylglycinate|salicylylglycinate (2-hydroxybenzamido)acetate (2-hydroxybenzamido)acetate|2-hydroxyhippurate|o-hydroxyhippurate|ortho-hydroxyhippurate|salicyloylglycinate|salicylylglycinate http://purl.obolibrary.org/obo/CHEBI_132923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132933 biolink:ChemicalEntity intermediate-density lipoprotein A class of lipoproteins with a density between that of low-density and very-low-density lipoproteins. They are formed by the degradatiion of very-low-density lipoproteins. pubmed:15698598|pubmed:24353240|pubmed:24680982|pubmed:9133510|pubmed:9740500|wikipedia.en:Intermediate-density_lipoprotein Graph IDL|intermediate density lipoprotein|intermediate density lipoproteins|intermediate-density lipoproteins IDL|intermediate density lipoprotein|intermediate density lipoproteins|intermediate-density lipoproteins http://purl.obolibrary.org/obo/CHEBI_132933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132938 biolink:ChemicalEntity ethylmalonate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of ethylmalonic acid. Graph ethylmalonate anion|ethylmalonic acid anion ethylmalonate anion|ethylmalonic acid anion http://purl.obolibrary.org/obo/CHEBI_132938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132939 biolink:ChemicalEntity ethylmalonate(2-) A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of ethylmalonic acid. reaxys:3904851 Graph ethylpropanedioate ethylpropanedioate ethylpropanedioate http://purl.obolibrary.org/obo/CHEBI_132939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132940 biolink:ChemicalEntity 1,3,7-trimethylurate An organic anion obtained by deprotonation of 1,3,7-trimethyluric acid. Graph 1,3,7-trimethylurate anion|1,3,7-trimethyluric acid anion 1,3,7-trimethylurate anion|1,3,7-trimethyluric acid anion http://purl.obolibrary.org/obo/CHEBI_132940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132941 biolink:ChemicalEntity 2-hydroxyglutarate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of 2-hydroxyglutaric acid. Graph 2-hydroxyglutarate anion|2-hydroxyglutaric acid anion 2-hydroxyglutarate anion|2-hydroxyglutaric acid anion http://purl.obolibrary.org/obo/CHEBI_132941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132942 biolink:ChemicalEntity quinolinate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of quinolinic acid. Graph quinolinate anion|quinolinic acid anion quinolinate anion|quinolinic acid anion http://purl.obolibrary.org/obo/CHEBI_132942 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132943 biolink:ChemicalEntity aspartate Graph aspartate anion|aspartic acid anion aspartate anion|aspartic acid anion http://purl.obolibrary.org/obo/CHEBI_132943 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:132944 biolink:ChemicalEntity octadec-9-enoate An octadecenoate in which the double bond is at C-9. Graph 9-octadecenoate|C18:1, n-9(1-)|Delta(9)-octadecenoate|octadec-9-enoate octadec-9-enoate 9-octadecenoate|C18:1, n-9(1-)|Delta(9)-octadecenoate|octadec-9-enoate http://purl.obolibrary.org/obo/CHEBI_132944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132946 biolink:ChemicalEntity (R)-2-hydroxyglutaryl-CoA(5-) A 2-hydroxyglutaryl-CoA(5−) that results from the removal of all five protons from the phosphate and carboxylic acid groups of (R)-2-hydroxyglutaryl-CoA; major species at pH 7.3. metacyc.compound:2-HYDROXYGLUTARYL-COA Graph (R)-2-hydroxyglutaryl-CoA (R)-2-hydroxyglutaryl-CoA http://purl.obolibrary.org/obo/CHEBI_132946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132948 biolink:ChemicalEntity pyridoxate A pyridinemonocarboxylate obtained by deprotonation of the carboxy group of any pyridoxic acid. Graph pyridoxate anion|pyridoxate anions|pyridoxates|pyridoxic acid anion|pyridoxic acid anions pyridoxate anion|pyridoxate anions|pyridoxates|pyridoxic acid anion|pyridoxic acid anions http://purl.obolibrary.org/obo/CHEBI_132948 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132950 biolink:ChemicalEntity tartrate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of any tartaric acid. Graph tartaric acid anion|tartaric acid anions|tartrate|tartrate anion|tartrate anions|tartrates tartaric acid anion|tartaric acid anions|tartrate|tartrate anion|tartrate anions|tartrates http://purl.obolibrary.org/obo/CHEBI_132950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132951 biolink:ChemicalEntity maleate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of maleic acid. Graph maleate anion|maleate anions|maleates|maleic acid anion|maleic acid anions maleate anion|maleate anions|maleates|maleic acid anion|maleic acid anions http://purl.obolibrary.org/obo/CHEBI_132951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132952 biolink:ChemicalEntity oxalate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of oxalic acid. Graph ethanedioic acid anion|ethanedioic acid anions|oxalate anion|oxalate anions|oxalates|oxalic acid anion|oxalic acid anions ethanedioic acid anion|ethanedioic acid anions|oxalate anion|oxalate anions|oxalates|oxalic acid anion|oxalic acid anions http://purl.obolibrary.org/obo/CHEBI_132952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132953 biolink:ChemicalEntity suberate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of suberic acid. Graph octanedioic acid anion|octanedioic acid anions|suberate anion|suberate anions|suberates|suberic acid anion|suberic acid anions octanedioic acid anion|octanedioic acid anions|suberate anion|suberate anions|suberates|suberic acid anion|suberic acid anions http://purl.obolibrary.org/obo/CHEBI_132953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132954 biolink:ChemicalEntity sebacate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of sebacic acid. Graph decanedioic acid anion|decanedioic acid anions|sebacate anion|sebacate anions|sebacates|sebacic acid anion|sebacic acid anions decanedioic acid anion|decanedioic acid anions|sebacate anion|sebacate anions|sebacates|sebacic acid anion|sebacic acid anions http://purl.obolibrary.org/obo/CHEBI_132954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132955 biolink:ChemicalEntity azelaate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of azelaic acid. Graph azelaate anion|azelaate anions|azelaates|azelaic acid anion|azelaic acid anions|nonanedioic acid anion|nonanedioic acid anions azelaate anion|azelaate anions|azelaates|azelaic acid anion|azelaic acid anions|nonanedioic acid anion|nonanedioic acid anions http://purl.obolibrary.org/obo/CHEBI_132955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132957 biolink:ChemicalEntity N-acetylmethioninate A monocarboxylic acid anion that is the conjugate base of N-acetylmethionine, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph 2-acetamido-4-(methylsulfanyl)butanoate|Ac-Met(1-)|N-Ac-Met(1-)|N-acetylmethionine(1-) 2-acetamido-4-(methylsulfanyl)butanoate 2-acetamido-4-(methylsulfanyl)butanoate|Ac-Met(1-)|N-Ac-Met(1-)|N-acetylmethionine(1-) http://purl.obolibrary.org/obo/CHEBI_132957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132958 biolink:ChemicalEntity N-acetylmethionine A methionine derivative that is methionine in which one of the amine hydrogens is substituted by an acetyl group. cas:1115-47-5|pubmed:1157846|pubmed:16129491|pubmed:23626375|pubmed:2738074|pubmed:35357105|pubmed:448454|pubmed:9589603|reaxys:1725554 Graph 2-acetamido-4-(methylsulfanyl)butanoic acid|2-acetylamino-4-methylsulfanyl-butyric acid|Ac-Met|N-Ac-Met|N-acetylmethionine N-acetylmethionine 2-acetamido-4-(methylsulfanyl)butanoic acid|2-acetylamino-4-methylsulfanyl-butyric acid|Ac-Met|N-Ac-Met|N-acetylmethionine http://purl.obolibrary.org/obo/CHEBI_132958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132960 biolink:ChemicalEntity 3-phosphoglycerate An organic anion obtained by deprotonation of at least one of the acidic groups of 3-phosphoglyceric acid. Graph 2-hydroxy-3-(phosphonooxy)propanoic acid anion|2-hydroxy-3-(phosphonooxy)propanoic acid anions|3-phosphoglycerate anion|3-phosphoglycerate anions|3-phosphoglycerates|3-phosphoglyceric acid anion|3-phosphoglyceric acid anions 2-hydroxy-3-(phosphonooxy)propanoic acid anion|2-hydroxy-3-(phosphonooxy)propanoic acid anions|3-phosphoglycerate anion|3-phosphoglycerate anions|3-phosphoglycerates|3-phosphoglyceric acid anion|3-phosphoglyceric acid anions http://purl.obolibrary.org/obo/CHEBI_132960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132961 biolink:ChemicalEntity methylsuccinate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of 3-methylsuccinic acid. Graph 2-methylbutanedioic acid anion|2-methylbutanedioic acid anions|methylsuccinate anion|methylsuccinates|methylsuccinic acid anion|methylsuccinic acid anions 2-methylbutanedioic acid anion|2-methylbutanedioic acid anions|methylsuccinate anion|methylsuccinates|methylsuccinic acid anion|methylsuccinic acid anions http://purl.obolibrary.org/obo/CHEBI_132961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132962 biolink:ChemicalEntity acetaminophen O-beta-D-glucosiduronate A β-D-glucosiduronate that is the conjugate base of acetaminophen O-β-D-glucosiduronic acid, obtained by deprotonation of the carboxy group. Graph 4-acetamidophenyl beta-D-glucopyranosiduronate|4-acetamidophenyl beta-D-glucosiduronate|4-acetamidophenyl beta-D-glucuronide(1-)|p-acetamidophenyl beta-D-glucopyranosiduronate|p-acetamidophenyl beta-D-glucosiduronate|p-acetamidophenyl beta-D-glucuronide(1-) 4-acetamidophenyl beta-D-glucopyranosiduronate 4-acetamidophenyl beta-D-glucopyranosiduronate|4-acetamidophenyl beta-D-glucosiduronate|4-acetamidophenyl beta-D-glucuronide(1-)|p-acetamidophenyl beta-D-glucopyranosiduronate|p-acetamidophenyl beta-D-glucosiduronate|p-acetamidophenyl beta-D-glucuronide(1-) http://purl.obolibrary.org/obo/CHEBI_132962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132966 biolink:ChemicalEntity hippurates An N-acylglycinate obtained by deprotonation of the carboxy group of hippuric acid (N-benzoylglycine) and its derivatives. Graph N-benzoylglycinates|N-benzoylglycine anions N-benzoylglycinates|N-benzoylglycine anions http://purl.obolibrary.org/obo/CHEBI_132966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132970 biolink:ChemicalEntity 5-ammoniolevulinic acid A primary ammonium ion obtained by protonation of the amino group of 5-aminolevulinic acid. Graph 4-carboxy-2-oxobutan-1-aminium|5-aminolevulinic acid cation|5-aminolevulinic acid(1+) 4-carboxy-2-oxobutan-1-aminium 4-carboxy-2-oxobutan-1-aminium|5-aminolevulinic acid cation|5-aminolevulinic acid(1+) http://purl.obolibrary.org/obo/CHEBI_132970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132972 biolink:ChemicalEntity farnesoid X receptor agonist An agonist that binds to and activates farnesoid X receptors wikipedia.en:Farnesoid_X_receptor Graph BAR agonist|BAR agonists|FXR agonist|FXR agonists|bile acid receptor agonist|bile acid receptor agonists|farnesoid X receptor agonists BAR agonist|BAR agonists|FXR agonist|FXR agonists|bile acid receptor agonist|bile acid receptor agonists|farnesoid X receptor agonists http://purl.obolibrary.org/obo/CHEBI_132972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132977 biolink:ChemicalEntity 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA(4-) A steroidal acyl-CoA(4−) oxoanion obtained by deprotonation of the phosphate and diphosphate OH groups of 7α,12α-dihydroxy-3-oxochol-4-en-24-oyl-CoA; major species at pH 7.3. metacyc.compound:3-OXO-DELTA4-CHOLYL-COA Graph 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA|7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-coenzyme A(4-) 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA|7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_132977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132978 biolink:ChemicalEntity 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA(4-) A steroidal acyl-CoA(4−) oxoanion obtained by deprotonation of the phosphate and diphosphate OH groups of 12α-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA; major species at pH 7.3. metacyc.compound:3-OXO-DELTA46-CHOLYL-COA Graph 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA|12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-coenzyme A(4-) 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA|12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_132978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132986 biolink:ChemicalEntity sapitinib A member of the class of quinazolines that is 4-amino-7-methoxyquinazoline in which the amino group has been substituted by a 3-chloro-2-fluorophenyl group and in which position 6 of the quinoline ring has been substituted by a {1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl}oxy group. Sapitinib is a dual tyrosine kinase inhibitor (TKI) of epithelial growth factor receptors (EGFR) HER2 and HER3. cas:848942-61-0|pubmed:20145185|pubmed:24554387|pubmed:24875132|pubmed:24886365|pubmed:24900741|pubmed:25007130|pubmed:25149507|pubmed:26095475|reaxys:12223131 Graph 2-(4-{[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxy}piperidin-1-yl)-N-methylacetamide|2-[4-({4-[(3-chloro-2-fluorophenyl)amino]-7-methoxyquinazolin-6-yl}oxy)piperidin-1-yl]-N-methylacetamide|AZD-8931|AZD8931|sapitinib|sapitinibum 2-(4-{[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxy}piperidin-1-yl)-N-methylacetamide 2-(4-{[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxy}piperidin-1-yl)-N-methylacetamide|2-[4-({4-[(3-chloro-2-fluorophenyl)amino]-7-methoxyquinazolin-6-yl}oxy)piperidin-1-yl]-N-methylacetamide|AZD-8931|AZD8931|sapitinib|sapitinibum http://purl.obolibrary.org/obo/CHEBI_132986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132988 biolink:ChemicalEntity bradykinin(2+) A peptide cation obtained by deprotonation of the carboxy group and protonation of the amino and guanidino groups of bradykinin; major species at pH 7.3. Graph 1-[(2S)-2-azaniumyl-5-carbamimidamidopentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-carbamimidamido-1-carboxylatobutyl]-L-phenylalaninamide|1-[(2S)-2-azaniumyl-5-{[azaniumyl(imino)methyl]amino}pentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-{[azaniumyl(imino)methyl]amino}-1-carboxylatobutyl]-L-phenylalaninamide|bradykinin 1-[(2S)-2-azaniumyl-5-carbamimidamidopentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-carbamimidamido-1-carboxylatobutyl]-L-phenylalaninamide|1-[(2S)-2-azaniumyl-5-{[azaniumyl(imino)methyl]amino}pentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-{[azaniumyl(imino)methyl]amino}-1-carboxylatobutyl]-L-phenylalaninamide 1-[(2S)-2-azaniumyl-5-carbamimidamidopentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-carbamimidamido-1-carboxylatobutyl]-L-phenylalaninamide|1-[(2S)-2-azaniumyl-5-{[azaniumyl(imino)methyl]amino}pentanoyl]-L-prolyl-L-prolylglycyl-L-phenylalanyl-L-seryl-L-prolyl-N-[(1S)-4-{[azaniumyl(imino)methyl]amino}-1-carboxylatobutyl]-L-phenylalaninamide|bradykinin http://purl.obolibrary.org/obo/CHEBI_132988 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132989 biolink:ChemicalEntity O-acetylhomoserine zwitterion An α-amino acid zwitterion that is O-acetylhomoserine in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3. Graph 4-(acetyloxy)-2-azaniumylbutanoate 4-(acetyloxy)-2-azaniumylbutanoate 4-(acetyloxy)-2-azaniumylbutanoate http://purl.obolibrary.org/obo/CHEBI_132989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:132992 biolink:ChemicalEntity radiosensitizing agent A drug that makes increases the sensitivity of tumour cells to radiation therapy. pubmed:12520460|wikipedia.en:Radiosensitizer Graph radiosensitiser|radiosensitisers|radiosensitising agent|radiosensitising agents|radiosensitizer|radiosensitizers|radiosensitizing agents radiosensitiser|radiosensitisers|radiosensitising agent|radiosensitising agents|radiosensitizer|radiosensitizers|radiosensitizing agents http://purl.obolibrary.org/obo/CHEBI_132992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133000 biolink:ChemicalEntity pregnenolone sulfate(1-) A steroid sulfate oxoanion that is the conjugate base of pregnenolone sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3. reaxys:7195695 Graph (3beta)-20-oxopregn-5-en-3-yl sulfate|20-oxopregn-5-en-3beta-yl sulfate|pregnenolone sulfate 20-oxopregn-5-en-3beta-yl sulfate (3beta)-20-oxopregn-5-en-3-yl sulfate|20-oxopregn-5-en-3beta-yl sulfate|pregnenolone sulfate http://purl.obolibrary.org/obo/CHEBI_133000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133004 biolink:ChemicalEntity bisbenzylisoquinoline alkaloid A type of benzylisoquinoline alkaloid whose structures are built up of two benzylisoquinoline units linked by ether bridges. Various structural patterns resulting from additional bridging between the two units by direct carbon-carbon bridging or by methylenedioxy groups are common. pubmed:1955879|pubmed:2191354|pubmed:3323421 Graph bis(benzylisoquinoline) alkaloid|bis(benzylisoquinoline) alkaloids|bis-benzylisoquinoline alkaloid|bis-benzylisoquinoline alkaloids|bisbenzylisoquinoline alkaloids bis(benzylisoquinoline) alkaloid|bis(benzylisoquinoline) alkaloids|bis-benzylisoquinoline alkaloid|bis-benzylisoquinoline alkaloids|bisbenzylisoquinoline alkaloids http://purl.obolibrary.org/obo/CHEBI_133004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133011 biolink:ChemicalEntity oxytetracycline zwitterion A zwitterion obtained by transfer of a proton from the 2-hydroxy group to the adjacent tertiary amino group of oxytetracycline; major species at pH 7.3. metacyc.compound:CPD-19255 Graph (1S,4aS,11S,11aR,12S,12aR)-3-carbamoyl-1-(dimethylazaniumyl)-4a,5,7,11,12-pentahydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate|oxytetracycline (1S,4aS,11S,11aR,12S,12aR)-3-carbamoyl-1-(dimethylazaniumyl)-4a,5,7,11,12-pentahydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate (1S,4aS,11S,11aR,12S,12aR)-3-carbamoyl-1-(dimethylazaniumyl)-4a,5,7,11,12-pentahydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate|oxytetracycline http://purl.obolibrary.org/obo/CHEBI_133011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133013 biolink:ChemicalEntity brivaracetam A non-proteinogenic amino acid derivative that is butanamide in which the pro-S hydrogen at position 2 is replaced by a (4R)-2-oxo-4-propylpyrrolidin-1-yl. Used for treatment of partial onset seizures related to epilepsy. cas:357336-20-0|drugcentral:5068|kegg.drug:D08879|pubmed:26515103|pubmed:26664121|pubmed:26666500|pubmed:26719676|pubmed:26740317|pubmed:26760311|pubmed:26891946|pubmed:26899665|pubmed:26920914|pubmed:26944275|pubmed:27002062|pubmed:27146213|pubmed:27192732|pubmed:27217762|pubmed:27221208|pubmed:27236448|pubmed:27252986|pubmed:27265725|pubmed:27274002|pubmed:27335114|pubmed:27346728|pubmed:27389600|pubmed:27403785|pubmed:27450143|pubmed:27503181|reaxys:9629290|wikipedia.en:Brivaracetam Graph (2S)-2-[(4R)-2-oxo-4-propylpyrrolidin-1-yl]butanamide|2-(2-Oxo-4-propylpyrrolidin-1-yl)butanamide|Briviact|UCB 34714|UCB34714|brivaracetam (2S)-2-[(4R)-2-oxo-4-propylpyrrolidin-1-yl]butanamide (2S)-2-[(4R)-2-oxo-4-propylpyrrolidin-1-yl]butanamide|2-(2-Oxo-4-propylpyrrolidin-1-yl)butanamide|Briviact|UCB 34714|UCB34714|brivaracetam http://purl.obolibrary.org/obo/CHEBI_133013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133015 biolink:ChemicalEntity alpha-D-Xyl-(1->3)-beta-D-GlcA-(1->3)-alpha-D-Xyl-(1->3)-beta-D-GlcA A tetrasaccharide consisting of alternating D-glucuronic acid and D-xylosyl residues joined in sequence by (1→3)-linkages. A repeating unit in glycoprotein DAG1 Graph Xylalpha1-3GlcAbeta1-3Xylalpha1-3GlcAbeta|alpha-D-Xylp-(1->3)-beta-D-GlcpA-(1->3)-alpha-D-Xylp-(1->3)-beta-D-GlcpA|alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronosyl-(1->3)-alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronic acid|alpha-D-xylosyl-(1->3)-beta-D-glucuronosyl-(1->3)-alpha-D-xylosyl-(1->3)-beta-D-glucuronic acid|alpha-Xyl-(1->3)-beta-GlcA-(1->3)-alpha-Xyl-(1->3)-beta-GlcA alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronosyl-(1->3)-alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronic acid Xylalpha1-3GlcAbeta1-3Xylalpha1-3GlcAbeta|alpha-D-Xylp-(1->3)-beta-D-GlcpA-(1->3)-alpha-D-Xylp-(1->3)-beta-D-GlcpA|alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronosyl-(1->3)-alpha-D-xylopyranosyl-(1->3)-beta-D-glucopyranuronic acid|alpha-D-xylosyl-(1->3)-beta-D-glucuronosyl-(1->3)-alpha-D-xylosyl-(1->3)-beta-D-glucuronic acid|alpha-Xyl-(1->3)-beta-GlcA-(1->3)-alpha-Xyl-(1->3)-beta-GlcA http://purl.obolibrary.org/obo/CHEBI_133015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133016 biolink:ChemicalEntity 5-hydroxytryptamine 2A receptor inverse agonist An inverse agonist that binds to the same receptor as a 5-hydroxytryptamine 2A receptor agonist, but which induces a pharmacological response opposite to that agonist. wikipedia.en:5-HT2A_receptor Graph 5-hydroxytryptamine (2A) receptor inverse agonist|5-hydroxytryptamine (2A) receptor inverse agonists|5-hydroxytryptamine 2A receptor inverse agonists|5HT(2A) inverse agonist|5HT(2A) inverse agonists|5HT2A inverse agonists|5HT2Ainverse agonist 5-hydroxytryptamine (2A) receptor inverse agonist|5-hydroxytryptamine (2A) receptor inverse agonists|5-hydroxytryptamine 2A receptor inverse agonists|5HT(2A) inverse agonist|5HT(2A) inverse agonists|5HT2A inverse agonists|5HT2Ainverse agonist http://purl.obolibrary.org/obo/CHEBI_133016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133017 biolink:ChemicalEntity pimavanserin A member of the class of ureas in which three of the four hydrogens are replaced by 4-fluorobenzyl, 1-methylpiperidin-4-yl, and 4-(isopropyloxy)benzyl groups. An atypical antipsychotic that is used (in the form of its tartrate salt) for treatment of hallucinations and delusions associated with Parkinson's disease. cas:706779-91-1|drugcentral:5142|patent:CA2652300|pubmed:16469866|pubmed:19040345|pubmed:19864614|pubmed:19907417|pubmed:21256805|pubmed:21921840|pubmed:22750845|pubmed:22954754|pubmed:23969614|pubmed:24016069|pubmed:24183563|pubmed:24183566|pubmed:24247322|pubmed:24292660|pubmed:24682754|pubmed:25655720|pubmed:26744739|pubmed:26908168|pubmed:27242287|pubmed:27245248|pubmed:27249096|pubmed:27261226|pubmed:27262680|pubmed:27503570|reaxys:10386699|wikipedia.en:Pimavanserin Graph N-(4-Fluorophenylmethyl)-N-(1-methylpiperidin-4-yl)-N'-(4-(2-methylpropyloxy)phenylmethyl) carbamide|N-[(4-fluorophenyl)methyl]-N-(1-methylpiperidin-4-yl)-N'-{[4-(2-methylpropoxy)phenyl]methyl}urea|pimavanserin N-[(4-fluorophenyl)methyl]-N-(1-methylpiperidin-4-yl)-N'-{[4-(2-methylpropoxy)phenyl]methyl}urea N-(4-Fluorophenylmethyl)-N-(1-methylpiperidin-4-yl)-N'-(4-(2-methylpropyloxy)phenylmethyl) carbamide|N-[(4-fluorophenyl)methyl]-N-(1-methylpiperidin-4-yl)-N'-{[4-(2-methylpropoxy)phenyl]methyl}urea|pimavanserin http://purl.obolibrary.org/obo/CHEBI_133017 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133018 biolink:ChemicalEntity diterpene triepoxide A diterpenoid compound that contains three epoxide groups. patent:US2002068098 Graph diterpene triepoxides diterpene triepoxides http://purl.obolibrary.org/obo/CHEBI_133018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133020 biolink:ChemicalEntity pimavanserin(1+) A piperidinium ion obtained by protonation of the piperidine nitrogen of pimavanserin. Graph 4-{[(4-fluorophenyl)methyl]({[4-(2-methylpropoxy)phenyl]methyl}carbamoyl)amino}-1-methylpiperidin-1-ium|pimavanserin cation 4-{[(4-fluorophenyl)methyl]({[4-(2-methylpropoxy)phenyl]methyl}carbamoyl)amino}-1-methylpiperidin-1-ium 4-{[(4-fluorophenyl)methyl]({[4-(2-methylpropoxy)phenyl]methyl}carbamoyl)amino}-1-methylpiperidin-1-ium|pimavanserin cation http://purl.obolibrary.org/obo/CHEBI_133020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133021 biolink:ChemicalEntity venetoclax A member of the class of pyrrolopyridines that is a potent inhibitor of the antiapoptotic protein B-cell lymphoma 2. It is used for treamtment of chronic lymphocytic leukemia with 17p deletion. cas:1257044-40-8|drugcentral:5133|kegg.drug:D10679|pubmed:24794804|pubmed:25185206|pubmed:25658896|pubmed:25768998|pubmed:25829398|pubmed:25882699|pubmed:25957396|pubmed:26110568|pubmed:26467384|pubmed:26493374|pubmed:26516589|pubmed:26565405|pubmed:26589495|pubmed:26711339|pubmed:26927160|pubmed:26967820|pubmed:27030982|pubmed:27056887|pubmed:27092880|pubmed:27095788|pubmed:27103402|pubmed:27166183|pubmed:27283158|pubmed:27466751|pubmed:27480872|reaxys:20908256|wikipedia.en:Venetoclax Graph 4-{4-[(4'-chloro-5,5-dimethyl[3,4,5,6-tetrahydro[1,1'-biphenyl]]-2-yl)methyl]piperazin-1-yl}-N-(3-nitro-4-{[(oxan-4-yl)methyl]amino}benzene-1-sulfonyl)-2-[(1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]benzamide|ABT 199|ABT-199|ABT199|GDC 0199|Venclexta|venetoclax 4-{4-[(4'-chloro-5,5-dimethyl[3,4,5,6-tetrahydro[1,1'-biphenyl]]-2-yl)methyl]piperazin-1-yl}-N-(3-nitro-4-{[(oxan-4-yl)methyl]amino}benzene-1-sulfonyl)-2-[(1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]benzamide 4-{4-[(4'-chloro-5,5-dimethyl[3,4,5,6-tetrahydro[1,1'-biphenyl]]-2-yl)methyl]piperazin-1-yl}-N-(3-nitro-4-{[(oxan-4-yl)methyl]amino}benzene-1-sulfonyl)-2-[(1H-pyrrolo[2,3-b]pyridin-5-yl)oxy]benzamide|ABT 199|ABT-199|ABT199|GDC 0199|Venclexta|venetoclax http://purl.obolibrary.org/obo/CHEBI_133021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133022 biolink:ChemicalEntity B-cell lymphoma 2 inhibitor Any inhibitor of B-cell lymphoma 2 protein. wikipedia.en:Bcl-2 Graph B-cell lymphoma 2 inhibitors|Bcl-2 inhibitor|Bcl-2 inhibitors B-cell lymphoma 2 inhibitors|Bcl-2 inhibitor|Bcl-2 inhibitors http://purl.obolibrary.org/obo/CHEBI_133022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133050 biolink:ChemicalEntity N-tetradecanoylglycyl group A univalent carboacyl group derived from N-tetradecanoylglycine. Graph N-myristoylglycyl group|N-terminal N-tetradecanoylglycyl residue N-myristoylglycyl group|N-terminal N-tetradecanoylglycyl residue http://purl.obolibrary.org/obo/CHEBI_133050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133066 biolink:ChemicalEntity S-(5-acetamido-2-hydroxyphenyl)cysteine A cysteine derivative in which the thiol hydrogen of cysteine is replaced by a 5-acetamido-2-hydroxyphenyl group. pubmed:1992763|pubmed:2200409|pubmed:2385841|pubmed:2913271 Graph 3-(cystein-S-yl)acetaminophen|3-(cystein-S-yl)paracetamol|S-(5-acetamido-2-hydroxyphenyl)cysteine|acetaminophen cysteine conjugate|cysteine S-acetaminophen conjugate|cysteine S-paracetamol conjugate|paracetamol cysteine conjugate S-(5-acetamido-2-hydroxyphenyl)cysteine 3-(cystein-S-yl)acetaminophen|3-(cystein-S-yl)paracetamol|S-(5-acetamido-2-hydroxyphenyl)cysteine|acetaminophen cysteine conjugate|cysteine S-acetaminophen conjugate|cysteine S-paracetamol conjugate|paracetamol cysteine conjugate http://purl.obolibrary.org/obo/CHEBI_133066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133067 biolink:ChemicalEntity S-(5-acetamido-2-hydroxyphenyl)cysteine zwitterion An α-amino acid zwitterion that is S-(5-acetamido-2-hydroxyphenyl)cysteine in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3. Graph 3-(cystein-S-yl)acetaminophen zwitterion|3-(cystein-S-yl)paracetamol zwitterion|3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]-2-azaniumylpropanoate|acetaminophen cysteine conjugate zwitterion|cysteine S-acetaminophen conjugate zwitterion|cysteine S-paracetamol conjugate zwitterion|paracetamol cysteine conjugate zwitterion 3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]-2-azaniumylpropanoate 3-(cystein-S-yl)acetaminophen zwitterion|3-(cystein-S-yl)paracetamol zwitterion|3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]-2-azaniumylpropanoate|acetaminophen cysteine conjugate zwitterion|cysteine S-acetaminophen conjugate zwitterion|cysteine S-paracetamol conjugate zwitterion|paracetamol cysteine conjugate zwitterion http://purl.obolibrary.org/obo/CHEBI_133067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133076 biolink:ChemicalEntity O-methylmalonylcarnitine(1-) A dicarboxylic acid monoanion that is the conjugate base of O-methylmalonylcarnitine; major species at pH 7.3. Graph 2-methylmalonyl carnitine|2-methylmalonylcarnitine(1-)|3-[(2-carboxylatopropanoyl)oxy]-4-(trimethylazaniumyl)butanoate|O-methylmalonylcarnitine(1-)|methylmalonylcarnitine(1-) 3-[(2-carboxylatopropanoyl)oxy]-4-(trimethylazaniumyl)butanoate 2-methylmalonyl carnitine|2-methylmalonylcarnitine(1-)|3-[(2-carboxylatopropanoyl)oxy]-4-(trimethylazaniumyl)butanoate|O-methylmalonylcarnitine(1-)|methylmalonylcarnitine(1-) http://purl.obolibrary.org/obo/CHEBI_133076 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133092 biolink:ChemicalEntity gamma-Glu-Abu A dipeptide obtained by formal condensation of the γ-carboxy group of glutamic acid with the amino group of 2-aminobutyric acid. reaxys:25853400 Graph N-(1-carboxypropyl)glutamine|gamma-glutamyl-2-aminobutyric acid N-(1-carboxypropyl)glutamine N-(1-carboxypropyl)glutamine|gamma-glutamyl-2-aminobutyric acid http://purl.obolibrary.org/obo/CHEBI_133092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133093 biolink:ChemicalEntity gamma-Glu-Abu(1-) A peptide anion that is the conjugate base of γ-Glu-Abu, obtained by removal of protons from the two carboxy groups as well as protonation of the amino group; major species at pH 7.3. Graph 2-azaniumyl-5-[(1-carboxylatopropyl)amino]-5-oxopentanoate|gamma-glutamyl-2-aminobutyrate 2-azaniumyl-5-[(1-carboxylatopropyl)amino]-5-oxopentanoate 2-azaniumyl-5-[(1-carboxylatopropyl)amino]-5-oxopentanoate|gamma-glutamyl-2-aminobutyrate http://purl.obolibrary.org/obo/CHEBI_133093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133118 biolink:ChemicalEntity 5alpha-pregnane-3beta,20alpha-diol disulfate anion A steroid sulfate oxoanion obtained by deprotonation of at least one of the sulfo groups of 5α-pregnan-3β,20α-diol disulfate Graph 5alpha-pregnan-3beta,20alpha-diol disulfate 5alpha-pregnan-3beta,20alpha-diol disulfate http://purl.obolibrary.org/obo/CHEBI_133118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133119 biolink:ChemicalEntity 5alpha-pregnane-3beta,20alpha-diol disulfate A steroid sulfate that is 5α-pregnane-3β,20α-diol in which both hydroxy hydrogens have been replaced by sulfo groups. cas:27935-53-1 Graph (20S)-5alpha-pregnane-3beta,20-diyl bis(hydrogen sulfate)|(3beta,5alpha,20S)-pregnane-3,20-diyl bis(hydrogen sulfate)|Pregnane-3,20-diol 3,20-disulfate (20S)-5alpha-pregnane-3beta,20-diyl bis(hydrogen sulfate) (20S)-5alpha-pregnane-3beta,20-diyl bis(hydrogen sulfate)|(3beta,5alpha,20S)-pregnane-3,20-diyl bis(hydrogen sulfate)|Pregnane-3,20-diol 3,20-disulfate http://purl.obolibrary.org/obo/CHEBI_133119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133121 biolink:ChemicalEntity 5alpha-pregnane-3beta,20alpha-diol disulfate(2-) A 5α-pregnane-3β,20α-diol disulfate anion obtained by deprotonation of both sulfo groups of 5α-pregnane-3β,20α-diol disulfate. Graph (20S)-5alpha-pregnane-3beta,20-diyl disulfate|(3beta,5alpha,20S)-pregnane-3,20-diyl disulfate (20S)-5alpha-pregnane-3beta,20-diyl disulfate (20S)-5alpha-pregnane-3beta,20-diyl disulfate|(3beta,5alpha,20S)-pregnane-3,20-diyl disulfate http://purl.obolibrary.org/obo/CHEBI_133121 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133131 biolink:ChemicalEntity spiro-epoxide An oxaspiro compound in which a carbon atom of an epoxide ring is the only common member of two rings. Graph spiro-epoxides|spiroepoxide|spiroepoxides spiro-epoxides|spiroepoxide|spiroepoxides http://purl.obolibrary.org/obo/CHEBI_133131 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133134 biolink:ChemicalEntity prostaglandin H3(1-) A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin H3, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoate|(5Z,9S,11R,13E,15S,17Z)-15-hydroxy-9,11-epidioxyprosta-5,13,17-trienoate|prostaglandin H3 (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoate (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoate|(5Z,9S,11R,13E,15S,17Z)-15-hydroxy-9,11-epidioxyprosta-5,13,17-trienoate|prostaglandin H3 http://purl.obolibrary.org/obo/CHEBI_133134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133135 biolink:ChemicalEntity chromenochromene Any organic heteroolycyclic compound whose skeleton two ortho-fused chromene rings, and their derivatives. Graph chromenochromenes chromenochromenes http://purl.obolibrary.org/obo/CHEBI_133135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133202 biolink:ChemicalEntity (ADP-D-ribosyl)(n)-acceptor A generic representative substrate in the ADP ribosylation of proteins Graph http://purl.obolibrary.org/obo/CHEBI_133202 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:133203 biolink:ChemicalEntity (ADP-D-ribosyl)(n+1)-acceptor A generic representative product of ADP ribosylation of proteins Graph http://purl.obolibrary.org/obo/CHEBI_133203 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:133220 biolink:ChemicalEntity tuberonic acid An oxo monocarboxylic acid that is (+)-7-isojasmonic acid in which one of the hydrogens of the side-chain methyl group is replaced by a hydroxy group. cas:124649-26-9|chemspider:4947920|knapsack:C00000221|lipidmaps:LMFA02020007|reaxys:11073168 Graph (+)-12-hydroxy-7-isojasmonic acid|(1R,2S)-3-oxo-2-(5'-hydroxy-2'Z-pentenyl)-cyclopentaneacetic acid|12-hydroxy-epi-jasmonic acid|{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetic acid {(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetic acid (+)-12-hydroxy-7-isojasmonic acid|(1R,2S)-3-oxo-2-(5'-hydroxy-2'Z-pentenyl)-cyclopentaneacetic acid|12-hydroxy-epi-jasmonic acid|{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetic acid http://purl.obolibrary.org/obo/CHEBI_133220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133241 biolink:ChemicalEntity omega-carboxyacyl-CoA(5-) An acyl-CoA oxoanion obtained by deprotonation of the phosphate, diphosphate and carboxy groups of any ω-carboxyacyl-CoA; major species at pH 7.3. Graph omega-dicarboxyl-CoA omega-dicarboxyl-CoA http://purl.obolibrary.org/obo/CHEBI_133241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133243 biolink:ChemicalEntity O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue An O-(S-acylpantetheine-4'-phosphoryl)serine(1−) residue in which the S-acyl group is derived from a long-chain fatty acid. Graph O-(S-(long-chain fatty acyl)pantetheine-4'-phosphoryl)serine residue O-(S-(long-chain fatty acyl)pantetheine-4'-phosphoryl)serine residue http://purl.obolibrary.org/obo/CHEBI_133243 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:133246 biolink:ChemicalEntity tetramethylpyrazine A member of the class of pyrazines that is pyrazine in which all four hydrogens have been replaced by methyl groups. An alkaloid extracted from Chuanxiong (Ligusticum wallichii). cas:1124-11-4|hmdb:HMDB0036584|metacyc.compound:CPD-15901|pubmed:11583735|pubmed:18790005|pubmed:21456940|pubmed:23253813|pubmed:23563941|pubmed:2413290|pubmed:24333010|pubmed:25841319|pubmed:26275042|pubmed:26404762|pubmed:27179035|pubmed:27389185|pubmed:27391608|pubmed:27431939|pubmed:27607420|pubmed:27610159|pubmed:27717875|reaxys:113100|wikipedia.en:Tetramethylpyrazine Graph 2,3,5,6,-tetramethyl-1,4-pyrazine|2,3,5,6-tetramethylpyrazine|FEMA 3237|FEMA No. 3237|TMP|liqustrazine|tetramethylpyrazine tetramethylpyrazine 2,3,5,6,-tetramethyl-1,4-pyrazine|2,3,5,6-tetramethylpyrazine|FEMA 3237|FEMA No. 3237|TMP|liqustrazine|tetramethylpyrazine http://purl.obolibrary.org/obo/CHEBI_133246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133249 biolink:ChemicalEntity saturated fatty aldehyde A fatty aldehyde in which there is no carbon-carbon unsaturation. pubmed:14564727|pubmed:17805609|pubmed:4531008 Graph a saturated fatty aldehyde|saturated fatty aldehydes a saturated fatty aldehyde|saturated fatty aldehydes http://purl.obolibrary.org/obo/CHEBI_133249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133251 biolink:ChemicalEntity 3-hydroxydicarboxylate(2-) A dicarboxylic acid dianion that results from the removal of a proton from both of the carboxylic acid groups of any 3-hydroxydicarboxylic acid. Graph 3-hydroxydicarboxylic acid dianion(2-)|a 3-hydroxy dicarboxylic acid 3-hydroxydicarboxylic acid dianion(2-)|a 3-hydroxy dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_133251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133291 biolink:ChemicalEntity saturated dicarboxylic acid dianion(2-) A carboxylic acid dianion obtained by deprotonation of both carboxy groups of any dicarboxylic acid that contains no carbon-carbon double bonds. Graph a saturated dicarboxylic acid a saturated dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_133291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133292 biolink:ChemicalEntity 3-oxo fatty acid anion An oxo fatty acid anion obtained by deprotonation of the carboxy group of any 3-oxo fatty acid. Graph 3-keto fatty acid anion|3-keto fatty acid anions|a 3-oxo fatty acid 3-keto fatty acid anion|3-keto fatty acid anions|a 3-oxo fatty acid http://purl.obolibrary.org/obo/CHEBI_133292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133294 biolink:ChemicalEntity oxo dicarboxylic acid dianion A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of any oxo dicarboxylic acid. Graph oxo dicarboxylic acid dianions oxo dicarboxylic acid dianions http://purl.obolibrary.org/obo/CHEBI_133294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133309 biolink:ChemicalEntity 12-dehydro-leukotriene B4(1-) An icosanoid anion that is the conjugate base of 12-dehydro-leukotriene B4, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoate|12-dehydroleukotriene B4(1-)|12-oxo-leukotriene B4|5(S)-hydroxy-12-oxo-(6Z,8E,10E,14Z)-eicosatetraenoate (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoate (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoate|12-dehydroleukotriene B4(1-)|12-oxo-leukotriene B4|5(S)-hydroxy-12-oxo-(6Z,8E,10E,14Z)-eicosatetraenoate http://purl.obolibrary.org/obo/CHEBI_133309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13332 biolink:ChemicalEntity GDP-beta-L-fucose A GDP-L-fucose in which the anomeric oxygen is on the same side of the fucose ring as the methyl substituent. cas:15839-70-0|kegg.compound:C00325|pdb-ccd:GFB|pubmed:10424902|pubmed:10988249|pubmed:11502265|pubmed:21966509|pubmed:22588082|pubmed:27434622|pubmed:28334865|pubmed:28530709|pubmed:8495447|reaxys:75468 Graph GDP-beta-L-fucose|guanosine 5'-[3-(6-deoxy-beta-L-galactopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(6-deoxy-beta-L-galactopyranosyl) dihydrogen diphosphate] GDP-beta-L-fucose|guanosine 5'-[3-(6-deoxy-beta-L-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_13332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133326 biolink:ChemicalEntity barium sulfate A metal sulfate with formula BaO4S. Virtually insoluble in water at room temperature, it is mostly used as a component in oil well drilling fluid it occurs naturally as the mineral barite. cas:7727-43-7|kegg.drug:D02052|pubmed:22831859|pubmed:25710096|pubmed:26903568|reaxys:11343139|wikipedia.en:Barium_sulfate Graph BaSO4|Baritop|Barosperse|Barotrast|E-Z-Paque|Enamel White|EneCat|EneMark|EntroBar|Esophotrast|Liquipake|Macropaque|Micropaque|Microtrast|Pigment White 22|Radiobaryt|Radiopaque|Readi-CAT|barite|barium sulfate|blanc fixe|sulfuric acid, barium salt (1:1) barium sulfate BaSO4|Baritop|Barosperse|Barotrast|E-Z-Paque|Enamel White|EneCat|EneMark|EntroBar|Esophotrast|Liquipake|Macropaque|Micropaque|Microtrast|Pigment White 22|Radiobaryt|Radiopaque|Readi-CAT|barite|barium sulfate|blanc fixe|sulfuric acid, barium salt (1:1) http://purl.obolibrary.org/obo/CHEBI_133326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133334 biolink:ChemicalEntity small nucleolar RNA A group of non-coding RNAs that primarily accumulate in the nucleoli and consist of 60-300 nucleotides. They are responsible for the post-transcriptional modification and maturation of ribosomal RNAs (rRNAs), small nuclear RNAs (snRNAs), and other cellular RNAs. There are two main classes of snoRNA, the C/D box snoRNAs, which are associated with methylation, and the H/ACA box snoRNAs, which are associated with pseudouridylation. pubmed:31338327|pubmed:31780925|pubmed:31828325|pubmed:32312483|pubmed:32393576|pubmed:32599901|pubmed:33104528|pubmed:33288886|pubmed:33315200|pubmed:33400969|pubmed:33501699|pubmed:33561224|pubmed:33894626|pubmed:33938625|pubmed:34088344|pubmed:34228845|wikipedia.en:Small_nucleolar_RNA Graph small nucleolar RNAs|snoRNA|snoRNAs small nucleolar RNAs|snoRNA|snoRNAs http://purl.obolibrary.org/obo/CHEBI_133334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133353 biolink:ChemicalEntity montmorillonite An aluminosilicate mineral consisting of aluminosilicate layers approximately 1 nm thick which are surface-substituted with metal cations and stacked in ca. 10 μm-sized multilayer stacks. Its approximate formula is R+0.33(Al,Mg)2Si4O10(OH)2.nH2O where R+ includes one or more of the cations Na+, K+, Mg2+, and Ca2+. agr:IND43816870|cas:1318-93-0|pubmed:14576428|pubmed:17767730|pubmed:17874771|pubmed:24453833|reaxys:11403277|reaxys:16080915|wikipedia.en:Montmorillonite Graph montmorillonite clay montmorillonite clay http://purl.obolibrary.org/obo/CHEBI_133353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133354 biolink:ChemicalEntity bentonite An aluminosilicate mineral consisting mostly of montmorillonite. The different types of bentonite (aluminium bentonite; calcium bentonite; potassium bentonite; sodium bentonite) are named after their dominant element. cas:1302-78-9|reaxys:8194168|wikipedia.en:Bentonite Graph http://purl.obolibrary.org/obo/CHEBI_133354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133367 biolink:ChemicalEntity resolvin D2(1-) A polyunsaturated fatty acid anion that is the conjugate base of resolvin D2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7S,8E,10Z,12E,14E,16R,17S,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoate|(7S,16R,17S)-trihydroxy-(4Z,8E,10Z,12E,14E,19Z)-docosahexaenoate|resolvin D2 (4Z,7S,8E,10Z,12E,14E,16R,17S,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoate (4Z,7S,8E,10Z,12E,14E,16R,17S,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoate|(7S,16R,17S)-trihydroxy-(4Z,8E,10Z,12E,14E,19Z)-docosahexaenoate|resolvin D2 http://purl.obolibrary.org/obo/CHEBI_133367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133368 biolink:ChemicalEntity resolvin E2(1-) A polyunsaturated fatty acid anion that is the conjugate base of resolvin E2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5S,18R)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18R)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate|resolvin E2 (5S,6E,8Z,11Z,14Z,16E,18R)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate (5S,18R)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18R)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate|resolvin E2 http://purl.obolibrary.org/obo/CHEBI_133368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133370 biolink:ChemicalEntity prostaglandin A2(1-) A prostaglandin carboxylic acid anion resulting from the removal of the proton from the carboxy group of prostaglandin A2. Graph (5E)-7-{2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopent-3-en-1-yl}hept-5-enoate|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oate|PGA2|prostaglandin 2|prostaglandin A(2) (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oate (5E)-7-{2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopent-3-en-1-yl}hept-5-enoate|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oate|PGA2|prostaglandin 2|prostaglandin A(2) http://purl.obolibrary.org/obo/CHEBI_133370 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133374 biolink:ChemicalEntity 13,14-dihydro-15-keto-PGF2alpha(1-) A prostaglandin carboxylic acid anion that is the conjugate base of 13,14-dihydro-15-keto-PGF2α, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:17449869 Graph (5Z,9alpha,11alpha)-9,11-dihydroxy-15-oxoprost-5-en-1-oate|13,14-dihydro-15-ketoprostaglandin F2alpha(1-)|13,14-dihydro-15-oxo-PGF2-alpha (5Z,9alpha,11alpha)-9,11-dihydroxy-15-oxoprost-5-en-1-oate (5Z,9alpha,11alpha)-9,11-dihydroxy-15-oxoprost-5-en-1-oate|13,14-dihydro-15-ketoprostaglandin F2alpha(1-)|13,14-dihydro-15-oxo-PGF2-alpha http://purl.obolibrary.org/obo/CHEBI_133374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133391 biolink:ChemicalEntity prostaglandin B2(1-) A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin B2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oate|PGB2|Prostaglandin B2|prostaglandin B(2) (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oate (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oate|PGB2|Prostaglandin B2|prostaglandin B(2) http://purl.obolibrary.org/obo/CHEBI_133391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133392 biolink:ChemicalEntity prostaglandin C2(1-) A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin C2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oate|PGC2|Prostaglandin C2|prostaglandin C(2) (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oate (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oate|PGC2|Prostaglandin C2|prostaglandin C(2) http://purl.obolibrary.org/obo/CHEBI_133392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133396 biolink:ChemicalEntity prostaglandin J2(1-) A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin J2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oate|PGJ2|Prostaglandin J2|prostaglandin J(2) (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oate (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oate|PGJ2|Prostaglandin J2|prostaglandin J(2) http://purl.obolibrary.org/obo/CHEBI_133396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133409 biolink:ChemicalEntity 15-oxoprostaglandin F2alpha(1-) A prostaglandin carboxylic acid anion that is the conjugate base of 15-oxoprostaglandin F2α, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:17449869 Graph 15-oxo-PGF2alpha(1-)|15-oxoprostaglandin F(2-alpha) 15-oxo-PGF2alpha(1-)|15-oxoprostaglandin F(2-alpha) http://purl.obolibrary.org/obo/CHEBI_133409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133414 biolink:ChemicalEntity N-acetyl-L-methionyl residue An N-acetylamino-acid residue derived from N-acetyl-L-methionine. Graph Ac-Met residue|N-acetylmethionyl residue|N-terminal N(alpha)-acetyl-L-methionine residue Ac-Met residue|N-acetylmethionyl residue|N-terminal N(alpha)-acetyl-L-methionine residue http://purl.obolibrary.org/obo/CHEBI_133414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133424 biolink:ChemicalEntity 13,14-dihydro-Delta(12)-prostaglandin J2(1-) A prostaglandin carboxylic acid anion that is the conjugate base of 13,14-dihydro-Δ12-prostaglandin J2, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oate|13,14-dihydro-Delta(12)-PGJ2(1-)|Delta(12)-prostaglandin J(2) (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oate (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oate|13,14-dihydro-Delta(12)-PGJ2(1-)|Delta(12)-prostaglandin J(2) http://purl.obolibrary.org/obo/CHEBI_133424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133427 biolink:ChemicalEntity omega-ammonioaldehyde An ammonio aldehyde that is an aliphatic aldehyde in which one of the hydrogens of the terminal methyl group has been replaced by an ammonio group. NH3+CH2(CH2)nCHO, where n = 0, 1, 2, etc. Graph an omega-aminoaldehyde an omega-aminoaldehyde http://purl.obolibrary.org/obo/CHEBI_133427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133435 biolink:ChemicalEntity S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine An S-substituted N-acetyl-L-cysteine in which the S-substitutuent is specified as 5-acetamido-2-hydroxyphenyl. cas:52372-86-8|pubmed:1440617|pubmed:2087153|pubmed:6833497|pubmed:7705777|reaxys:8395991 Graph 3-(N-acetyl-L-cystein-S-yl)acetaminophen|Acetaminophen mercapturate|N-Acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-L-cysteine|N-acetyl-L-cysteine S-acetaminophen conjugate|N-acetyl-L-cysteine S-paracetamol conjugate|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine|acetaminophen N-acetyl-L-cysteine conjugate|acetaminophen mercapturic acid|paracetamol N-acetyl-L-cysteine conjugate S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine 3-(N-acetyl-L-cystein-S-yl)acetaminophen|Acetaminophen mercapturate|N-Acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-L-cysteine|N-acetyl-L-cysteine S-acetaminophen conjugate|N-acetyl-L-cysteine S-paracetamol conjugate|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine|acetaminophen N-acetyl-L-cysteine conjugate|acetaminophen mercapturic acid|paracetamol N-acetyl-L-cysteine conjugate http://purl.obolibrary.org/obo/CHEBI_133435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133438 biolink:ChemicalEntity S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteinate An S-substituted N-acetyl-L-cysteine that is the conjugate base of S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (2R)-2-acetamido-3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]propanoate|3-(N-acetyl-L-cystein-S-yl)acetaminophen(1-)|N-acetyl-L-cysteinate S-acetaminophen conjugate|N-acetyl-L-cysteinate S-paracetamol conjugate|N-acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-L-cysteine|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteinate|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine(1-)|acetaminophen N-acetyl-L-cysteinate conjugate|acetaminophen mercapturate|paracetamol N-acetyl-L-cysteinate conjugate (2R)-2-acetamido-3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]propanoate (2R)-2-acetamido-3-[(5-acetamido-2-hydroxyphenyl)sulfanyl]propanoate|3-(N-acetyl-L-cystein-S-yl)acetaminophen(1-)|N-acetyl-L-cysteinate S-acetaminophen conjugate|N-acetyl-L-cysteinate S-paracetamol conjugate|N-acetyl-S-(5-(acetylamino)-2-hydroxyphenyl)-L-cysteine|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteinate|S-(5-acetamido-2-hydroxyphenyl)-N-acetyl-L-cysteine(1-)|acetaminophen N-acetyl-L-cysteinate conjugate|acetaminophen mercapturate|paracetamol N-acetyl-L-cysteinate conjugate http://purl.obolibrary.org/obo/CHEBI_133438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133442 biolink:ChemicalEntity (5R)-5-hydroxy-L-lysine(1+) residue An amino-acid cation residue obtained by protonation of the side-chain amino group of (5R)-5-hydroxy-L-lysine residue residue; major species at pH 7.3. metacyc.compound:PROCOLLAGEN-5-HYDROXY-L-LYSINE Graph (5R)-5-hydroxy-L-lysine residue|L-erythro-5-hydroxy-L-lysine residue (5R)-5-hydroxy-L-lysine residue|L-erythro-5-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_133442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133443 biolink:ChemicalEntity (5R)-5-(beta-D-galactosyloxy)-L-lysine(1+) residue An α-amino-acid cation residue obtained by protonation of the side-chain amino group of (5R)-5-(β-D-galactosyloxy)-L-lysine residue; major species at pH 7.3. Graph (5R)-5-O-(beta-D-galactosyl)-5-hydroxy-L-lysine residue (5R)-5-O-(beta-D-galactosyl)-5-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_133443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133445 biolink:ChemicalEntity saturated fatty acyl-L-carnitine An O-acylcarnitine in which the R is a saturated fatty acyl chain. Graph a saturated fatty acyl-L-carnitine a saturated fatty acyl-L-carnitine http://purl.obolibrary.org/obo/CHEBI_133445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133446 biolink:ChemicalEntity monounsaturated fatty acyl-L-carnitine An O-acylcarnitine in which the R is a monounsaturated fatty acyl chain. Graph a monounsaturated fatty acyl-L-carnitine a monounsaturated fatty acyl-L-carnitine http://purl.obolibrary.org/obo/CHEBI_133446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133447 biolink:ChemicalEntity methyl-branched fatty acyl-L-carnitine An O-acylcarnitine in which the R group is a methyl-branched fatty acyl chain. Graph a methyl-branched fatty acyl-L-carnitine a methyl-branched fatty acyl-L-carnitine http://purl.obolibrary.org/obo/CHEBI_133447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133451 biolink:ChemicalEntity 6-oxoprostaglandin F1alpha(1-) A prostaglandin carboxylic acid anion that is the conjugate base of 6-oxoprostaglandin F1α, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph 6-oxo-PGF1alpha(1-)|6-oxo-prostaglandin F1alpha(1-) 6-oxo-PGF1alpha(1-)|6-oxo-prostaglandin F1alpha(1-) http://purl.obolibrary.org/obo/CHEBI_133451 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133452 biolink:ChemicalEntity (5R)-5-[(alpha-D-glucosyl-(1->2)-beta-D-galactosyl)oxy]-L-lysine(1+) residue An α-amino-acid cation residue obtained by protonation of the side-chain amino group of (5R)-5-[(α-D-glucosyl-(1→2)-β-D-galactosyl)oxy]-L-lysine residue; major species at pH 7.3. Graph (5R)-5-O-(alpha-D-glucosyl-(1->2)-beta-D-galactosyl)-5-hydroxy-L-lysine residue (5R)-5-O-(alpha-D-glucosyl-(1->2)-beta-D-galactosyl)-5-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_133452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13346 biolink:ChemicalEntity Glu-tRNA(Glx) Graph Glu-tRNA(Glx)|L-glutamyl-tRNA(Glx) Glu-tRNA(Glx)|L-glutamyl-tRNA(Glx) http://purl.obolibrary.org/obo/CHEBI_13346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133470 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminide Any glycoside derived from β-D-galactosyl-(1→3)-N-acetyl-α-D-galactosamine. Graph a beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl derivative|beta-D-Gal-(1->3)-alpha-D-GalNAc-OR a beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl derivative|beta-D-Gal-(1->3)-alpha-D-GalNAc-OR http://purl.obolibrary.org/obo/CHEBI_133470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133476 biolink:ChemicalEntity hydantoin-5-propionate A monocarboxylic acid anion that is the conjugate base of hydantoin-5-propionic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph 3-(2,5-dioxoimidazolidin-4-yl)propanoate|hydantoin-5-propanoate 3-(2,5-dioxoimidazolidin-4-yl)propanoate 3-(2,5-dioxoimidazolidin-4-yl)propanoate|hydantoin-5-propanoate http://purl.obolibrary.org/obo/CHEBI_133476 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133479 biolink:ChemicalEntity S-(long-chain fatty acyl)-L-cysteine residue An L-α-amino acid residue derived from any S-(long-chain fatty acyl)-L-cysteine. Graph S-(long-chain fatty acyl)-L-cysteine residue S-(long-chain fatty acyl)-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_133479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133492 biolink:ChemicalEntity polyunsaturated dicarboxylic acid dianion A dicarboxylic acid dianion having 2 or more units of unsaturation. Graph a polyunsaturated dicarboxylic fatty acid|polyunsaturated dicarboxylic acid dianions|polyunsaturated dicarboxylic acid(2-) a polyunsaturated dicarboxylic fatty acid|polyunsaturated dicarboxylic acid dianions|polyunsaturated dicarboxylic acid(2-) http://purl.obolibrary.org/obo/CHEBI_133492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133493 biolink:ChemicalEntity omega-(methylthio)-2-oxocarboxylate A 2-oxo monocarboxylic acid anion obtained by deprotonation of the carboxy group of any ω-(methylthio)-2-oxocarboxylic acid; major species at pH 7.3. metacyc.compound:CPD-19485|pubmed:14740211|pubmed:17369439 Graph an omega-(methylsulfanyl)-2-oxoalkanoate an omega-(methylsulfanyl)-2-oxoalkanoate http://purl.obolibrary.org/obo/CHEBI_133493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133494 biolink:ChemicalEntity 2-(omega-methylthio)alkylmalate(2-) A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of any 2-(ω-methylthio)alkylmalic acid; major species at pH 7.3. metacyc.compound:CPD-19482|pubmed:14740211|pubmed:17369439 Graph a 2-omega-(methylsulfanyl)alkylmalate a 2-omega-(methylsulfanyl)alkylmalate http://purl.obolibrary.org/obo/CHEBI_133494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133506 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminide Any glycoside derived from β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosamine metacyc.compound:beta-Gal-13-beta-GlcNac-R Graph a beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-beta-D-GlcNAc-OR a beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-beta-D-GlcNAc-OR http://purl.obolibrary.org/obo/CHEBI_133506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133507 biolink:ChemicalEntity beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide Any glycoside derived from β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine kegg.compound:C04657|metacyc.compound:B-Gal-14-NacGlc-R|pubmed:2118655|pubmed:804484 Graph a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->4)-beta-D-GlcNAc-OR a beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->4)-beta-D-GlcNAc-OR http://purl.obolibrary.org/obo/CHEBI_133507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133509 biolink:ChemicalEntity alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminide Any glycoside derived from α-L-fucosyl-(1→2)-β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosamine metacyc.compound:Type-1-H-Antigen Graph alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-OR|an alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc derivative alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-OR|an alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc derivative http://purl.obolibrary.org/obo/CHEBI_133509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133511 biolink:ChemicalEntity 3-hydroxyoctanoate A 3-hydroxy fatty acid anion that is the conjugate base of 3-hydroxyoctanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph 3-hydroxycaprylate|3-hydroxyoctanoate|beta-hydroxycaprylate|beta-hydroxyoctanoate 3-hydroxyoctanoate 3-hydroxycaprylate|3-hydroxyoctanoate|beta-hydroxycaprylate|beta-hydroxyoctanoate http://purl.obolibrary.org/obo/CHEBI_133511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133513 biolink:ChemicalEntity 3-methylglutaconate anion A dicarboxylic anion obtained by deprotonation of at least one of the carboxy groups of 3-methylglutaconic acid. Graph 3-methylglutaconate anions 3-methylglutaconate anions http://purl.obolibrary.org/obo/CHEBI_133513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133518 biolink:ChemicalEntity (E)-3-methylglutaconate anion A 3-methylglutaconate anion obtained by deprotonation of at least one of the carboxyl groups of (E)-3-methylglutaconic acid. Graph (E)-3-methylglutaconate anions|(E)-beta-methylglutaconate anion|(E)-beta-methylglutaconate anions (E)-3-methylglutaconate anions|(E)-beta-methylglutaconate anion|(E)-beta-methylglutaconate anions http://purl.obolibrary.org/obo/CHEBI_133518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133520 biolink:ChemicalEntity N-acetyl-L-alaninate A monocarboxylic acid anion that is the conjugate base of N-acetyl-L-alanine, obtained by deprotonation of the carboxy group; major species at pH 7.3. reaxys:4131390 Graph (2S)-2-acetamidopropanoate|N(alpha)-acetyl-L-alanine|N-acetylalaninate (2S)-2-acetamidopropanoate (2S)-2-acetamidopropanoate|N(alpha)-acetyl-L-alanine|N-acetylalaninate http://purl.obolibrary.org/obo/CHEBI_133520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133524 biolink:ChemicalEntity dopamine 3-O-sulfate zwitterion A zwitterion obtained by transfer of a proton from the sulfonyl to the amino group of dopamine 3-O-sulfate; major species at pH 7.3. Graph 5-(2-azaniumylethyl)-2-hydroxyphenyl sulfate|dopamine 3-O-sulfate|dopamine 3-monosulfate zwitterion|dopamine 3-sulfate zwitterion 5-(2-azaniumylethyl)-2-hydroxyphenyl sulfate 5-(2-azaniumylethyl)-2-hydroxyphenyl sulfate|dopamine 3-O-sulfate|dopamine 3-monosulfate zwitterion|dopamine 3-sulfate zwitterion http://purl.obolibrary.org/obo/CHEBI_133524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133526 biolink:ChemicalEntity oxodocosahexaenoate An oxo fatty acid anion obtained by deproitonation of any oxo-DoHE; major species at pH 7.3. Graph ketodocosahexaenoate|oxo-DoHE(1-)|oxodocosahexaenoates ketodocosahexaenoate|oxo-DoHE(1-)|oxodocosahexaenoates http://purl.obolibrary.org/obo/CHEBI_133526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133538 biolink:ChemicalEntity L-lysine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of L-lysine; major species at pH 7.3. Graph (2S)-6-amino-2-azaniumylhexanoate|L-lysine|Lys|lysine zwitterion (2S)-6-amino-2-azaniumylhexanoate (2S)-6-amino-2-azaniumylhexanoate|L-lysine|Lys|lysine zwitterion http://purl.obolibrary.org/obo/CHEBI_133538 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133539 biolink:ChemicalEntity hydroxyicosatrienoate A hydroxy polyunsaturated fatty acid anion consisting of icosatrieonate anion carrying one or more hydroxy substituents. Graph hydroxy-eicosatrienoate|hydroxyeicosatrienoate hydroxy-eicosatrienoate|hydroxyeicosatrienoate http://purl.obolibrary.org/obo/CHEBI_133539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133558 biolink:ChemicalEntity hydroperoxyoctadecatrienoate An octadecanoid anion that is octadecatrienoate containing a hydroperoxy substituent attached to its carbon chain. Graph HPOTrE(1-)|hydroperoxyoctadecatrienoates HPOTrE(1-)|hydroperoxyoctadecatrienoates http://purl.obolibrary.org/obo/CHEBI_133558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133564 biolink:ChemicalEntity D-glucosyl salicylate A benzoate ester resulting from the formal condensation of the carboxy group of salicylic acid with the anomeric hydroxy group of D-glucose. Graph 1-O-(2-hydroxybenzoyl)-D-glucopyranose|1-O-(2-hydroxybenzoyl)-D-glucose|1-O-salicyl-D-glucose|salicylate-D-glucose ester 1-O-(2-hydroxybenzoyl)-D-glucopyranose 1-O-(2-hydroxybenzoyl)-D-glucopyranose|1-O-(2-hydroxybenzoyl)-D-glucose|1-O-salicyl-D-glucose|salicylate-D-glucose ester http://purl.obolibrary.org/obo/CHEBI_133564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133574 biolink:ChemicalEntity 5-hydroxylysinium An α-amino-acid cation obtained by deprotonation of the carboxy group and protonation of the two amino groups of 5-hydroxylysine. Graph 2,6-bis(azaniumyl)-5-hydroxyhexanoate|2,6-bis[(azaniumyl)]-2,3,4,6-tetradeoxyhexonate|5-hydroxylysine|5-hydroxylysine cation|5-hydroxylysine(1+) 2,6-bis(azaniumyl)-5-hydroxyhexanoate|2,6-bis[(azaniumyl)]-2,3,4,6-tetradeoxyhexonate 2,6-bis(azaniumyl)-5-hydroxyhexanoate|2,6-bis[(azaniumyl)]-2,3,4,6-tetradeoxyhexonate|5-hydroxylysine|5-hydroxylysine cation|5-hydroxylysine(1+) http://purl.obolibrary.org/obo/CHEBI_133574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133575 biolink:ChemicalEntity N-acyl-gamma-aminobutyrate A monocarboxylic acid anion that is the conjugate base of N-acyl-γ-aminobutyric acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph N-acyl-4-aminobutanoate|N-acyl-4-aminobutyrate|N-acyl-gamma-aminobutanoate N-acyl-4-aminobutanoate|N-acyl-4-aminobutyrate|N-acyl-gamma-aminobutanoate http://purl.obolibrary.org/obo/CHEBI_133575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133580 biolink:ChemicalEntity N-hexanoylglycinate A monocarboxylic acid anion that is the conjugate base of N-hexanoylglycine, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (hexanoylamino)acetate|N-caproylglycinate|N-hexanoylglycine|N-hexanoylglycine anion|N-hexanoylglycine(1-) (hexanoylamino)acetate (hexanoylamino)acetate|N-caproylglycinate|N-hexanoylglycine|N-hexanoylglycine anion|N-hexanoylglycine(1-) http://purl.obolibrary.org/obo/CHEBI_133580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133598 biolink:ChemicalEntity chlortetracycline(1-) An organic anion that is the major structure of chlortetracycline at pH 7.3 (according to Marvin v 6.2.0.). metacyc.compound:CPD-19258 Graph (5S,5aS,6aS,7S,10aS)-9-carbamoyl-4-chloro-7-(dimethylazaniumyl)-5,10a,11-trihydroxy-5-methyl-10,12-dioxo-5,5a,6,6a,7,10,10a,12-octahydrotetracene-1,8-bis(olate)|7-chlorotetracycline (5S,5aS,6aS,7S,10aS)-9-carbamoyl-4-chloro-7-(dimethylazaniumyl)-5,10a,11-trihydroxy-5-methyl-10,12-dioxo-5,5a,6,6a,7,10,10a,12-octahydrotetracene-1,8-bis(olate) (5S,5aS,6aS,7S,10aS)-9-carbamoyl-4-chloro-7-(dimethylazaniumyl)-5,10a,11-trihydroxy-5-methyl-10,12-dioxo-5,5a,6,6a,7,10,10a,12-octahydrotetracene-1,8-bis(olate)|7-chlorotetracycline http://purl.obolibrary.org/obo/CHEBI_133598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133602 biolink:ChemicalEntity carbon black nanoparticle Any form of carbon black which has a particle size of less than 100 nm in each dimension. pmc:PMC3190904|pubmed:21525001|pubmed:22753103|pubmed:24078381|pubmed:24283474|pubmed:25056782|pubmed:25071917|pubmed:25184212|pubmed:25451823|pubmed:25833640|pubmed:25966413|pubmed:26066782|pubmed:26551751|pubmed:26914170|pubmed:27460290|pubmed:27534448 Graph carbon black nanoparticles carbon black nanoparticles http://purl.obolibrary.org/obo/CHEBI_133602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133608 biolink:ChemicalEntity 1-methylhistidine zwitterion An α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of 1-methylhistidine; major species at pH 7.3. Graph 2-azaniumyl-3-(1-methyl-1H-imidazol-4-yl)propanoate 2-azaniumyl-3-(1-methyl-1H-imidazol-4-yl)propanoate 2-azaniumyl-3-(1-methyl-1H-imidazol-4-yl)propanoate http://purl.obolibrary.org/obo/CHEBI_133608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133609 biolink:ChemicalEntity 3-methylhistidine zwitterion An α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of 3-methylhistidine; major species at pH 7.3. Graph 2-azaniumyl-3-(1-methyl-1H-imidazol-5-yl)propanoate 2-azaniumyl-3-(1-methyl-1H-imidazol-5-yl)propanoate 2-azaniumyl-3-(1-methyl-1H-imidazol-5-yl)propanoate http://purl.obolibrary.org/obo/CHEBI_133609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133610 biolink:ChemicalEntity N-isobutyrylglycinate A monocarboxylic acid anion that is the conjugate base of N-isobutyrylglycine, obtained by deprotonation of the carboxy group; major species at pH 7.3. hmdb:HMDB0000730 Graph (2-methylpropanamido)acetate|N-(2-methylpropanoyl)glycinate|N-isobutanoylglycinate|isobutanoylglycinate|isobutyrylglycinate (2-methylpropanamido)acetate (2-methylpropanamido)acetate|N-(2-methylpropanoyl)glycinate|N-isobutanoylglycinate|isobutanoylglycinate|isobutyrylglycinate http://purl.obolibrary.org/obo/CHEBI_133610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133648 biolink:ChemicalEntity S-allylcysteine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of S-allylcysteine. Major species at pH 7.3. Graph (2R)-2-azaniumyl-3-[(prop-2-en-1-yl)sulfanyl]propanoate|Cys(All) zwitterion|L-deoxyalliin zwitterion|S-2-propenyl-L-cysteine|S-allyl-L-cysteine zwitterion (2R)-2-azaniumyl-3-[(prop-2-en-1-yl)sulfanyl]propanoate (2R)-2-azaniumyl-3-[(prop-2-en-1-yl)sulfanyl]propanoate|Cys(All) zwitterion|L-deoxyalliin zwitterion|S-2-propenyl-L-cysteine|S-allyl-L-cysteine zwitterion http://purl.obolibrary.org/obo/CHEBI_133648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133649 biolink:ChemicalEntity 1-(1Z-hexadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alkenyl and acyl groups are specified as (1Z)-hexadecenyl and linoleoyl respectively. Graph 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE|1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)|1-(1Z-hexadecenyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine zwitterion|1-[(1Z)-hexadecenyl]-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine zwitterion|2-azaniumylethyl (2R)-3-{[(1Z)-hexadec-1-en-1-yl]oxy}-2-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}propyl phosphate|GPE(P-16:0/18:2) 2-azaniumylethyl (2R)-3-{[(1Z)-hexadec-1-en-1-yl]oxy}-2-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}propyl phosphate 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE|1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)|1-(1Z-hexadecenyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine zwitterion|1-[(1Z)-hexadecenyl]-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine zwitterion|2-azaniumylethyl (2R)-3-{[(1Z)-hexadec-1-en-1-yl]oxy}-2-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}propyl phosphate|GPE(P-16:0/18:2) http://purl.obolibrary.org/obo/CHEBI_133649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133653 biolink:ChemicalEntity hydroperoxy(hydroxy)icosapentaenoate An icosanoid anion that is any icosapentaenoate bearing hydroxy and hydroperoxy substituents. An oxidation product of icosapentaenoic acid metabolism. Graph hydroperoxy(hydroxy)eicosapentaenoate hydroperoxy(hydroxy)eicosapentaenoate http://purl.obolibrary.org/obo/CHEBI_133653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133654 biolink:ChemicalEntity hydroxydocosapentaenoate A docosanoid anion that is any docosapentaenoate carrying a hydroxy substituent on its carbon chain. Graph http://purl.obolibrary.org/obo/CHEBI_133654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133667 biolink:ChemicalEntity glycitein 4'-O-glucuronide A glycosyloxyisoflavone that is the glucuronide-conjugated form of the phytoestrogen glycitein. hmdb:HMDB0041740 Graph 4-(7-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid|glycitein 4'-O-beta-D-glucuronide|glycitein 4'-O-beta-glucuronide 4-(7-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid 4-(7-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid|glycitein 4'-O-beta-D-glucuronide|glycitein 4'-O-beta-glucuronide http://purl.obolibrary.org/obo/CHEBI_133667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133673 biolink:ChemicalEntity glyphosate(1-) An organophosphate oxoanion obtained by the deprotonation of the carboxy and one of the phosphate OH groups as well as protonation of the amino group of glyphosate. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Graph glyphosate glyphosate http://purl.obolibrary.org/obo/CHEBI_133673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133677 biolink:ChemicalEntity hexadecanoylcholine An acylcholine obtained by formal condensation of the carboxy group of hexadecanoic acid with the hydroxy group of choline. cas:13100-90-8|reaxys:1801641 Graph 2-(hexadecanoyloxy)-N,N,N-trimethylethan-1-aminium|O-hexadecanoylcholine|O-palmitoylcholine|choline hexadecanoate|choline palmitate|palmitoylcholine 2-(hexadecanoyloxy)-N,N,N-trimethylethan-1-aminium 2-(hexadecanoyloxy)-N,N,N-trimethylethan-1-aminium|O-hexadecanoylcholine|O-palmitoylcholine|choline hexadecanoate|choline palmitate|palmitoylcholine http://purl.obolibrary.org/obo/CHEBI_133677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133686 biolink:ChemicalEntity 5-bromotryptophan A non-proteinogenic α-amino acid that is tryptophan in which the hydrogen at position 5 on the indole ring is replaced by a bromo group. cas:6548-09-0|reaxys:5280904 Graph 2-amino-3-(5-bromo-1H-indol-3-yl)propanoic acid|5-bromotryptophan 5-bromotryptophan 2-amino-3-(5-bromo-1H-indol-3-yl)propanoic acid|5-bromotryptophan http://purl.obolibrary.org/obo/CHEBI_133686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133688 biolink:ChemicalEntity 5-bromotryptophan zwitterion An α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of 5-bromotryptophan; major species at pH 7.3. Graph 2-azaniumyl-3-(5-bromo-1H-indol-3-yl)propanoate 2-azaniumyl-3-(5-bromo-1H-indol-3-yl)propanoate 2-azaniumyl-3-(5-bromo-1H-indol-3-yl)propanoate http://purl.obolibrary.org/obo/CHEBI_133688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133719 biolink:ChemicalEntity hydroxyoctanoate A hydroxy fatty acid anion that is octanoate (caprylate) substituted by a hydroxy group at any position. Graph hydroxycaprylate|hydroxycaprylates|hydroxyoctanoates hydroxycaprylate|hydroxycaprylates|hydroxyoctanoates http://purl.obolibrary.org/obo/CHEBI_133719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133720 biolink:ChemicalEntity glycochenodeoxycholic acid sulfate anion An organic anion obtained by deprotonation of at least one of the acidic functions of glycochenodeoxycholic acid sulfate. Graph glycochenodeoxycholic acid sulfate anions glycochenodeoxycholic acid sulfate anions http://purl.obolibrary.org/obo/CHEBI_133720 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133721 biolink:ChemicalEntity rhamnacene A dimethoxyflavone that is quercetin in which the hydroxy groups at the 3' and 7 positions have been replaced by methoxy groups. cas:552-54-5|pubmed:11594002|pubmed:25704088|pubmed:27025066|pubmed:35723317|reaxys:338203|wikipedia.en:Rhamnazin Graph 3',7-dimethylquercetin|3,5,4'-trihydroxy-7,3'-dimethoxyflavone|3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one|rhamnazin 3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one 3',7-dimethylquercetin|3,5,4'-trihydroxy-7,3'-dimethoxyflavone|3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-chromen-4-one|rhamnazin http://purl.obolibrary.org/obo/CHEBI_133721 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133737 biolink:ChemicalEntity acetyltaurine(1-) An organosulfonate oxoanion obtained by deprotonation of the sulfonic acid group of acetyltaurine. reaxys:3664502 Graph 2-(acetylamino)ethanesulfonate|2-acetamidoethane-1-sulfonate|2-acetamidoethanesulfonate|N-acetyltaurinate|N-acetyltaurine|N-acetyltaurine(1-)|acetyltaurinate 2-acetamidoethane-1-sulfonate 2-(acetylamino)ethanesulfonate|2-acetamidoethane-1-sulfonate|2-acetamidoethanesulfonate|N-acetyltaurinate|N-acetyltaurine|N-acetyltaurine(1-)|acetyltaurinate http://purl.obolibrary.org/obo/CHEBI_133737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133741 biolink:ChemicalEntity (E)-dodec-2-enal A trans-2,3-unsaturated fatty aldehyde that is (E)-dodec-2-ene in which the allylic methyl group has been oxidised to the corresponding aldehyde. agr:IND44119408|agr:IND500604868|agr:IND600802502|cas:20407-84-5|hmdb:HMDB0031020|patent:EP0282940|pubmed:14194100|pubmed:15012807|pubmed:15161192|pubmed:15612802|pubmed:21062639|pubmed:24139239|pubmed:24243612|pubmed:25619643|pubmed:25870012|pubmed:26667677|pubmed:6483572 Graph (2E)-dodec-2-enal|(2E)-dodecenal|(E)-2-dodecen-1-al|(E)-dodec-2-en-1-al|eryngial|trans-2-dodecenal|trans-dodec-2-enal (2E)-dodec-2-enal (2E)-dodec-2-enal|(2E)-dodecenal|(E)-2-dodecen-1-al|(E)-dodec-2-en-1-al|eryngial|trans-2-dodecenal|trans-dodec-2-enal http://purl.obolibrary.org/obo/CHEBI_133741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133744 biolink:ChemicalEntity homovanillate A hydroxy monocarboxylic acid anion which is obtained by deprotonation of the carboxy group of homovanillic acid. Graph (4-hydroxy-3-methoxyphenyl)acetate|3-methoxy-4-hydroxyphenylacetate (4-hydroxy-3-methoxyphenyl)acetate (4-hydroxy-3-methoxyphenyl)acetate|3-methoxy-4-hydroxyphenylacetate http://purl.obolibrary.org/obo/CHEBI_133744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133748 biolink:ChemicalEntity citrate anion A tricarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of citric acid. Graph citrate|citrate anions citrate|citrate anions http://purl.obolibrary.org/obo/CHEBI_133748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133750 biolink:ChemicalEntity Cutin-1 A phosphonium ylide that is 2-(triphenylphosphoranylidene)acetamide in which the nitrogen has been converted to the corresponding carbamoyl derivative. By targeting the β-subunit of fatty acid synthase, it inhibits nuclear envelope expansion and nuclear elongation during the closed mitosis of fission yeast. cas:53296-08-5|pubmed:26869222|reaxys:2765280 Graph 2-(triphenyl-lambda(5)-phosphanylidene)acetamide|N-carbamoyl-2-(triphenylphosphoranylidene)acetamide|triphenylphosphonium(carbamoylcarbamoyl)methylylid|ureidocarbomethylentriphenylphosphoniumylid 2-(triphenyl-lambda(5)-phosphanylidene)acetamide|N-carbamoyl-2-(triphenylphosphoranylidene)acetamide 2-(triphenyl-lambda(5)-phosphanylidene)acetamide|N-carbamoyl-2-(triphenylphosphoranylidene)acetamide|triphenylphosphonium(carbamoylcarbamoyl)methylylid|ureidocarbomethylentriphenylphosphoniumylid http://purl.obolibrary.org/obo/CHEBI_133750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133752 biolink:ChemicalEntity epsilon-(gamma-glutamyl)lysine dizwitterion An L-α-amino acid zwitterion that is the dizwitterionic form of ε-(γ-glutamyl)lysine obtained by migration of protons from both carboxy groups to the amino groups; major species at pH 7.3. Graph (2S)-2-azaniumyl-6-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}hexanoate|L-gamma-glutamyl-L-epsilon-lysine dizwitterion|epsilon-(L-gamma-glutamyl)-L-lysine dizwitterion|epsilon-(gamma-L-glutamyl)-L-lysine|gamma-Glu-epsilon-Lys dizwitterion|gamma-glutamyl-epsilon-lysine dizwitterion (2S)-2-azaniumyl-6-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}hexanoate (2S)-2-azaniumyl-6-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}hexanoate|L-gamma-glutamyl-L-epsilon-lysine dizwitterion|epsilon-(L-gamma-glutamyl)-L-lysine dizwitterion|epsilon-(gamma-L-glutamyl)-L-lysine|gamma-Glu-epsilon-Lys dizwitterion|gamma-glutamyl-epsilon-lysine dizwitterion http://purl.obolibrary.org/obo/CHEBI_133752 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133773 biolink:ChemicalEntity pimelate A tricarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of pimelic acid. Graph heptanedioic acid anion|heptanedioic acid anions|pimelates|pimelic acid anion|pimelic acid anions heptanedioic acid anion|heptanedioic acid anions|pimelates|pimelic acid anion|pimelic acid anions http://purl.obolibrary.org/obo/CHEBI_133773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133775 biolink:ChemicalEntity dimethylargininium(1+) An α-amino-acid cation obtained by protonation of any dimethylarginine. Graph dimethylarginine cation|dimethylarginine(1+) dimethylarginine cation|dimethylarginine(1+) http://purl.obolibrary.org/obo/CHEBI_133775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133790 biolink:ChemicalEntity linolenate A polyunsaturated fatty acid anion obtained by deprotonation of the carboxy group of either α- or γ-linolenic acid. Graph linolenates linolenates http://purl.obolibrary.org/obo/CHEBI_133790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133792 biolink:ChemicalEntity erythronate A hydroxy monocarboxylic acid anion obtained by deprotonation of the carboxy group of any erythronic acid; major species at pH 7.3. Graph erythronate anion|erythronate anions|erythronates erythronate anion|erythronate anions|erythronates http://purl.obolibrary.org/obo/CHEBI_133792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133795 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosahexaenoate A hydroperoxydocosahexaenoate that is the conjugate base of (17S)-HPDoHE, obtained by deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD66-80|pubmed:19324874 Graph (17S)-HPDHA(1-)|(17S)-HPDoHE(1-)|(17S)-hydroperoxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoate|(4Z,7Z,10Z,13Z,15E,17S,19Z)-hydroperoxydocosahexaenoate (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoate (17S)-HPDHA(1-)|(17S)-HPDoHE(1-)|(17S)-hydroperoxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoate|(4Z,7Z,10Z,13Z,15E,17S,19Z)-hydroperoxydocosahexaenoate http://purl.obolibrary.org/obo/CHEBI_133795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133797 biolink:ChemicalEntity (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoate A hydroperoxydocosapentaenoate that is the conjugate base of 17-HPDoPE, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:19324874 Graph (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate|(7Z,10Z,13Z,15E,19Z)-hydroperoxydocosahexaenoate|17-HPDPA(n-3)(1-)|17-HPDoPE(n-3)(1-)|17-hydroperoxy-(7Z,10Z,13Z,15E,19Z)-docosapentaenoate (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate|(7Z,10Z,13Z,15E,19Z)-hydroperoxydocosahexaenoate|17-HPDPA(n-3)(1-)|17-HPDoPE(n-3)(1-)|17-hydroperoxy-(7Z,10Z,13Z,15E,19Z)-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_133797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133798 biolink:ChemicalEntity (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoate A hydroperoxydocosapentaenoate that is the conjugate base of (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:19324874 Graph (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate|14-HPDPA(n-3)(1-)|14-HPDoPE(1-)|14-HPDoPE(n-3)(1-)|14-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate|14-HPDPA(n-3)(1-)|14-HPDoPE(1-)|14-HPDoPE(n-3)(1-)|14-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_133798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133809 biolink:ChemicalEntity anisindione A cyclic β-diketone consisting of indane-1,3-dione having a 4-methoxyphenyl substituent at the 4-position. beilstein:1880681|cas:117-37-3|drugbank:DB01125|drugcentral:222|kegg.drug:D07457|patent:US2899358|wikipedia.en:Anisindione Graph 2-(4-Methoxyphenyl)-1H-indene-1,3(2H)-dione|2-(4-Methoxyphenyl)indan-1,3-dione|2-(4-methoxyphenyl)-1H-indene-1,3(2H)-dione|2-(p-Methoxyphenyl)-1,3-indandione|2-(p-Methoxyphenyl)indane-1,3-dione|2-p-Anisyl-1,3-indandione|2-para-Anisyl-1,3-indandione|Anisin indandione|anisindiona|anisindione|anisindionum 2-(4-methoxyphenyl)-1H-indene-1,3(2H)-dione 2-(4-Methoxyphenyl)-1H-indene-1,3(2H)-dione|2-(4-Methoxyphenyl)indan-1,3-dione|2-(4-methoxyphenyl)-1H-indene-1,3(2H)-dione|2-(p-Methoxyphenyl)-1,3-indandione|2-(p-Methoxyphenyl)indane-1,3-dione|2-p-Anisyl-1,3-indandione|2-para-Anisyl-1,3-indandione|Anisin indandione|anisindiona|anisindione|anisindionum http://purl.obolibrary.org/obo/CHEBI_133809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133817 biolink:ChemicalEntity doxorubicinol A member of the class of tetracenequinones that is the major metabolite of the anthracycline doxorubicin, a chemotherapeutic agent effective against a broad range of malignant neoplasms. It is thought to exhibit cardiotoxic properties. cas:54193-28-1|hmdb:HMDB0041884|pubmed:10408701|pubmed:11448472|pubmed:12647011|pubmed:16168722|pubmed:1628370|pubmed:16614166|pubmed:16915573|pubmed:16958789|pubmed:17197005|pubmed:17379584|pubmed:18371724|pubmed:18967867|pubmed:19174209|pubmed:23192654|pubmed:23337906|pubmed:24631816|pubmed:25446851|pubmed:27447545|pubmed:2897122|pubmed:8298821|pubmed:8595168|pubmed:9261889|pubmed:9696578|pubmed:9888978|reaxys:6773847 Graph (1S,3S)-3-[(1S)-1,2-dihydroxyethyl]-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|13-dihydrodoxorubicin|Antibiotic 27706RP|DOXOL|adriamycinol (1S,3S)-3-[(1S)-1,2-dihydroxyethyl]-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside (1S,3S)-3-[(1S)-1,2-dihydroxyethyl]-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|13-dihydrodoxorubicin|Antibiotic 27706RP|DOXOL|adriamycinol http://purl.obolibrary.org/obo/CHEBI_133817 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133819 biolink:ChemicalEntity 13-HODE(1-) A HODE(1−) that is the conjugate base of 13-HODE, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (9Z,11E)-13-hydroxyoctadeca-9,11-dienoate|(9Z,11E)-13-hydroxyoctadecadienoate|13-hydroxy-(9Z,11E)-octadecadienoate (9Z,11E)-13-hydroxyoctadeca-9,11-dienoate (9Z,11E)-13-hydroxyoctadeca-9,11-dienoate|(9Z,11E)-13-hydroxyoctadecadienoate|13-hydroxy-(9Z,11E)-octadecadienoate http://purl.obolibrary.org/obo/CHEBI_133819 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133820 biolink:ChemicalEntity 9-HODE(1-) A HODE(1−) that is the conjugate base of 9-HODE, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (10E,12Z)-9-hydroxyoctadeca-10,12-dienoate|(10E,12Z)-9-hydroxyoctadecadienoate|9-hydroxy-(10E,12Z)-octadecadienoate (10E,12Z)-9-hydroxyoctadeca-10,12-dienoate (10E,12Z)-9-hydroxyoctadeca-10,12-dienoate|(10E,12Z)-9-hydroxyoctadecadienoate|9-hydroxy-(10E,12Z)-octadecadienoate http://purl.obolibrary.org/obo/CHEBI_133820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133833 biolink:ChemicalEntity benznidazole A monocarboxylic acid amide obtained by formal condensation of the carboxy group of (2-nitroimidazol-1-yl)acetic acid with the aromatic amino group of benzylamine. Used for treatment of Chagas disease. cas:22994-85-0|drugcentral:322|kegg.drug:D02489|pubmed:26760092|pubmed:26760093|pubmed:26760094|pubmed:26760095|pubmed:26974551|pubmed:26982179|pubmed:27001816|pubmed:27067322|pubmed:27158908|pubmed:27161638|pubmed:27223650|pubmed:27246447|pubmed:27376278|pubmed:27487264|pubmed:27488437|pubmed:27550362|pubmed:27619190|pubmed:27688600|reaxys:551486|wikipedia.en:Benznidazole Graph 2-Nitro-N-(phenylmethyl)-1H-imidazole-1-acetamide|N-Benzyl-2-nitroimidazol-1-yl-acetamide|N-Benzyl-2-nitroimidazole-1-acetamide|N-benzyl-2-(2-nitro-1H-imidazol-1-yl)acetamide|benznidazol|benznidazole|benznidazolum N-benzyl-2-(2-nitro-1H-imidazol-1-yl)acetamide 2-Nitro-N-(phenylmethyl)-1H-imidazole-1-acetamide|N-Benzyl-2-nitroimidazol-1-yl-acetamide|N-Benzyl-2-nitroimidazole-1-acetamide|N-benzyl-2-(2-nitro-1H-imidazol-1-yl)acetamide|benznidazol|benznidazole|benznidazolum http://purl.obolibrary.org/obo/CHEBI_133833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133867 biolink:ChemicalEntity 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(4-) An organophosphate oxoanion obtained by deprotonation of the phosphate and diphosphate functions of 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl undecaprenyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-19301|pubmed:21035733|pubmed:24024634 Graph 4-O-(di(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 4-O-(di(2R)-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_133867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133872 biolink:ChemicalEntity (2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid An oxodicarboxylic acid that is a tautomer of 4-maleylacetoacetic acid in which the carbonyl of the α,β-unsaturated ketone moiety has tautomerised to the corresponding enol (the 2Z,4E isomer). Graph (2Z,4E)-4-hydroxy-6-oxo-2,4-octadienedioic acid|(2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid (2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid (2Z,4E)-4-hydroxy-6-oxo-2,4-octadienedioic acid|(2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid http://purl.obolibrary.org/obo/CHEBI_133872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133886 biolink:ChemicalEntity FMNH2(3-) A organophosphate oxoanion obtained by deprotonation of the phosphate OH groups as well as position N1 of FMNH2. Graph 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-1-id-10(5H)-yl)-5-O-phosphonato-D-ribitol 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-1-id-10(5H)-yl)-5-O-phosphonato-D-ribitol 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydro-2H-benzo[g]pteridin-1-id-10(5H)-yl)-5-O-phosphonato-D-ribitol http://purl.obolibrary.org/obo/CHEBI_133886 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13389 biolink:ChemicalEntity NAD Abbreviation for nicotinamide-adenine dinucleotide when its oxidation state is unknown or unspecified. It is used in metabolic pathways like glycolysis and citric acid cycle. hmdb:HMDB0000902|wikipedia.en:Nicotinamide_adenine_dinucleotide Graph nicotinamide-adenine dinucleotide nicotinamide-adenine dinucleotide http://purl.obolibrary.org/obo/CHEBI_13389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133894 biolink:ChemicalEntity 4-O-[poly(1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion An organophosphate oxoanion obtained by global deprotonation of the phosphate and diphosphate functions of 4-O-[poly(1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate. metacyc.compound:CPD-19308|pubmed:21035733 Graph 4-O-[poly(D-ribitylphospho)-D-ribitylphospho-(2R)-glycerylphospho]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 4-O-[poly(D-ribitylphospho)-D-ribitylphospho-(2R)-glycerylphospho]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_133894 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133896 biolink:ChemicalEntity 4-O-({poly[1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion An organophosphate oxoanion obtained by global deprotonation of the phosphate and diphosphate functions of 4-O-({poly[1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate metacyc.compound:CPD-19303|pubmed:18215769|pubmed:18556787|pubmed:21035733 Graph 4-O-({poly[1-D-ribitylphospho]}-di{[2R]-glycerylphospho})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 4-O-({poly[1-D-ribitylphospho]}-di{[2R]-glycerylphospho})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_133896 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13390 biolink:ChemicalEntity NAD(P)(+) A coenzyme that may be NAD+ or NADP+. Graph http://purl.obolibrary.org/obo/CHEBI_13390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133901 biolink:ChemicalEntity 3-aminobutyryl-CoA(3-) An acyl-CoA oxoanion arising from deprotonation of phosphate and diphosphate functions as well as protonation of the amino group of 3-aminobutyryl-CoA; major species at pH 7.3. Graph 3-aminobutanoyl-CoA|3-aminobutanoyl-coenzyme A(3-)|3-aminobutyryl-coenzyme A(3-) 3-aminobutanoyl-CoA|3-aminobutanoyl-coenzyme A(3-)|3-aminobutyryl-coenzyme A(3-) http://purl.obolibrary.org/obo/CHEBI_133901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133907 biolink:ChemicalEntity hypothiocyanous acid A sulfur oxoacid that is sulfenic acid in which the hydrogen attached to the sulfur has been replaced by a cyano group. cas:63296-34-4|chemspider:111270|hmdb:HMDB0012974|pubmed:19705807|pubmed:19821602|pubmed:22031955|pubmed:22053976|pubmed:23088652|pubmed:23540488|pubmed:24112082|pubmed:24120969|pubmed:24632382|pubmed:24657078|pubmed:24928513|pubmed:25172223|pubmed:25393952|pubmed:25795019|pubmed:26453918|pubmed:26608498|pubmed:26616646|pubmed:26898502|pubmed:27013775|pubmed:27343172|pubmed:27350402|pubmed:27629563|pubmed:27864363|reaxys:2958668 Graph (hydroxysulfanyl)formonitrile|Hypothiocyanite|cyanosulfoxylic acid|hypocyanous acid|hypothiocyanous acid|nitrilomethane-SO-thioperoxol nitrilomethane-SO-thioperoxol (hydroxysulfanyl)formonitrile|Hypothiocyanite|cyanosulfoxylic acid|hypocyanous acid|hypothiocyanous acid|nitrilomethane-SO-thioperoxol http://purl.obolibrary.org/obo/CHEBI_133907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133911 biolink:ChemicalEntity alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→3)-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5161 Graph alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_133911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133912 biolink:ChemicalEntity alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5162 Graph alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_133912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133917 biolink:ChemicalEntity ochratoxin alpha A member of the class of isocoumarins that is 1-oxo-3,4-dihydro-2-benzopyran-7-carboxylic acid carrying additional methyl, chloro and hydroxy substituents at positions 3, 5 and 8 respectively. A non-toxic metabolite of the mycotoxin ochratoxin A. cas:19165-63-0|pubmed:10398513|pubmed:10441032|pubmed:20031488|pubmed:21443919|pubmed:23041474|pubmed:26861395|pubmed:27597255|pubmed:27924714|pubmed:27959549|pubmed:28119679|pubmed:6341224|reaxys:6125765 Graph (-)-ochratoxin alpha|(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid|(R)-(-)-ochratoxin alpha|(R)-ochratoxin alpha|Ochratoxin alpha|alpha-Ochratoxin|alpha-ochratoxin (3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid (-)-ochratoxin alpha|(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid|(R)-(-)-ochratoxin alpha|(R)-ochratoxin alpha|Ochratoxin alpha|alpha-Ochratoxin|alpha-ochratoxin http://purl.obolibrary.org/obo/CHEBI_133917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13392 biolink:ChemicalEntity NAD(P)H A coenzyme that may be NADH or NADPH. Graph http://purl.obolibrary.org/obo/CHEBI_13392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133930 biolink:ChemicalEntity 5alpha-androst-1-ene-3,17-dione A 3-oxo Δ1-steroid that is androst-1-ene substituted by oxo groups at positions 3 and 17. cas:571-40-4|pubmed:17123559|pubmed:21310167|pubmed:22350385|pubmed:23090723|pubmed:25797375|reaxys:3085323 Graph 1-Androstenedione|5alpha-androst-1-ene-3,17-dione|Delta(1)-androstene-3,17-dione|delta1-5alpha-Androstene-3,17-dione 5alpha-androst-1-ene-3,17-dione 1-Androstenedione|5alpha-androst-1-ene-3,17-dione|Delta(1)-androstene-3,17-dione|delta1-5alpha-Androstene-3,17-dione http://purl.obolibrary.org/obo/CHEBI_133930 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133932 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoate A docosanoid anion that is the conjugate base of (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:16112640 Graph (4Z,7Z,10Z,13Z)-15-{3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,13-tetraenoate|16,17-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosapentaenoate (4Z,7Z,10Z,13Z)-15-{3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,13-tetraenoate (4Z,7Z,10Z,13Z)-15-{3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,13-tetraenoate|16,17-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_133932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133940 biolink:ChemicalEntity lithocholate sulfate(2-) A steroid sulfate oxoanion obtained by deprotonation of the carboxylic acid and sulfate functions of lithocholic acid sulfate; major species at pH 7.3. pubmed:17425406 Graph (3alpha,5beta)-3-(sulfonatooxy)cholan-24-oate|3alpha-(sulfonatooxy)-5beta-cholan-24-oate|lithocholate 3-sulfate|lithocholate 3-sulfate(2-)|sulfolithocholate(2-) 3alpha-(sulfonatooxy)-5beta-cholan-24-oate (3alpha,5beta)-3-(sulfonatooxy)cholan-24-oate|3alpha-(sulfonatooxy)-5beta-cholan-24-oate|lithocholate 3-sulfate|lithocholate 3-sulfate(2-)|sulfolithocholate(2-) http://purl.obolibrary.org/obo/CHEBI_133940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133959 biolink:ChemicalEntity 4'-methoxyisoflavones Any methoxyisoflavone which has a methoxy group at the 4-position of the phenyl substituent. Graph a 4'-methoxyisoflavone a 4'-methoxyisoflavone http://purl.obolibrary.org/obo/CHEBI_133959 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133967 biolink:ChemicalEntity aflatoxin B1 dialdehyde(1-) A phenolate anion that is the conjugate base of aflatoxin B1 dialdehyde, obtained by deprotonation of the 7-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0). Graph 6-(3-hydroxy-1,4-dioxobutan-2-yl)-9-methoxy-3,4-dioxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate|AFB1 dialdehyde(1-)|aflatoxin B(1) dialdehyde|aflatoxin B1 dialdehyde anion 6-(3-hydroxy-1,4-dioxobutan-2-yl)-9-methoxy-3,4-dioxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate 6-(3-hydroxy-1,4-dioxobutan-2-yl)-9-methoxy-3,4-dioxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate|AFB1 dialdehyde(1-)|aflatoxin B(1) dialdehyde|aflatoxin B1 dialdehyde anion http://purl.obolibrary.org/obo/CHEBI_133967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133969 biolink:ChemicalEntity 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)(2-) residue A 7-methyl guanosine (m7G) linked via an inverted 5'-5' triphosphate bridge to an initiating 2'-O-methyl-purine-ribonucleotide Graph a 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleoside) residue a 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleoside) residue http://purl.obolibrary.org/obo/CHEBI_133969 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133970 biolink:ChemicalEntity N-retinylidene-N-retinylphosphatidylethanolamine betaine An iminium betaine obtained by deprotonation of the phosphate group of any N-retinylidene-N-retinylphosphatidylethanolamine. Graph N-retinylidene-N-retinylphosphatidylethanolamine N-retinylidene-N-retinylphosphatidylethanolamine http://purl.obolibrary.org/obo/CHEBI_133970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133972 biolink:ChemicalEntity primary nitroalkane A nitroalkane in which the nitro group is attached to a terminal carbon. Major microspecies at pH 7.3. pubmed:1710166|pubmed:26506056|pubmed:7762004 Graph a primary nitroalkane a primary nitroalkane http://purl.obolibrary.org/obo/CHEBI_133972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133975 biolink:ChemicalEntity Delta(6)-trans-12-epi-leukotriene B4(1-) A leukotriene anion that is the conjugate base of Δ6-trans-12-epi-leukotriene B4, obtained by deprotonation of the carboxylic acid function; major species at pH 7.3. pubmed:8394361 Graph (5S,12S)-dihydroxy-(6E,10E,12E,14Z)-eicosatetraenoate|(5S,12S)-dihydroxy-(6E,10E,12E,14Z)-icosapentaenoate|(5S,6E,10E,12E,12S,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate|(5S,6E,10E,12E,12S,14Z)-5,12-dihydroxyicosatetraenoate|12-epi-6-trans-LTB4(1-)|12-epi-6-trans-leukotriene B4(1-) (5S,6E,10E,12E,12S,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate (5S,12S)-dihydroxy-(6E,10E,12E,14Z)-eicosatetraenoate|(5S,12S)-dihydroxy-(6E,10E,12E,14Z)-icosapentaenoate|(5S,6E,10E,12E,12S,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate|(5S,6E,10E,12E,12S,14Z)-5,12-dihydroxyicosatetraenoate|12-epi-6-trans-LTB4(1-)|12-epi-6-trans-leukotriene B4(1-) http://purl.obolibrary.org/obo/CHEBI_133975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133977 biolink:ChemicalEntity S-(2,4-dinitrophenyl)glutathione(1-) An S-substituted glutathione(1−) obtained by deprotonation of the the two carboxy groups and protonation of the glutamyl amino group of S-(2,4-dinitrophenyl)glutathione. Major microspecies at pH 7.3. metacyc.compound:S-24-DINITROPHENYLGLUTATHIONE Graph (2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(2,4-dinitrophenyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate|2,4-dinitrophenyl-S-glutathione|DNP-SG|S-(2,4-dinitrophenyl)glutathionate (2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(2,4-dinitrophenyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate (2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(2,4-dinitrophenyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate|2,4-dinitrophenyl-S-glutathione|DNP-SG|S-(2,4-dinitrophenyl)glutathionate http://purl.obolibrary.org/obo/CHEBI_133977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133980 biolink:ChemicalEntity oxidised coenzyme F420-(gamma-Glu)n polyanion A polyanionic polymer derived from oxidised coenzyme F420-(γ-Glu)n. Major microspecies at pH 7.3 Graph coenzyme F420-(gamma-Glu)(n)|oxidized coenzyme F420-(gamma-Glu)n polyanion coenzyme F420-(gamma-Glu)(n)|oxidized coenzyme F420-(gamma-Glu)n polyanion http://purl.obolibrary.org/obo/CHEBI_133980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133985 biolink:ChemicalEntity 13(R)-HPODE(1-) A 13-HPODE(1−) that is the conjugate base of 13(R)-HPODE, obtained by deprotonation of the carboxylic acid function. Major microspecies at pH 7.3. Graph (13R)-hydroperoxy-(9Z,11E)-octadecadienoate|(9Z,11E,13R)-13-hydroperoxyoctadeca-9,11-dienoate|(9Z,11E,13R)-13-hydroperoxyoctadecadienoate (9Z,11E,13R)-13-hydroperoxyoctadeca-9,11-dienoate (13R)-hydroperoxy-(9Z,11E)-octadecadienoate|(9Z,11E,13R)-13-hydroperoxyoctadeca-9,11-dienoate|(9Z,11E,13R)-13-hydroperoxyoctadecadienoate http://purl.obolibrary.org/obo/CHEBI_133985 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133986 biolink:ChemicalEntity (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid A hydroperoxyoctadecatrienoic acid, obtained by the formal substitution of a hydrogen at position 13 of (9Z,11E,15Z)-octadeca-9,11,15-trienoic acid by a hydroperoxy group (the 13R-stereoisomer). pubmed:21167311|reaxys:6864314 Graph (13R)-HPOTrE|(13R)-hydroperoxy-(9Z,11E,15Z)-octadecatrienoic acid|(9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid|13(R)-HPOTrE (9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid (13R)-HPOTrE|(13R)-hydroperoxy-(9Z,11E,15Z)-octadecatrienoic acid|(9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid|13(R)-HPOTrE http://purl.obolibrary.org/obo/CHEBI_133986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133987 biolink:ChemicalEntity (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate A hydroperoxyoctadecatrienoate that is the conjugate base of (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid, obtained by deprotonation of the carboxy group. Major microspecies at pH 7.3. Graph (13R)-HPOTrE(1-)|(13R)-hydroperoxy-(9Z,11E,15Z)-octadeca-9,11,15-trienoate|(13R)-hydroperoxy-(9Z,11E,15Z)-octadecatrienoate|(9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate|13(R)-HPOTrE(1-) (9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate (13R)-HPOTrE(1-)|(13R)-hydroperoxy-(9Z,11E,15Z)-octadeca-9,11,15-trienoate|(13R)-hydroperoxy-(9Z,11E,15Z)-octadecatrienoate|(9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate|13(R)-HPOTrE(1-) http://purl.obolibrary.org/obo/CHEBI_133987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133994 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5164 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_133994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133998 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→3)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5165 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_133998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:133999 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5166 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_133999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134000 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5167 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->6)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_134000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134002 biolink:ChemicalEntity alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5168 Graph alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_134002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134003 biolink:ChemicalEntity alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5169 Graph alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_134003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134004 biolink:ChemicalEntity alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Glc-(1→3)-α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-5170 Graph alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc-diphosphodolichol|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_134004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134005 biolink:ChemicalEntity alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) An α-D-Glc-(1→2)-α-D-Glc-(1→3)-α-D-Glc-(1→3)-α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc(PP-Dol) in which the anomeric centre has α-configuration. metacyc.compound:CPD-18076 Graph alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)-diphosphodolichol|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranosyl dolichyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_134005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134018 biolink:ChemicalEntity N-acyl-gamma-aminobutyric acid A carboxamide resulting from the formal condensation of a carboxylic acid with the amino group of γ-aminobutyric acid. Graph N-acyl-4-aminobutanoic acid|N-acyl-4-aminobutyric acid|N-acyl-GABA N-acyl-4-aminobutanoic acid N-acyl-4-aminobutanoic acid|N-acyl-4-aminobutyric acid|N-acyl-GABA http://purl.obolibrary.org/obo/CHEBI_134018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134019 biolink:ChemicalEntity hydroperoxy polyunsaturated fatty acid anion Any polyunsaturated fatty acid anion carrying one or more hydroperoxy substituents. Graph a hydroperoxy polyunsaturated fatty acid|hydroperoxy polyunsaturated fatty acid anions|hydroperoxy-polyunsaturated fatty acid anion|hydroperoxy-polyunsaturated fatty acid anions a hydroperoxy polyunsaturated fatty acid|hydroperoxy polyunsaturated fatty acid anions|hydroperoxy-polyunsaturated fatty acid anion|hydroperoxy-polyunsaturated fatty acid anions http://purl.obolibrary.org/obo/CHEBI_134019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134020 biolink:ChemicalEntity N-oleoyl-L-phenylalaninate An N-acyl-L-α-amino acid anion resulting from the deprotonation of the carboxy group of N-oleoyl-L-phenylalanine. The major species at pH 7.3. pubmed:27374330 Graph (2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropanoate|(2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropionate|N-(9Z-octadecenoyl)-L-phenylalanine|N-oleoyl-L-phenylalaninate N-oleoyl-L-phenylalaninate (2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropanoate|(2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropionate|N-(9Z-octadecenoyl)-L-phenylalanine|N-oleoyl-L-phenylalaninate http://purl.obolibrary.org/obo/CHEBI_134020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134021 biolink:ChemicalEntity N-oleoyl-L-phenylalanine An N-acyl-L-phenylalanine resulting from the formal condensation of the carboxy group of oleic acid with the amino group of L-phenylalanine. lipidmaps:LMFA08020092|pubmed:27374330|reaxys:20745810 Graph (2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropanoic acid|(2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropionic acid|N-(9Z-octadecenoyl)-phenylalanine|N-[(9Z)-octadec-9-enoyl]-L-phenylalanine|N-oleoyl phenylalanine|oleoyl-L-Phe-OH N-[(9Z)-octadec-9-enoyl]-L-phenylalanine (2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropanoic acid|(2S)-2-[(9Z)-octadec-9-enoylamino]-3-phenylpropionic acid|N-(9Z-octadecenoyl)-phenylalanine|N-[(9Z)-octadec-9-enoyl]-L-phenylalanine|N-oleoyl phenylalanine|oleoyl-L-Phe-OH http://purl.obolibrary.org/obo/CHEBI_134021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134043 biolink:ChemicalEntity phenylureas Any member of the class of ureas in which at least one of the nitrogens of the urea moiety is substituted by a phenyl or substituted phenyl group. Graph http://purl.obolibrary.org/obo/CHEBI_134043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134045 biolink:ChemicalEntity polychlorinated dibenzodioxines and related compounds Organochlorine compounds that are polychlorinated dibenzodioxines and structurally related entities that are persistant organic pollutants. These include polychlorinated dibenzofurans as well as polychlorinated and polybrominated biphenyls They vary widely in their toxicity, but their toxic mode of action is through the aryl hydrocarbon receptor. wikipedia.en:Dioxins_and_dioxin-like_compounds Graph DLCs|PCDDs and related compounds|dioxins and dioxin-like compounds|polychlorinated dibenzodioxins and related compounds DLCs|PCDDs and related compounds|dioxins and dioxin-like compounds|polychlorinated dibenzodioxins and related compounds http://purl.obolibrary.org/obo/CHEBI_134045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134066 biolink:ChemicalEntity N(6)-(pyridoxal phosphate)-L-lysine An L-lysine derivative that is the aldimine obtained via formal condensation of the side-chain amino group of L-lysine with the carbonyl group of pyridoxal phosphate. cas:2440-59-7|pdb-ccd:LLP|reaxys:5457489 Graph (E)-N(6)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-lysine|(S)-2-amino-6-[(3-hydroxy-2-methyl-5-phosphonooxymethyl-4-pyridine)methyleneamino]hexanoic acid|N'-PYRIDOXYL-LYSINE-5'-MONOPHOSPHATE|N(6)-pyridoxal phosphate-L-lysine conjugate|N6-((3-Hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methylene)-L-lysine (E)-N(6)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-lysine (E)-N(6)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)-L-lysine|(S)-2-amino-6-[(3-hydroxy-2-methyl-5-phosphonooxymethyl-4-pyridine)methyleneamino]hexanoic acid|N'-PYRIDOXYL-LYSINE-5'-MONOPHOSPHATE|N(6)-pyridoxal phosphate-L-lysine conjugate|N6-((3-Hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methylene)-L-lysine http://purl.obolibrary.org/obo/CHEBI_134066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134068 biolink:ChemicalEntity (1->4)-6-phospho-alpha-D-glucan polyanion An organophosphate oxoanion obtained by global deprotonation of the phosphate OH groups of (1→4)-6-phospho-α-D-glucan; major species at pH 7.3. metacyc.compound:(1right4)-6-phospho-alpha-D-glucan Graph (1->4)-6-phospho-alpha-D-glucan (1->4)-6-phospho-alpha-D-glucan http://purl.obolibrary.org/obo/CHEBI_134068 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134084 biolink:ChemicalEntity EC 1.15.1.1 (superoxide dismutase) inhibitor An EC 1.15.* (oxidoreductase acting on superoxide as acceptor) inhibitor that interferes with the action of superoxide dismutase (EC 1.15.1.1). Graph Cu,Zn-SOD inhibitor|Cu,Zn-SOD inhibitors|Cu-Zn superoxide dismutase inhibitor|Cu-Zn superoxide dismutase inhibitors|EC 1.15.1.1 (superoxide dismutase) inhibitors|EC 1.15.1.1 inhibitor|EC 1.15.1.1 inhibitors|Fe-SOD inhibitor|Fe-SOD inhibitors|Mn-SOD inhibitor|Mn-SOD inhibitors|SOD inhibitor|SOD inhibitors|SOD-1 inhibitor|SOD-1 inhibitors|SOD-2 inhibitor|SOD-2 inhibitors|SOD-3 inhibitor|SOD-3 inhibitors|SOD-4 inhibitor|SOD-4 inhibitors|SODF inhibitor|SODF inhibitors|SODS inhibitor|SODS inhibitors|copper-zinc superoxide dismutase inhibitor|copper-zinc superoxide dismutase inhibitors|cuprein inhibitor|cuprein inhibitors|cytocuprein inhibitor|cytocuprein inhibitors|erythrocuprein inhibitor|erythrocuprein inhibitors|ferrisuperoxide dismutase inhibitor|ferrisuperoxide dismutase inhibitors|hemocuprein inhibitor|hemocuprein inhibitors|hepatocuprein inhibitor|hepatocuprein inhibitors|superoxidase dismutase inhibitor|superoxidase dismutase inhibitors|superoxide dismutase (EC 1.15.1.1) inhibitor|superoxide dismutase (EC 1.15.1.1) inhibitors|superoxide dismutase I inhibitor|superoxide dismutase I inhibitors|superoxide dismutase II inhibitor|superoxide dismutase II inhibitors|superoxide dismutase inhibitor|superoxide dismutase inhibitors|superoxide:superoxide oxidoreductase inhibitor|superoxide:superoxide oxidoreductase inhibitors Cu,Zn-SOD inhibitor|Cu,Zn-SOD inhibitors|Cu-Zn superoxide dismutase inhibitor|Cu-Zn superoxide dismutase inhibitors|EC 1.15.1.1 (superoxide dismutase) inhibitors|EC 1.15.1.1 inhibitor|EC 1.15.1.1 inhibitors|Fe-SOD inhibitor|Fe-SOD inhibitors|Mn-SOD inhibitor|Mn-SOD inhibitors|SOD inhibitor|SOD inhibitors|SOD-1 inhibitor|SOD-1 inhibitors|SOD-2 inhibitor|SOD-2 inhibitors|SOD-3 inhibitor|SOD-3 inhibitors|SOD-4 inhibitor|SOD-4 inhibitors|SODF inhibitor|SODF inhibitors|SODS inhibitor|SODS inhibitors|copper-zinc superoxide dismutase inhibitor|copper-zinc superoxide dismutase inhibitors|cuprein inhibitor|cuprein inhibitors|cytocuprein inhibitor|cytocuprein inhibitors|erythrocuprein inhibitor|erythrocuprein inhibitors|ferrisuperoxide dismutase inhibitor|ferrisuperoxide dismutase inhibitors|hemocuprein inhibitor|hemocuprein inhibitors|hepatocuprein inhibitor|hepatocuprein inhibitors|superoxidase dismutase inhibitor|superoxidase dismutase inhibitors|superoxide dismutase (EC 1.15.1.1) inhibitor|superoxide dismutase (EC 1.15.1.1) inhibitors|superoxide dismutase I inhibitor|superoxide dismutase I inhibitors|superoxide dismutase II inhibitor|superoxide dismutase II inhibitors|superoxide dismutase inhibitor|superoxide dismutase inhibitors|superoxide:superoxide oxidoreductase inhibitor|superoxide:superoxide oxidoreductase inhibitors http://purl.obolibrary.org/obo/CHEBI_134084 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:134085 biolink:ChemicalEntity 3-hydroxyanthocyanidin cation Any anthocyanin cation carrying a 3-hydroxy substituent. metacyc.compound:3-OH-Anthocyanidins|pubmed:12532018|pubmed:14725861 Graph 3-hydroxyanthocyanidin cations 3-hydroxyanthocyanidin cations http://purl.obolibrary.org/obo/CHEBI_134085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134087 biolink:ChemicalEntity 3-hydroxyanthocyanidin betaine An oxonium betaine obtained by deprotonation of the 3-hydroxy group of any 3-hydroxyanthocyanidin cation. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). pubmed:12532018|pubmed:14725861 Graph an anthocyanidin with a 3-hydroxy group an anthocyanidin with a 3-hydroxy group http://purl.obolibrary.org/obo/CHEBI_134087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134090 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide Any glycoside derived from N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine. metacyc.compound:N-ACETYL-BETA-D-GLUCOSAMINYL-13-ETCETERA Graph an N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative an N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_134090 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134091 biolink:ChemicalEntity perfluorinated compound An organofluorine compound containing only C-F bonds (no C-H bonds) and C-C bonds but also other heteroatoms (particularly other halogens, oxygen, and sulfur). Their properties represent a blend of fluorocarbons (containing only C-F and C-C bonds) and the parent functionalised organic species. wikipedia.en:Perfluorinated_compound Graph PFC|PFCs|perfluorinated compounds PFC|PFCs|perfluorinated compounds http://purl.obolibrary.org/obo/CHEBI_134091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134117 biolink:ChemicalEntity presqualene monophosphate A triterpenyl phosphate that is presqualene in which the hydroxy hydrogen has been replaced by a monophosphate group. pubmed:16464866|pubmed:16990613|pubmed:23568778|pubmed:9353124 Graph {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl dihydrogen phosphate {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl dihydrogen phosphate {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_134117 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134126 biolink:ChemicalEntity picrotoxin A mixture consisting of equimolar amounts of picrotoxinin and picrotin found in the climbing plant Anamirta cocculus. cas:124-87-8|hmdb:HMDB0014609|reaxys:21526388|wikipedia.en:Picrotoxin Graph (1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-(prop-1-en-2-yl)-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione -- (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione (1:1)|Cocculin|Cocculus|Coques du levant|picrotoxine|picrotoxinin - picrotin (1:1) (1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-(prop-1-en-2-yl)-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione -- (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione (1:1) (1R,3R,5S,8S,9R,12S,13R,14R)-1-hydroxy-13-methyl-14-(prop-1-en-2-yl)-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione -- (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione (1:1)|Cocculin|Cocculus|Coques du levant|picrotoxine|picrotoxinin - picrotin (1:1) http://purl.obolibrary.org/obo/CHEBI_134126 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134133 biolink:ChemicalEntity 1-acylglycerol 20:4 A 1-monoglyceride in which the acyl group contains 20 carbons and 4 double bonds. Graph 1-AG 20:4|1-monoglyceride 20:4 1-AG 20:4|1-monoglyceride 20:4 http://purl.obolibrary.org/obo/CHEBI_134133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134144 biolink:ChemicalEntity 2-acylglycerol 20:4 A 2-monoglyceride in which the acyl group contains 20 carbons and 4 double bonds. Graph 2-AG 20:4|2-monoglyceride 20:4 2-AG 20:4|2-monoglyceride 20:4 http://purl.obolibrary.org/obo/CHEBI_134144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134157 biolink:ChemicalEntity N-acylethanolamine 18:0 A N-(long-chain-acyl)ethanolamine in which the acyl group contains 18 carbons and is fully saturated. Graph NAE 18:0 NAE 18:0 http://purl.obolibrary.org/obo/CHEBI_134157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134158 biolink:ChemicalEntity N-acylethanolamine 18:1 An N-acylethanolamine in which the acyl group contains 18 carbons and 1 double bond. Graph NAE 18:1 NAE 18:1 http://purl.obolibrary.org/obo/CHEBI_134158 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134161 biolink:ChemicalEntity N-acylethanolamine 20:4 A N-(long-chain-acyl)ethanolamine in which the acyl group contains 20 carbons and 4 double bonds. Graph NAE 20:4 NAE 20:4 http://purl.obolibrary.org/obo/CHEBI_134161 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134173 biolink:ChemicalEntity antidote to barbiturate poisoning A role borne by a molecule that acts to counteract or neutralise the deleterious effects of barbiturates. pubmed:15432128 Graph antidote to barbiturate overdose antidote to barbiturate overdose http://purl.obolibrary.org/obo/CHEBI_134173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134174 biolink:ChemicalEntity picrotoxane sesquiterpenoid A group of sesquiterpenoids whose structure is based on a hexahydroindane skeleton, as exemplified by picrotin. Graph picrotoxane sesquiterpenoids picrotoxane sesquiterpenoids http://purl.obolibrary.org/obo/CHEBI_134174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134175 biolink:ChemicalEntity N-acylserotonin A fatty amide resulting from the condensation of the carboxy group of a fatty acid with the primary amino group of serotonin. pubmed:21798367|pubmed:24444601|pubmed:25291601 Graph N-acyl-serotonin|N-acyl-serotonins|N-acylserotonins|an N-(fatty acyl)-serotonin N-acyl-serotonin|N-acyl-serotonins|N-acylserotonins|an N-(fatty acyl)-serotonin http://purl.obolibrary.org/obo/CHEBI_134175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134178 biolink:ChemicalEntity all-trans-4-hydroxyretinoate A hydroxy monocarboxylic acid anion that is the conjugate base of all-trans-4-hydroxyretinoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:8939936 Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-3-hydroxy-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate|(2E,4E,6E,8E)-9-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3,7-dimethyl-nona-2,4,6,8-tetraenoate|(7E,9E,11E,13E)-4-hydroxyretinoic acid|4-hydroxy-(7E,9E,11E,13E)-retinoate|4-hydroxy-15-oxidoretinal|4-hydroxy-all-trans-retinoate|all-trans-4-hydroxyretinoate 4-hydroxy-15-oxidoretinal (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-3-hydroxy-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate|(2E,4E,6E,8E)-9-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3,7-dimethyl-nona-2,4,6,8-tetraenoate|(7E,9E,11E,13E)-4-hydroxyretinoic acid|4-hydroxy-(7E,9E,11E,13E)-retinoate|4-hydroxy-15-oxidoretinal|4-hydroxy-all-trans-retinoate|all-trans-4-hydroxyretinoate http://purl.obolibrary.org/obo/CHEBI_134178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134179 biolink:ChemicalEntity volatile organic compound Any organic compound having an initial boiling point less than or equal to 250 °C (482 °F) measured at a standard atmospheric pressure of 101.3 kPa. wikipedia.en:Volatile_organic_compound Graph VOC|VOCs|volatile organic compounds VOC|VOCs|volatile organic compounds http://purl.obolibrary.org/obo/CHEBI_134179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134182 biolink:ChemicalEntity platelet-activating factor receptor antagonist An antagonist that acts at the platelet-activating factor receptor. Graph PAF antagonist|PAF antagonists|platelet-activating factor receptor antagonists PAF antagonist|PAF antagonists|platelet-activating factor receptor antagonists http://purl.obolibrary.org/obo/CHEBI_134182 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134185 biolink:ChemicalEntity (S)-all-trans-4-hydroxyretinoate An all-trans-4-hydroxyretinoate that is the conjugate base of (S)-all-trans-4-hydroxyretinoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25492813 Graph (4S)-4-hydroxy-15-oxidoretinal|(4S)-OH-atRA|all-trans-(4S)-hydroxyretinoate (4S)-4-hydroxy-15-oxidoretinal (4S)-4-hydroxy-15-oxidoretinal|(4S)-OH-atRA|all-trans-(4S)-hydroxyretinoate http://purl.obolibrary.org/obo/CHEBI_134185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134190 biolink:ChemicalEntity capsiate A carboxylic ester obtained by formal condensation of the carboxy group of (6E)-8-methylnon-6-enoic acid with the benzylic hydroxy group of vanillyl alcohol. A non-pungent analogue of capsaicin with a similar biological profile. agr:IND44385191|cas:205687-01-0|chemspider:8015237|hmdb:HMDB0034780|kegg.compound:C20203|pubmed:12726827|pubmed:12959953|pubmed:16636441|pubmed:17264228|pubmed:17971242|pubmed:18172315|pubmed:19773740|pubmed:20102390|pubmed:20123015|pubmed:21071592|pubmed:21878735|pubmed:21883144|pubmed:21928164|pubmed:22038945|pubmed:23026494|pubmed:24026939|pubmed:24102723|pubmed:24644244|pubmed:25806854|pubmed:26030806|pubmed:28001433|pubmed:28230360|pubmed:28569248|reaxys:7933697 Graph (4-hydroxy-3-methoxyphenyl)methyl (6E)-8-methylnon-6-enoate|capsiate|vanillyl (6E)-8-methylnon-6-enoate (4-hydroxy-3-methoxyphenyl)methyl (6E)-8-methylnon-6-enoate (4-hydroxy-3-methoxyphenyl)methyl (6E)-8-methylnon-6-enoate|capsiate|vanillyl (6E)-8-methylnon-6-enoate http://purl.obolibrary.org/obo/CHEBI_134190 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134196 biolink:ChemicalEntity (2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid A 2,5-dihydro-1,3-thiazole carrying carboxy-, methyl- and (2-phosphonooxy)ethylidene-substituents at positions 2, 4 and 5 respectively. kegg.compound:C20246|pubmed:21534620|reaxys:19003148 Graph (2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid|(R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate|2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate|cThz*-P (2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid (2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid|(R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate|2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate|cThz*-P http://purl.obolibrary.org/obo/CHEBI_134196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134197 biolink:ChemicalEntity 3',5'-cyclic IMP(1-) An organophosphate oxoanion that is the conjugate base of 3',5'-cyclic IMP arising from deprotonation of the free phosphate OH group; major species at pH 7.3. pubmed:24074367 Graph 3',5'-cyclic IMP 3',5'-cyclic IMP http://purl.obolibrary.org/obo/CHEBI_134197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134205 biolink:ChemicalEntity 2-methyl-D-serine The D-enantiomer of 2-methylserine. Graph (2R)-2-amino-3-hydroxy-2-methylpropanoic acid|(2R)-2-amino-3-hydroxy-2-methylpropionic acid|(R)-2-methylserine|(R)-alpha-MeSer|2-methyl-D-serine 2-methyl-D-serine (2R)-2-amino-3-hydroxy-2-methylpropanoic acid|(2R)-2-amino-3-hydroxy-2-methylpropionic acid|(R)-2-methylserine|(R)-alpha-MeSer|2-methyl-D-serine http://purl.obolibrary.org/obo/CHEBI_134205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134206 biolink:ChemicalEntity 2-methylserine A hydroxy-amino acid that is serine which is substituted by a methyl group at position 2. cas:5424-29-3 Graph 2-amino-3-hydroxy-2-methylpropanoic acid|2-amino-3-hydroxy-2-methylpropionic acid|alpha-methylserine 2-amino-3-hydroxy-2-methylpropanoic acid|2-amino-3-hydroxy-2-methylpropionic acid|alpha-methylserine http://purl.obolibrary.org/obo/CHEBI_134206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134207 biolink:ChemicalEntity methylcytosine An aminopyrimidine that is cytosine which is substituted by a methyl group. Graph methylcytosines methylcytosines http://purl.obolibrary.org/obo/CHEBI_134207 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:134209 biolink:ChemicalEntity aporphine alkaloid Any benzylisoquinoline alkaloid that has a structure based on 4H-dibenzo[de,g]quinoline or its 3-methyl derivative. Graph aporphine alkaloids aporphine alkaloids http://purl.obolibrary.org/obo/CHEBI_134209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134212 biolink:ChemicalEntity (S)-glaucine(1+) An organic cation that is the conjugate acid of (R)-glaucine, obtained by protonation of the tertiary amino group; major species at pH 7.3. Graph (+)-glaucine|(6aS)-1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium|(S)-glaucine (6aS)-1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium (+)-glaucine|(6aS)-1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium|(S)-glaucine http://purl.obolibrary.org/obo/CHEBI_134212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134219 biolink:ChemicalEntity decenals A monounsaturated fatty aldehyde that is decanal which has undergone formal dehydrogenation to introduce a double bond at unspecified position. Graph decenal decenal http://purl.obolibrary.org/obo/CHEBI_134219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134225 biolink:ChemicalEntity 1,4-benzosemiquinones A semiquinone derived from a 1,4-benzoquinone by formal addition of one hydrogen atom with its electron, or from the removal of one hydrogen atom with its electron from a hydroquinone. Graph a 1,4-benzosemiquinone|p-benzosemiquinones a 1,4-benzosemiquinone|p-benzosemiquinones http://purl.obolibrary.org/obo/CHEBI_134225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134237 biolink:ChemicalEntity phosphatidic acid 36:2 A phosphatidic acid in which the two acyl groups contain a total of 36 carbons and 2 double bonds. Graph PA(36:2) PA(36:2) http://purl.obolibrary.org/obo/CHEBI_134237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134239 biolink:ChemicalEntity phosphatidylethanolamine 38:5 A phosphatidylethanolamine in which the two acyl groups contain a total of 38 carbons and 5 double bonds. agr:IND601133963 Graph PE(38:5) PE(38:5) http://purl.obolibrary.org/obo/CHEBI_134239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134241 biolink:ChemicalEntity phosphatidylethanolamine 40:6 A phosphatidylethanolamine in which the two acyl groups contain a total of 40 carbons and 6 double bonds. agr:IND601133963|pubmed:26363509 Graph PE(40:6) PE(40:6) http://purl.obolibrary.org/obo/CHEBI_134241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134243 biolink:ChemicalEntity phosphatidylethanolamine 40:5 A phosphatidylethanolamine in which the two acyl groups contain a total of 40 carbons and 5 double bonds. Graph PE(40:5) PE(40:5) http://purl.obolibrary.org/obo/CHEBI_134243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134246 biolink:ChemicalEntity (R)-2-hydroxyglutaryl-CoA A hydroxyglutaryl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (R)-2-hydroxyglutaric acid. cas:111769-66-5|metacyc.compound:2-HYDROXYGLUTARYL-COA|pubmed:11106419|pubmed:11243821|pubmed:11759672|pubmed:11980491|pubmed:12610725|pubmed:15450487|pubmed:18274792|pubmed:21037290|pubmed:21434666|reaxys:21247358 Graph (R)-2-hydroxyglutaryl-coenzyme A|2-Hydroxyglutaryl-1-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-{[(2R)-4-carboxy-2-hydroxybutanoyl]sulfanyl}ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-{[(2R)-4-carboxy-2-hydroxybutanoyl]sulfanyl}ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (R)-2-hydroxyglutaryl-coenzyme A|2-Hydroxyglutaryl-1-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-{[(2R)-4-carboxy-2-hydroxybutanoyl]sulfanyl}ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_134246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134247 biolink:ChemicalEntity (11R)-11-hydroperoxylinoleic acid A linoleic acid hydroperoxide in which the hydroperoxy substituent is located at position 11R. Graph (11R)-hydroperoxy-(9Z,12Z)-octadecadienoic acid|(9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid|(9Z,11R,12Z)-11-hydroperoxyoctadecadienoic acid (9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid (11R)-hydroperoxy-(9Z,12Z)-octadecadienoic acid|(9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid|(9Z,11R,12Z)-11-hydroperoxyoctadecadienoic acid http://purl.obolibrary.org/obo/CHEBI_134247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134248 biolink:ChemicalEntity (11R)-11-hydroperoxylinoleate An octadecanoid anion that is the conjugate base of (11R)-11-hydroperoxylinoleic acid arising from deprotonation of the carboxylic acid function; major species at pH 7.3. Graph (11R)-11-hydroperoxylinoleate anion|(11R)-hydroperoxy-(9Z,12Z)-octadecadienoate|(9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoate|(9Z,11R,12Z)-11-hydroperoxyoctadecadienoate (9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoate (11R)-11-hydroperoxylinoleate anion|(11R)-hydroperoxy-(9Z,12Z)-octadecadienoate|(9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoate|(9Z,11R,12Z)-11-hydroperoxyoctadecadienoate http://purl.obolibrary.org/obo/CHEBI_134248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134249 biolink:ChemicalEntity alkanesulfonate oxoanion An alkanesulfonate in which the carbon at position 1 is attached to R, which can represent hydrogens, a carbon chain, or other groups. metacyc.compound:Alkanesulfonates Graph alkanesulfonate oxoanions|alkanesulfonates|an alkanesulfonate alkanesulfonate oxoanions|alkanesulfonates|an alkanesulfonate http://purl.obolibrary.org/obo/CHEBI_134249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134251 biolink:ChemicalEntity guaiacols Any phenol carrying an additional methoxy substituent at the ortho-position. metacyc.compound:Guaiacols Graph 1-hydroxy-2-methoxybenzenes|2-methoxyphenol|2-methoxyphenol derivative|2-methoxyphenol derivatives|2-methoxyphenols|a guaiacol|catechol monomethyl ether|catechol monomethyl ethers|o-methoxyphenol|o-methoxyphenols|ortho-methoxyphenol|ortho-methoxyphenols 1-hydroxy-2-methoxybenzenes|2-methoxyphenol|2-methoxyphenol derivative|2-methoxyphenol derivatives|2-methoxyphenols|a guaiacol|catechol monomethyl ether|catechol monomethyl ethers|o-methoxyphenol|o-methoxyphenols|ortho-methoxyphenol|ortho-methoxyphenols http://purl.obolibrary.org/obo/CHEBI_134251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134252 biolink:ChemicalEntity apraclonidine(1+) A guanidinium ion that is the conjugate acid of apraclonidine, obtained by protonation of the guanidino group. Major microspecies at pH 7.3. pubmed:11056163 Graph 2-(4-amino-2,6-dichloroanilino)-4,5-dihydro-1H-imidazol-1-ium|aminoclonidine(1+)|apraclonidine|apraclonidine cation 2-(4-amino-2,6-dichloroanilino)-4,5-dihydro-1H-imidazol-1-ium 2-(4-amino-2,6-dichloroanilino)-4,5-dihydro-1H-imidazol-1-ium|aminoclonidine(1+)|apraclonidine|apraclonidine cation http://purl.obolibrary.org/obo/CHEBI_134252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134256 biolink:ChemicalEntity lipid A (E. coli) The glycolipid moiety of the lipopolysaccharide produced by E. coli. pubmed:25867074|reaxys:11056969 Graph 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|E. coli lipid A 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|E. coli lipid A http://purl.obolibrary.org/obo/CHEBI_134256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134257 biolink:ChemicalEntity lipid A(4-) (E. coli) A lipid A(4−) obtained by deprotonation of the four phosphate OH groups of the lipid A obtained from E. coli; major species at pH 7.3. Graph 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphonato-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphonato-alpha-D-glucopyranose|E. coli lipid A(4-)|lipid A (E. coli) 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphonato-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphonato-alpha-D-glucopyranose 2-deoxy-6-O-(2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphonato-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphonato-alpha-D-glucopyranose|E. coli lipid A(4-)|lipid A (E. coli) http://purl.obolibrary.org/obo/CHEBI_134257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134268 biolink:ChemicalEntity (S)-mandelamide A mandelamide in which the stereocentre at position 2 has S-configuration pubmed:652949|reaxys:5251737 Graph (2S)-2-hydroxy-2-phenylacetamide|(S)-mandelic acid amide|(S)-mandelic amide (2S)-2-hydroxy-2-phenylacetamide (2S)-2-hydroxy-2-phenylacetamide|(S)-mandelic acid amide|(S)-mandelic amide http://purl.obolibrary.org/obo/CHEBI_134268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134269 biolink:ChemicalEntity 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one A differentiation-inducing factor that is pentaphenone bearing two chloro substituents at positions 3 and 5, two hydroxy substituents at positions 2 and 6 as well as a single methoxy substituent at position 4. A secreted, chlorinated molecule that controls cell fate during development of Dictyostelium cells. cas:113411-16-8|pubmed:1850369|pubmed:19684855|pubmed:21258165|pubmed:26688830|pubmed:26919666|pubmed:3355503|reaxys:10181236|wikipedia.en:Differentiation-inducing_factor Graph 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl-)-1-pentanone|1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one|DIF 2|DIF-2|Dif-2 (dictyostelium)|differentiation-inducing factor 2|differentiation-inducing factor-2 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl-)-1-pentanone|1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one|DIF 2|DIF-2|Dif-2 (dictyostelium)|differentiation-inducing factor 2|differentiation-inducing factor-2 http://purl.obolibrary.org/obo/CHEBI_134269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134270 biolink:ChemicalEntity phosphatidylethanolamine 38:4 A phosphatidylethanolamine in which the acyl groups at C-1 and C-2 contain 38 carbons in total with 4 double bonds. pubmed:26156741|pubmed:27002763|pubmed:27162539|pubmed:28807032 Graph PE 38:4|PE(38:4) PE 38:4|PE(38:4) http://purl.obolibrary.org/obo/CHEBI_134270 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134271 biolink:ChemicalEntity phosphatidylethanolamine 36:4 Graph PE 36:4|PE(36:4)|phosphatidylethanolamine(36:4) PE 36:4|PE(36:4)|phosphatidylethanolamine(36:4) http://purl.obolibrary.org/obo/CHEBI_134271 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134273 biolink:ChemicalEntity phosphatidylcholine 35:1 A 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups at C-1 and C-2 contain 35 carbons in total with 1 double bond. Graph PC 35:1|PC(35:1) PC 35:1|PC(35:1) http://purl.obolibrary.org/obo/CHEBI_134273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134275 biolink:ChemicalEntity keto-L-tagatose The straight-chain keto form of L-tagatose. agr:IND44317231|agr:IND44507646|cas:17598-82-2|metacyc.compound:CPD-15825|pdb-ccd:LTG|pubmed:16233647|pubmed:18984017|pubmed:19111643|pubmed:19856146|pubmed:20410293|pubmed:21392547|pubmed:21482110|pubmed:24367410|pubmed:25615556|pubmed:25655925|pubmed:25899632|pubmed:26227774|pubmed:27998065|reaxys:1724558 Graph (3R,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-lyxo-2-hexulose|L-tagatose|keto-L-tagatose L-tagatose (3R,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-lyxo-2-hexulose|L-tagatose|keto-L-tagatose http://purl.obolibrary.org/obo/CHEBI_134275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134283 biolink:ChemicalEntity keto-D-tagatose 6-phosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of keto-D-tagatose 6-phosphate; major species at pH 7.3. metacyc.compound:CPD-15826 Graph 6-O-phosphonato-D-tagatose|D-tagatose 6-phosphate(2-)|keto-D-tagatose 6-phosphate 6-O-phosphonato-D-tagatose 6-O-phosphonato-D-tagatose|D-tagatose 6-phosphate(2-)|keto-D-tagatose 6-phosphate http://purl.obolibrary.org/obo/CHEBI_134283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134284 biolink:ChemicalEntity keto-L-tagatose 6-phosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of keto-L-tagatose 6-phosphate; major species at pH 7.3. metacyc.compound:CPD-15828 Graph 6-O-phosphonato-L-tagatose|L-tagatose 6-phosphate(2-)|keto-L-tagatose 6-phosphate 6-O-phosphonato-L-tagatose 6-O-phosphonato-L-tagatose|L-tagatose 6-phosphate(2-)|keto-L-tagatose 6-phosphate http://purl.obolibrary.org/obo/CHEBI_134284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134286 biolink:ChemicalEntity O-succinyl-L-serine A dicarboxylic acid monoester obtained by formal condensation of one of the carboxy groups of succinic acid with the side-chain hydroxy group of L-serine. It is an intermediate in the biosynthesis of the amino acid cysteine in fungi and bacteria. pubmed:28581482|pubmed:4893684|reaxys:6698489 Graph 4-[(2S)-2-amino-2-carboxyethoxy]-4-oxobutanoic acid|O-succinylserine|Ser(Suc)OH 4-[(2S)-2-amino-2-carboxyethoxy]-4-oxobutanoic acid 4-[(2S)-2-amino-2-carboxyethoxy]-4-oxobutanoic acid|O-succinylserine|Ser(Suc)OH http://purl.obolibrary.org/obo/CHEBI_134286 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134301 biolink:ChemicalEntity salvianolic acid B A member of the class of 1-benzofurans that is an antioxidant and free radical scavenging compound extracted from S. miltiorrhiza cas:121521-90-2|foodb.food:FDB030001|knapsack:C00031982|pubmed:1414377|pubmed:16933885|pubmed:27278104|pubmed:27424655|pubmed:27442887|pubmed:27484287|pubmed:27490455|pubmed:27497919|pubmed:27507327|pubmed:27513569|pubmed:27557491|pubmed:27569393|pubmed:27586425|pubmed:27592492|pubmed:27614127|pubmed:27670752|pubmed:27716647|pubmed:27779641|pubmed:27827892|pubmed:27843313|pubmed:27852325|pubmed:27893819|pubmed:27941340|pubmed:27973422|pubmed:27989594|pubmed:28000873|pubmed:28072989|pubmed:28116660|pubmed:28178753|pubmed:28211114|pubmed:28214521|pubmed:28244648|pubmed:28251987|pubmed:28254683|reaxys:8182741 Graph (2R)-2-({(2E)-3-[(2S,3S)-3-{[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl}oxy)-3-(3,4-dihydroxyphenyl)propanoic acid|Dan Shen Suan B|Danfensuan B|Lithospermate B|Lithospermic acid B (2R)-2-({(2E)-3-[(2S,3S)-3-{[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl}oxy)-3-(3,4-dihydroxyphenyl)propanoic acid (2R)-2-({(2E)-3-[(2S,3S)-3-{[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl}oxy)-3-(3,4-dihydroxyphenyl)propanoic acid|Dan Shen Suan B|Danfensuan B|Lithospermate B|Lithospermic acid B http://purl.obolibrary.org/obo/CHEBI_134301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134316 biolink:ChemicalEntity 2-acylphloroglucinol A benzenetriol that is phloroglucinol in which one of the ring hydrogens has been replaced by an acyl group. metacyc.compound:CPD-19786 Graph 2-acylphloroglucinols 2-acylphloroglucinols http://purl.obolibrary.org/obo/CHEBI_134316 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134343 biolink:ChemicalEntity lupulone(1-) A β-bitter acid(1−) that is the conjugate base of lupulone, obtained by deprotonation of the 1-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). metacyc.compound:CPD-7110|pubmed:19476340|pubmed:25099125 Graph 5-hydroxy-2-(3-methylbutanoyl)-4,4,6-tris(3-methylbut-2-en-1-yl)-3-oxocyclohexa-1,5-dien-1-olate|lupulone 5-hydroxy-2-(3-methylbutanoyl)-4,4,6-tris(3-methylbut-2-en-1-yl)-3-oxocyclohexa-1,5-dien-1-olate 5-hydroxy-2-(3-methylbutanoyl)-4,4,6-tris(3-methylbut-2-en-1-yl)-3-oxocyclohexa-1,5-dien-1-olate|lupulone http://purl.obolibrary.org/obo/CHEBI_134343 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134344 biolink:ChemicalEntity ergothioneine(1+) An α-amino-acid cation obtained by protonation of the imidazole ring of ergothioneine. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Graph (2S)-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-3-ium-4-yl)-2-(trimethylazaniumyl)propanoate|ergothioneine|ergothioneine cation (2S)-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-3-ium-4-yl)-2-(trimethylazaniumyl)propanoate (2S)-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-3-ium-4-yl)-2-(trimethylazaniumyl)propanoate|ergothioneine|ergothioneine cation http://purl.obolibrary.org/obo/CHEBI_134344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134348 biolink:ChemicalEntity beta-bitter acid(1-) An organic anion obtained by deprotonation of one of the enolic hydroxy groups of any β-bitter acid. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). metacyc.compound:BETA-ACIDS Graph 2-acyl-4,6,6-triprenylphloroglucinol(1-)|a 2-acyl-4,6,6-triprenylphloroglucinol|beta-bitter acid anion 2-acyl-4,6,6-triprenylphloroglucinol(1-)|a 2-acyl-4,6,6-triprenylphloroglucinol|beta-bitter acid anion http://purl.obolibrary.org/obo/CHEBI_134348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134355 biolink:ChemicalEntity auraptene A member of the class of coumarins that is umbelliferone in which the phenolic hydrogen has been replaced by a geranyl group. Ii is isolated from several edible fruits and vegetables and exhibits a variety of therapeutic properties. cas:495-02-3|chemspider:1267148|hmdb:HMDB0034054|knapsack:C00029763|pubmed:10426794|pubmed:10820092|pubmed:10840935|pubmed:10890030|pubmed:10919638|pubmed:11023542|pubmed:13155117|pubmed:15218316|pubmed:16012713|pubmed:16317159|pubmed:16395701|pubmed:16979634|pubmed:17151446|pubmed:17284254|pubmed:17301064|pubmed:17571970|pubmed:17898489|pubmed:18060855|pubmed:18444171|pubmed:19276534|pubmed:19444820|pubmed:19640308|pubmed:19688830|pubmed:20460732|pubmed:20681532|pubmed:20702762|pubmed:20863601|pubmed:20955144|pubmed:21705169|pubmed:21911903|pubmed:22038981|pubmed:22283649|pubmed:22471969|pubmed:22742512|pubmed:22754300|pubmed:22761031|pubmed:23083450|pubmed:23219792|pubmed:23320178|pubmed:23368941|pubmed:23495198|pubmed:23872723|pubmed:24070132|pubmed:24955102|pubmed:25147119|pubmed:25522543|pubmed:25620131|pubmed:25810889|pubmed:26351512|pubmed:26474388|pubmed:26730337|pubmed:26944297|pubmed:27130820|pubmed:27207438|pubmed:27420975|pubmed:27763495|pubmed:27771936|pubmed:28383142|pubmed:9247600|pubmed:9395216|pubmed:9525276|pubmed:9635577|reaxys:1291239|wikipedia.en:Auraptene Graph (E)-7-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-2H-chromen-2-one|7-O-geranylumbelliferone|7-geranyloxycoumarin|7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-1-benzopyran-2-one 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-1-benzopyran-2-one (E)-7-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-2H-chromen-2-one|7-O-geranylumbelliferone|7-geranyloxycoumarin|7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-1-benzopyran-2-one http://purl.obolibrary.org/obo/CHEBI_134355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134361 biolink:ChemicalEntity allylic alcohol An alcohol where the hydroxy group is attached to a saturated carbon atom adjacent to a double bond (R groups may be H, organyl, etc.). Graph allylic alcohols allylic alcohols http://purl.obolibrary.org/obo/CHEBI_134361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134362 biolink:ChemicalEntity homoallylic alcohol An aliphatic alcohol where the hydroxy carbon is β to a double bond. Graph homoallylic alcohols homoallylic alcohols http://purl.obolibrary.org/obo/CHEBI_134362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134363 biolink:ChemicalEntity tertiary amine oxide An N-oxide where there are three organic groups bonded to the nitrogen atom. patent:EP0545208|patent:EP0757983|patent:EP0866058|patent:EP1068179|patent:US4206204|patent:WO9950236 Graph tertiary amine oxides tertiary amine oxides http://purl.obolibrary.org/obo/CHEBI_134363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134364 biolink:ChemicalEntity 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA A steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 7α,12α-3-oxochol-4-en-24-oic acid. metacyc.compound:3-OXO-DELTA4-CHOLYL-COA Graph 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-coenzyme A 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_134364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134366 biolink:ChemicalEntity 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA A steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 12α-hydroxy-3-oxochola-4,6-dien-24-oic acid. metacyc.compound:3-OXO-DELTA46-CHOLYL-COA Graph 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-coenzyme A 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_134366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134386 biolink:ChemicalEntity 2-acylphloroglucinol(1-) A phenolate anion obtained by deprotonation of one of the phenolic hydroxy groups of any 2-acylphloroglucinol. Graph a 2-acylphloroglucinol a 2-acylphloroglucinol http://purl.obolibrary.org/obo/CHEBI_134386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134394 biolink:ChemicalEntity primary allylic alcohol An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to two hydrogens. Graph primary allylic alcohols primary allylic alcohols http://purl.obolibrary.org/obo/CHEBI_134394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134396 biolink:ChemicalEntity secondary allylic alcohol An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to one other carbon and one hydrogen. Graph secondary allylic alcohols secondary allylic alcohols http://purl.obolibrary.org/obo/CHEBI_134396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134397 biolink:ChemicalEntity tertiary allylic alcohol An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to two other carbons (R4,R5 ≠ H). Graph tertiary allylic alcohols tertiary allylic alcohols http://purl.obolibrary.org/obo/CHEBI_134397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134398 biolink:ChemicalEntity D-proline betaine An amino acid betaine that is D-proline zwitterion in which both of the hydrogens attached to the nitrogen are replaced by methyl groups. metacyc.compound:CPD-17175 Graph (2R)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate|(R)-2-carboxylato-1,1-dimethylpyrrolidinium|D-proline betaine|N,N-dimethyl-D-proline (2R)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate (2R)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate|(R)-2-carboxylato-1,1-dimethylpyrrolidinium|D-proline betaine|N,N-dimethyl-D-proline http://purl.obolibrary.org/obo/CHEBI_134398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134399 biolink:ChemicalEntity ADP-5-ethyl-4-methylthiazole-2-carboxylic acid An 1,3-thiazolemonocarboxylic acid that is ADP in which one of the diphosphate hydrogens has been replaced by a 2-(2-carboxy-4-methyl-1,3-thiazol-5-yl)ethyl group. kegg.compound:C20784|pdb-ccd:AHZ|reaxys:10406259 Graph 5'-O-[({[2-(2-carboxy-4-methyl-1,3-thiazol-5-yl)ethoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine|Adenosine diphospho-5-beta-ethyl-4-methylthiazole-2-carboxylic acid 5'-O-[({[2-(2-carboxy-4-methyl-1,3-thiazol-5-yl)ethoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine 5'-O-[({[2-(2-carboxy-4-methyl-1,3-thiazol-5-yl)ethoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine|Adenosine diphospho-5-beta-ethyl-4-methylthiazole-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_134399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134407 biolink:ChemicalEntity prostaglandin H3 A member of the class of prostaglandins H that is 9,11-epidioxyprosta-5,13,17-trienoic acid carrying an additional hydroxy substituent at the 15S-position. cas:60114-66-1|pubmed:2491846|pubmed:3579292|pubmed:531219|pubmed:6966885|reaxys:30529584 Graph (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoic acid|(5Z,9S,11R,13E,15S,17Z)-15-hydroxy-9,11-epidioxyprosta-5,13,17-trienoic acid|(5Z,9alpha,11alpha,13E,15S,17Z)-9,11-Epidioxy-15-hydroxyprosta-5,13,17-trien-1-oic acid|PGH3 (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoic acid (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S,,5Z)-3-hydroxyocta-1,5-dien-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}hept-5-enoic acid|(5Z,9S,11R,13E,15S,17Z)-15-hydroxy-9,11-epidioxyprosta-5,13,17-trienoic acid|(5Z,9alpha,11alpha,13E,15S,17Z)-9,11-Epidioxy-15-hydroxyprosta-5,13,17-trien-1-oic acid|PGH3 http://purl.obolibrary.org/obo/CHEBI_134407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134416 biolink:ChemicalEntity 3-oxo fatty acid Any oxo fatty acid in which an oxo substituent is located at position 3. Graph 3-keto fatty acid|3-keto fatty acids|3-oxo fatty acids 3-keto fatty acid|3-keto fatty acids|3-oxo fatty acids http://purl.obolibrary.org/obo/CHEBI_134416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134428 biolink:ChemicalEntity phosphatidylethanolamine 38:6 A phosphatidylethanolamine in which the two acyl groups contain a total of 38 carbons and 6 double bonds. Graph PE 38:6 PE 38:6 http://purl.obolibrary.org/obo/CHEBI_134428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134429 biolink:ChemicalEntity phosphatidylethanolamine 40:7 A phosphatidylethanolamine in which the two acyl groups contain a total of 40 carbons and 7 double bonds. Graph PE 40:7 PE 40:7 http://purl.obolibrary.org/obo/CHEBI_134429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134438 biolink:ChemicalEntity titanium oxides A class containing any titanium molecular entity that is an oxide of titanium. Graph titanium oxide titanium oxide http://purl.obolibrary.org/obo/CHEBI_134438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134441 biolink:ChemicalEntity titanium oxide nanoparticle A nanoparticle composed of any titanium oxide. Graph http://purl.obolibrary.org/obo/CHEBI_134441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134448 biolink:ChemicalEntity phosphatidylglycerol 38:4 A phosphatidylglycerol in which the two acyl groups contain a total of 38 carbons and 4 double bonds. Graph PG 38:4 PG 38:4 http://purl.obolibrary.org/obo/CHEBI_134448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134451 biolink:ChemicalEntity phosphatidylethanolamine 36:1 A phosphatidylethanolamine in which the two acyl groups contain a total of 36 carbons and 1 double bond. Graph PE 36:1 PE 36:1 http://purl.obolibrary.org/obo/CHEBI_134451 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134464 biolink:ChemicalEntity [(2->6)-beta-D-fructofuranosyl-]n alpha-D-glucopyranoside A fructan derivative consisting of (2→6)-β-D-fructan attached to an α-D-glucopyranosyl residue via a (1↔1) linkage. Graph [(2->6)-beta-D-fructofuranosyl-]n alpha-D-glucopyranoside [(2->6)-beta-D-fructofuranosyl-]n alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_134464 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134490 biolink:ChemicalEntity phosphatidylglycerol 36:1 A phosphatidylglycerol in which the two acyl groups contain 36 carbon atoms and 1 double bond. Graph PG 36:1 PG 36:1 http://purl.obolibrary.org/obo/CHEBI_134490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134504 biolink:ChemicalEntity tenofovir(1-) A phosphorus oxoanion resulting from the removal of one proton from the phosphonic acid group of tenofovir. The major microspecies at pH 7.3. Graph hydrogen ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate|tenofovir|tenofovir (1-) hydrogen ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate hydrogen ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate|tenofovir|tenofovir (1-) http://purl.obolibrary.org/obo/CHEBI_134504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134512 biolink:ChemicalEntity adefovir(1-) A organophosphonate oxoanion obtained by removal of a proton from the phosphonate group of adefovir, a nucleoside reverse transcriptase inhibitor. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Graph adefovir|hydrogen {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate hydrogen {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate adefovir|hydrogen {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate http://purl.obolibrary.org/obo/CHEBI_134512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134514 biolink:ChemicalEntity cidofovir(1-) A organophosphonate oxoanion obtained by removal of a proton from the phosphonate group of cidofovir. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). pubmed:15914676 Graph cidofovir|hydrogen ({[(2S)-1-(4-amino-2-oxopyrimidin-1(2H)-yl)-3-hydroxypropan-2-yl]oxy}methyl)phosphonate cidofovir|hydrogen ({[(2S)-1-(4-amino-2-oxopyrimidin-1(2H)-yl)-3-hydroxypropan-2-yl]oxy}methyl)phosphonate http://purl.obolibrary.org/obo/CHEBI_134514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134526 biolink:ChemicalEntity S-(long-chain fatty acyl)-L-cysteine An L-cysteine derivative obtained by formal condensation of the carboxy group of any long-chain fatty acid with the side-chain thiol group of L-cysteine. Graph http://purl.obolibrary.org/obo/CHEBI_134526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134529 biolink:ChemicalEntity omega-(methylthio)-2-oxocarboxylic acid Any 2-oxo monocarboxylic acid in which one of the terminal methyl hydrogens has been replaced by a methylthio group. Graph omega-(methylthio)-2-oxocarboxylic acids omega-(methylthio)-2-oxocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_134529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134530 biolink:ChemicalEntity 2-(omega-methylthio)alkylmalic acid A 2-hydroxydicarboxylic acid that is any 2-alkylmalic acid in which one of the terminal methyl hydrogens has been replaced by a methylthio group. metacyc.compound:CPD-19482 Graph 2-(omega-methylthio)alkylmalic acids|alpha-(methylsulfanyl)-omega-(2,3-dicarboxy-2-hydroxypropyl)polymethylene alpha-(methylsulfanyl)-omega-(2,3-dicarboxy-2-hydroxypropyl)polymethylene 2-(omega-methylthio)alkylmalic acids|alpha-(methylsulfanyl)-omega-(2,3-dicarboxy-2-hydroxypropyl)polymethylene http://purl.obolibrary.org/obo/CHEBI_134530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134531 biolink:ChemicalEntity polyunsaturated dicarboxylic acid A dicarboxylic acid having 2 or more units of unsaturation. Graph polyunsaturated dicarboxylic acids polyunsaturated dicarboxylic acids http://purl.obolibrary.org/obo/CHEBI_134531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134542 biolink:ChemicalEntity oxodocosahexaenoic acid An oxo fatty acid that consists of docosahexaenoic acid (DoHE) carrying one or more oxo substituents. Graph ketodocosahexaenoic acid|ketodocosahexaenoic acids|oxo-DoHE|oxodocosahexaenoic acids ketodocosahexaenoic acid|ketodocosahexaenoic acids|oxo-DoHE|oxodocosahexaenoic acids http://purl.obolibrary.org/obo/CHEBI_134542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134547 biolink:ChemicalEntity TOP-53 A furonaphthodioxole that is 4'-demethyldeoxypodophyllotoxin which is substituted at position 4 of the C-ring by a 2-{[2-(dimethylamino)ethyl](methyl)amino}ethyl group. While structurally related to etoposide, TOP-53 is significantly more toxic to non-small cell lung cancer cells, more active at generating chromosomal breaks, and displays improved cellular uptake and pharmacokinetics in animal lung tissues. cas:148262-19-5|pubmed:11106259|pubmed:11170388|pubmed:12081147|pubmed:15892669|pubmed:15992351|pubmed:24827545|pubmed:8665518|pubmed:9106054|reaxys:6377812 Graph (5R,5aR,8aR,9S)-9-(2-{[2-(dimethylamino)ethyl](methyl)amino}ethyl)-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one|4'-demethyl-4beta-(2-{N-[2-(N',N'-dimethylamino)ethyl]-N-methylamino}ethyl)-4-desoxypodophyllotoxin|TOP 53 (5R,5aR,8aR,9S)-9-(2-{[2-(dimethylamino)ethyl](methyl)amino}ethyl)-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one (5R,5aR,8aR,9S)-9-(2-{[2-(dimethylamino)ethyl](methyl)amino}ethyl)-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one|4'-demethyl-4beta-(2-{N-[2-(N',N'-dimethylamino)ethyl]-N-methylamino}ethyl)-4-desoxypodophyllotoxin|TOP 53 http://purl.obolibrary.org/obo/CHEBI_134547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134548 biolink:ChemicalEntity N-pentacosanoylsphingosine A N-acylsphingosine in which the ceramide N-acyl group is specified as pentacosanoyl. cas:104404-17-3|hmdb:HMDB0004957|lipidmaps:LMSP02010013|pubmed:18835123|reaxys:31222671 Graph C25 ceramide|Cer(d18:1/25:0)|N-(pentacosanoyl)-ceramide|N-(pentacosanoyl)-sphing-4-enine|N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]pentacosanamide|N-pentacosanoylsphing-4-enine|ceramide (d18:1/25:0) N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]pentacosanamide C25 ceramide|Cer(d18:1/25:0)|N-(pentacosanoyl)-ceramide|N-(pentacosanoyl)-sphing-4-enine|N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]pentacosanamide|N-pentacosanoylsphing-4-enine|ceramide (d18:1/25:0) http://purl.obolibrary.org/obo/CHEBI_134548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134605 biolink:ChemicalEntity diazepinoindole Any organic heterotricyclic compound with a skeleton consisting of a diazepine ring fused to an indole. Graph diazepinoindoles diazepinoindoles http://purl.obolibrary.org/obo/CHEBI_134605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134615 biolink:ChemicalEntity hydroperoxyoctadecatrienoic acid A octadecanoid that is any octadecatrienoic acid carrying a single hydroperoxy substituent (position unspecified). Graph HpOTE|HpOTrE|hydroperoxyoctadecatrienoic acids HpOTE|HpOTrE|hydroperoxyoctadecatrienoic acids http://purl.obolibrary.org/obo/CHEBI_134615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134628 biolink:ChemicalEntity (1E,2S)-2-methylbutanal oxime An (E)-2-methylbutanal oxime that has S configuration at position 2. kegg.compound:C19491 Graph (1E,2S)-2-methylbutanal oxime|N-[(1E,2S)-2-methylbutylidene]hydroxylamine N-[(1E,2S)-2-methylbutylidene]hydroxylamine (1E,2S)-2-methylbutanal oxime|N-[(1E,2S)-2-methylbutylidene]hydroxylamine http://purl.obolibrary.org/obo/CHEBI_134628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134631 biolink:ChemicalEntity L-polyhomomethionine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of any L-polyhomomethionine; major species at pH 7.3. metacyc.compound:N-homo-methionine Graph L-polyhomomethionine zwitterions|an L-polyhomomethionine L-polyhomomethionine zwitterions|an L-polyhomomethionine http://purl.obolibrary.org/obo/CHEBI_134631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134645 biolink:ChemicalEntity hydroperoxy(hydroxy)icosapentaenoic acid An icosanoid that is any icosapentaenoic acid bearing hydroxy and hydroperoxy substituents. An oxidation product of icosapentaenoic acid metabolism. Graph hydroperoxy(hydroxy)eicosapentaenoic acid|hydroperoxy(hydroxy)eicosapentaenoic acids|hydroperoxy(hydroxy)icosapentaenoic acids hydroperoxy(hydroxy)eicosapentaenoic acid|hydroperoxy(hydroxy)eicosapentaenoic acids|hydroperoxy(hydroxy)icosapentaenoic acids http://purl.obolibrary.org/obo/CHEBI_134645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134651 biolink:ChemicalEntity hydroxydocosapentaenoic acid A docosanoid that is any docosapentaenoic acid carrying a single hydroxy substituent on its carbon chain. Graph hydroxydocosapentaenoic acids hydroxydocosapentaenoic acids http://purl.obolibrary.org/obo/CHEBI_134651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134656 biolink:ChemicalEntity resolvin T1(1-) A docosanoid anion that is the conjugate base of resolvin T1, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:27704804 Graph (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoate|(8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosapentaenoate|13-series resolvin 1(1-)|RvT1(1-)|resolvin T1 (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoate (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoate|(8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosapentaenoate|13-series resolvin 1(1-)|RvT1(1-)|resolvin T1 http://purl.obolibrary.org/obo/CHEBI_134656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134657 biolink:ChemicalEntity resolvin T2(1-) A docosanoid anion that is the conjugate base of resolvin T2, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:27704804 Graph (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoate|(8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosapentaenoate|13-series resolvin 2(1-)|RvT2(1-)|resolvin T2 (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoate (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoate|(8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosapentaenoate|13-series resolvin 2(1-)|RvT2(1-)|resolvin T2 http://purl.obolibrary.org/obo/CHEBI_134657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134658 biolink:ChemicalEntity resolvin T3(1-) A docosanoid anion that is the conjugate base of resolvin T3, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:27704804 Graph (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoate|(9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosapentaenoate|13-series resolvin 3(1-)|RvT3(1-)|resolvin T3 (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoate (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoate|(9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosapentaenoate|13-series resolvin 3(1-)|RvT3(1-)|resolvin T3 http://purl.obolibrary.org/obo/CHEBI_134658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134659 biolink:ChemicalEntity resolvin T4(1-) A docosanoid anion that is the conjugate base of resolvin T4, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:27704804 Graph (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoate|(8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosapentaenoate|13-series resolvin 4(1-)|RvT4(1-)|resolvin T4 (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoate (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoate|(8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosapentaenoate|13-series resolvin 4(1-)|RvT4(1-)|resolvin T4 http://purl.obolibrary.org/obo/CHEBI_134659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134680 biolink:ChemicalEntity omega-(methylsulfanyl)-(E)-alkanal oxime An aliphatic aldoxime which is substituted at the ω position by a methylsulfanediyl group and in which the oxime moiety has E configuration. metacyc.compound:CPD-19472 Graph an omega-(methylsulfanyl)-(E)-alkanal oxime|omega-(methylsulfanyl)-(E)-alkanal oximes|omega-(methylthio)-(E)-alkanal oxime|omega-(methylthio)-(E)-alkanal oximes an omega-(methylsulfanyl)-(E)-alkanal oxime|omega-(methylsulfanyl)-(E)-alkanal oximes|omega-(methylthio)-(E)-alkanal oxime|omega-(methylthio)-(E)-alkanal oximes http://purl.obolibrary.org/obo/CHEBI_134680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134686 biolink:ChemicalEntity oxycodone(1+) An organic cation that is the conjugate acid of oxycodone, obtained by protonation of the tertiary amino group of oxycodone. Graph (5alpha,17S)-14-hydroxy-3-methoxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium|oxycodone cation (5alpha,17S)-14-hydroxy-3-methoxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium (5alpha,17S)-14-hydroxy-3-methoxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium|oxycodone cation http://purl.obolibrary.org/obo/CHEBI_134686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134688 biolink:ChemicalEntity naltrexone(1+) An organic cation that is conjugate acid of naltrexone resulting from the protonation of the amino group; Major species at pH 7.3. Graph (5alpha,17R)-17-(cyclopropylmethyl)-3,14-dihydroxy-6-oxo-4,5-epoxymorphinan-17-ium|naltrexone cation (5alpha,17R)-17-(cyclopropylmethyl)-3,14-dihydroxy-6-oxo-4,5-epoxymorphinan-17-ium (5alpha,17R)-17-(cyclopropylmethyl)-3,14-dihydroxy-6-oxo-4,5-epoxymorphinan-17-ium|naltrexone cation http://purl.obolibrary.org/obo/CHEBI_134688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134689 biolink:ChemicalEntity rucaparib A member of the class of azepinoindoles that is 1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one carrying additional 4-[(methylamino)methyl]phenyl and fluoro substituents at positions 2 and 8 respectively. It is an inhibitor of poly (ADP-ribose) polymerase and is used (as the camsylate salt) as monotherapy for advanced ovarian cancer and deleterious germline or somatic BRCA mutation. cas:283173-50-2|chemspider:8107584|drugbank:DB12332|kegg.drug:D10079|lincs.smallmolecule:LSM-4947|pdb-ccd:RPB|pubmed:24900770|pubmed:25689628|pubmed:26438157|pubmed:27002934|pubmed:27087632|pubmed:27128213|pubmed:27228289|pubmed:27415012|pubmed:27515310|pubmed:27600766|pubmed:27702817|pubmed:27716873|pubmed:27866910|pubmed:27908594|pubmed:27940438|pubmed:28001384|pubmed:28057616|pubmed:28069724|pubmed:28205191|pubmed:28790837|pubmed:30830551|pubmed:30977683|pubmed:32121331|pubmed:32173049|pubmed:32241924|pubmed:32495160|pubmed:32717310|pubmed:32795228|pubmed:33053351|pubmed:33145877|pubmed:33332934|pubmed:33343988|pubmed:33369704|pubmed:33515503|pubmed:33752918|pubmed:33780687|reaxys:11556434|wikipedia.en:Rucaparib Graph 8-fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one|AG-14447|rucaparib|rucaparibum 8-fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one 8-fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one|AG-14447|rucaparib|rucaparibum http://purl.obolibrary.org/obo/CHEBI_134689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134691 biolink:ChemicalEntity azepinoindole Any organic heterotricyclic compound with a skeleton consisting of an azepine ring fused to an indole. Graph azepinoindoles azepinoindoles http://purl.obolibrary.org/obo/CHEBI_134691 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134695 biolink:ChemicalEntity rucaparib(1+) An organic cation obtained by protonation of the secondary amino function of rucaparib. Graph [4-(8-fluoro-6-oxo-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-2-yl)phenyl]-N-methylmethanaminium|rucaparib cation [4-(8-fluoro-6-oxo-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-2-yl)phenyl]-N-methylmethanaminium [4-(8-fluoro-6-oxo-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-2-yl)phenyl]-N-methylmethanaminium|rucaparib cation http://purl.obolibrary.org/obo/CHEBI_134695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134709 biolink:ChemicalEntity pitolisant cas:362665-56-3|drugcentral:5048 Graph BF2.649|pitolisant hydrochloride|tiprolisant|tiprolisant hydrochloride|wakix BF2.649|pitolisant hydrochloride|tiprolisant|tiprolisant hydrochloride|wakix http://purl.obolibrary.org/obo/CHEBI_134709 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134715 biolink:ChemicalEntity trelagliptin cas:865759-25-7|drugcentral:5013 Graph SYR-472|SYR111472|trelagliptin succinate|zafatek SYR-472|SYR111472|trelagliptin succinate|zafatek http://purl.obolibrary.org/obo/CHEBI_134715 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134718 biolink:ChemicalEntity safinamide cas:133865-89-1|drugcentral:4921 Graph EMD 1195686|EMD-1195686|safinamide mesilate|safinamide mesylate|safinamide methanesulfonate|xadago EMD 1195686|EMD-1195686|safinamide mesilate|safinamide mesylate|safinamide methanesulfonate|xadago http://purl.obolibrary.org/obo/CHEBI_134718 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134721 biolink:ChemicalEntity cetilistat cas:282526-98-1|drugcentral:4886 Graph ATL-962|oblean ATL-962|oblean http://purl.obolibrary.org/obo/CHEBI_134721 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134722 biolink:ChemicalEntity favipiravir A member of the class of pyrazines that is pyrazine substituted by aminocarbonyl, hydroxy and fluoro groups at positions 2, 3 and 6, respectively. It is an anti-viral agent that inhibits RNA-dependent RNA polymerase of several RNA viruses and is approved for the treatment of influenza in Japan. cas:259793-96-9|chemspider:431002|drugbank:DB12466|drugcentral:4887|kegg.drug:D09537|pmc:PMC7971419|pubmed:28105854|pubmed:28324644|pubmed:28465146|pubmed:28769016|pubmed:29289664|pubmed:29289666|pubmed:29369776|pubmed:29765101|pubmed:29936152|pubmed:29982696|pubmed:30715325|pubmed:30951731|pubmed:31195019|pubmed:31507197|pubmed:31673977|pubmed:32174453|pubmed:32553844|pubmed:32645335|pubmed:32834770|pubmed:32836314|pubmed:32863356|pubmed:33108587|pubmed:33232871|pubmed:33268271|pubmed:33418497|pubmed:33451007|pubmed:33457366|pubmed:33478340|pubmed:33494498|pubmed:33526596|pubmed:33649117|pubmed:33859168|reaxys:9697246|wikipedia.en:Favipiravir Graph 6-fluoro-3-hydroxy-2-pyrazinecarboxamide|6-fluoro-3-hydroxypyrazine-2-carboxamide|Areplivir|Avifavir|Avigan|Favilavir|Favipira|T 705|T-705|T705|fapilavir|favipiravir|favipiravirum 6-fluoro-3-hydroxypyrazine-2-carboxamide 6-fluoro-3-hydroxy-2-pyrazinecarboxamide|6-fluoro-3-hydroxypyrazine-2-carboxamide|Areplivir|Avifavir|Avigan|Favilavir|Favipira|T 705|T-705|T705|fapilavir|favipiravir|favipiravirum http://purl.obolibrary.org/obo/CHEBI_134722 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134726 biolink:ChemicalEntity istradefylline cas:155270-99-8|drugcentral:4882 Graph KW-6002|KW6002|nouriast KW-6002|KW6002|nouriast http://purl.obolibrary.org/obo/CHEBI_134726 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134730 biolink:ChemicalEntity umifenovir cas:131707-25-0|drugcentral:4868 Graph arbidol|arbidole arbidol|arbidole http://purl.obolibrary.org/obo/CHEBI_134730 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134743 biolink:ChemicalEntity simeprevir cas:923604-59-5|drugcentral:4812 Graph TMC-435|TMC435350|olysio|simeprevir sodium TMC-435|TMC435350|olysio|simeprevir sodium http://purl.obolibrary.org/obo/CHEBI_134743 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134749 biolink:ChemicalEntity methylatropine cas:31610-87-4|drugcentral:4660 Graph atropine methobromide|atropine methonitrate|methylatropine nitrate|methylatropinium atropine methobromide|atropine methonitrate|methylatropine nitrate|methylatropinium http://purl.obolibrary.org/obo/CHEBI_134749 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134757 biolink:ChemicalEntity fluroxene cas:406-90-6|drugcentral:3242 Graph fluoromar|fluoroxene|trifluoroethyl vinyl ether fluoromar|fluoroxene|trifluoroethyl vinyl ether http://purl.obolibrary.org/obo/CHEBI_134757 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134762 biolink:ChemicalEntity isaxonine cas:4214-72-6|drugcentral:1485 Graph N-(Isopropylamino)-2-pyrimidine N-(Isopropylamino)-2-pyrimidine http://purl.obolibrary.org/obo/CHEBI_134762 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134767 biolink:ChemicalEntity valnoctamide cas:4171-13-5|drugcentral:2802 Graph nirvanil|valmethamide nirvanil|valmethamide http://purl.obolibrary.org/obo/CHEBI_134767 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134776 biolink:ChemicalEntity tisopurine cas:5334-23-6|drugcentral:2682 Graph thiopurinol thiopurinol http://purl.obolibrary.org/obo/CHEBI_134776 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134778 biolink:ChemicalEntity enbucrilate cas:6606-65-1|drugcentral:3056 Graph butyl alpha-cyanoacrylate|butyl cyanoacrylate|histacryl blue|indermil|n-Butyl 2-cyanoacrylate|n-butyl cyanoacrylate butyl alpha-cyanoacrylate|butyl cyanoacrylate|histacryl blue|indermil|n-Butyl 2-cyanoacrylate|n-butyl cyanoacrylate http://purl.obolibrary.org/obo/CHEBI_134778 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134779 biolink:ChemicalEntity norfenefrine cas:536-21-0|drugcentral:1966 Graph DL-Norphenylephrine|metacardiol|metaoctopamine|norfenefrine HCl|norfenefrine hydrochloride|normetasympathol|normetasynephrine|normezaton|norphenephrine|norphenylephrine DL-Norphenylephrine|metacardiol|metaoctopamine|norfenefrine HCl|norfenefrine hydrochloride|normetasympathol|normetasynephrine|normezaton|norphenephrine|norphenylephrine http://purl.obolibrary.org/obo/CHEBI_134779 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134788 biolink:ChemicalEntity oxiracetam cas:62613-82-5|drugcentral:2021 Graph hydroxypiracetam|neuromet hydroxypiracetam|neuromet http://purl.obolibrary.org/obo/CHEBI_134788 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134792 biolink:ChemicalEntity aminorex cas:2207-50-3|drugcentral:175 Graph aminoxafen|aminoxaphen|apiquel aminoxafen|aminoxaphen|apiquel http://purl.obolibrary.org/obo/CHEBI_134792 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134822 biolink:ChemicalEntity oxilofrine cas:365-26-4|drugcentral:3286 Graph oxilofrine HCl|oxilofrine hydrochloride oxilofrine HCl|oxilofrine hydrochloride http://purl.obolibrary.org/obo/CHEBI_134822 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134831 biolink:ChemicalEntity capuride An N-acylurea in which the acyl substituent is 2-ethyl-3-methylpentanoyl. A monoureide sedative, it has a duration of hypnotic effect similar to that of the short-acting barbiturates. cas:5579-13-5|drugcentral:485|kegg.drug:D03377|pubmed:19674061|pubmed:29438107|pubmed:4554661|pubmed:4927636|reaxys:1780788 Graph (2-Ethyl-3-methylvaleryl)urea|(Ethyl-sec-butylacetyl)urea|1-(2-Ethyl-3-methylpentanoyl)urea|N-carbamoyl-2-ethyl-3-methylpentanamide|capurida|capuride|capuridum N-carbamoyl-2-ethyl-3-methylpentanamide (2-Ethyl-3-methylvaleryl)urea|(Ethyl-sec-butylacetyl)urea|1-(2-Ethyl-3-methylpentanoyl)urea|N-carbamoyl-2-ethyl-3-methylpentanamide|capurida|capuride|capuridum http://purl.obolibrary.org/obo/CHEBI_134831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134841 biolink:ChemicalEntity dihydralazine cas:484-23-1|drugcentral:884 Graph dihydralazin|dihydralazine sulfate|dihydrallazine|dihydrazinophthalazine|hypopresol|nepresol|nepresolin|nepressol|ophthazin|tonolysin dihydralazin|dihydralazine sulfate|dihydrallazine|dihydrazinophthalazine|hypopresol|nepresol|nepresolin|nepressol|ophthazin|tonolysin http://purl.obolibrary.org/obo/CHEBI_134841 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134846 biolink:ChemicalEntity sabcomeline cas:159912-53-5|drugcentral:3536 Graph SB-202026-A|sabcomeline HCl|sabcomeline hydrochloride SB-202026-A|sabcomeline HCl|sabcomeline hydrochloride http://purl.obolibrary.org/obo/CHEBI_134846 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134860 biolink:ChemicalEntity oxophenarsine cas:538-03-4|drugcentral:3411 Graph arsenoxide|arsphenoxide|mapharsen|mapharside|metarsen|oxiarsolan|oxophenarsine HCl|oxophenarsine hydrochloride|treparsen arsenoxide|arsphenoxide|mapharsen|mapharside|metarsen|oxiarsolan|oxophenarsine HCl|oxophenarsine hydrochloride|treparsen http://purl.obolibrary.org/obo/CHEBI_134860 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134870 biolink:ChemicalEntity toloxatone A racemate consisting of equimolar amounts of (R)- and (S)-toloxatone. It is a reversible monoamine oxidase A inhibitor and antidepressant. cas:29218-27-7|drugbank:DB09245|drugcentral:2702|kegg.drug:D02559|patent:US4699782|pubmed:10371410|pubmed:1221563|pubmed:12659549|pubmed:1352813|pubmed:1424410|pubmed:1546124|pubmed:1546145|pubmed:1705137|pubmed:1843597|pubmed:2353326|pubmed:2365178|pubmed:2768411|pubmed:29844717|pubmed:32935716|pubmed:3634492|pubmed:3810545|pubmed:409416|pubmed:41906|pubmed:494659|pubmed:551645|pubmed:6520180|pubmed:6633672|pubmed:7200786|pubmed:7884022|pubmed:8094790|pubmed:8436164|reaxys:527506|wikipedia.en:Toloxatone Graph (5RS)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|(RS)-toloxatone|Delalande 69276|Humoryl|MD 69276|MD-69276|MD69276|Perenum|rac-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|rac-5-(hydroxymethyl)-3-(3-methylphenyl)-2-oxazolidinone|rac-5-hydroxymethyl-3-(m-tolyl)-2-oxazolidinone|rac-toloxatone|racemic toloxatone|toloxatona|toloxatone|toloxatonum rac-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (5RS)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|(RS)-toloxatone|Delalande 69276|Humoryl|MD 69276|MD-69276|MD69276|Perenum|rac-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|rac-5-(hydroxymethyl)-3-(3-methylphenyl)-2-oxazolidinone|rac-5-hydroxymethyl-3-(m-tolyl)-2-oxazolidinone|rac-toloxatone|racemic toloxatone|toloxatona|toloxatone|toloxatonum http://purl.obolibrary.org/obo/CHEBI_134870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134871 biolink:ChemicalEntity guanoxan cas:2165-19-7|drugcentral:1346 Graph guanoxan sulfate|guanoxane guanoxan sulfate|guanoxane http://purl.obolibrary.org/obo/CHEBI_134871 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134874 biolink:ChemicalEntity meobentine cas:46464-11-3|drugcentral:3340 Graph meobentine sulfate meobentine sulfate http://purl.obolibrary.org/obo/CHEBI_134874 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134878 biolink:ChemicalEntity fepradinol cas:36981-91-6|drugcentral:1168 Graph fepradinol hydrochloride fepradinol hydrochloride http://purl.obolibrary.org/obo/CHEBI_134878 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13488 biolink:ChemicalEntity UDP-D-galacturonic acid Graph uridine 5'-[3-(D-galacturonosyl) dihydrogen diphosphate] uridine 5'-[3-(D-galacturonosyl) dihydrogen diphosphate] uridine 5'-[3-(D-galacturonosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_13488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134880 biolink:ChemicalEntity melevodopa cas:7101-51-1|drugcentral:1673 Graph L-dopa methyl ester|levodopa methyl ester|levomet L-dopa methyl ester|levodopa methyl ester|levomet http://purl.obolibrary.org/obo/CHEBI_134880 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134885 biolink:ChemicalEntity albutoin cas:830-89-7|drugcentral:106 Graph euprax euprax http://purl.obolibrary.org/obo/CHEBI_134885 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134896 biolink:ChemicalEntity tiamenidine cas:31428-61-2|drugcentral:2649 Graph thiamendidine|tiamenidine hydrochloride thiamendidine|tiamenidine hydrochloride http://purl.obolibrary.org/obo/CHEBI_134896 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134906 biolink:ChemicalEntity cicloxilic acid A racemate comprising equal amounts of (1R,2S)- and (1S,2R)-cicloxilic acid. It is a choleretic agent that has antilithogenic activity. cas:57808-63-6|drugcentral:638|pubmed:367682|pubmed:3703340|pubmed:378512|pubmed:380876|pubmed:41738|pubmed:554041|pubmed:582955|pubmed:582956|pubmed:582957|pubmed:582958|pubmed:582959|pubmed:582960|pubmed:582961|pubmed:582962|pubmed:582963|pubmed:582964|pubmed:582965|pubmed:582966|pubmed:582984|pubmed:6360773|pubmed:6475902|pubmed:6627972|pubmed:6891234|pubmed:6998639|pubmed:7247747|pubmed:744226|pubmed:748062 Graph Plecton|acide cicloxilique|acido cicloxilico|acidum cicloxilicum|cicloxilic acid|cis-2-hydroxy-2-phenyl-cyclohexanecarboxylic acid|cycloxilic acid|rac-(1S,2R)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|rac-(1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|rac-cicloxilic acid|racemic cicloxilic acid rac-(1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid Plecton|acide cicloxilique|acido cicloxilico|acidum cicloxilicum|cicloxilic acid|cis-2-hydroxy-2-phenyl-cyclohexanecarboxylic acid|cycloxilic acid|rac-(1S,2R)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|rac-(1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|rac-cicloxilic acid|racemic cicloxilic acid http://purl.obolibrary.org/obo/CHEBI_134906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134907 biolink:ChemicalEntity lidamidine cas:66871-56-5|drugcentral:1578 Graph WHR-1142A|lidamidine HCl|lidamidine hydrochloride|lidamidine monohydrochloride WHR-1142A|lidamidine HCl|lidamidine hydrochloride|lidamidine monohydrochloride http://purl.obolibrary.org/obo/CHEBI_134907 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134918 biolink:ChemicalEntity toliprolol cas:2933-94-0|drugcentral:3616 Graph KO-592|doberol|racemic toliprolol KO-592|doberol|racemic toliprolol http://purl.obolibrary.org/obo/CHEBI_134918 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134921 biolink:ChemicalEntity nifenalol cas:7413-36-7|drugcentral:3380 Graph isophenethanol|racemic nifenalol isophenethanol|racemic nifenalol http://purl.obolibrary.org/obo/CHEBI_134921 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134929 biolink:ChemicalEntity nimorazole cas:6506-37-2|drugcentral:1938 Graph naxofem|naxogin|nimorazol|nitrimidazine|nulogyl naxofem|naxogin|nimorazol|nitrimidazine|nulogyl http://purl.obolibrary.org/obo/CHEBI_134929 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134932 biolink:ChemicalEntity dimetofrine cas:22950-29-4|drugcentral:909 Graph anassicol|dimethophrine|dimetrophine anassicol|dimethophrine|dimetrophine http://purl.obolibrary.org/obo/CHEBI_134932 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134936 biolink:ChemicalEntity pemirolast cas:69372-19-6|drugcentral:2074|hmdb:HMDB0015023 Graph alamast|alegysal|pemirolast potassium|potassium pemirolast alamast|alegysal|pemirolast potassium|potassium pemirolast http://purl.obolibrary.org/obo/CHEBI_134936 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134938 biolink:ChemicalEntity ozagrel cas:82571-53-7|drugcentral:2043 Graph OKY-046|domenan|ozagrel HCl|ozagrel hydrochloride|ozagrel hydrochloride hydrate|ozagrel sodium|pulmoza|sodium ozagrel|xanbon OKY-046|domenan|ozagrel HCl|ozagrel hydrochloride|ozagrel hydrochloride hydrate|ozagrel sodium|pulmoza|sodium ozagrel|xanbon http://purl.obolibrary.org/obo/CHEBI_134938 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134955 biolink:ChemicalEntity azapetine cas:146-36-1|drugcentral:265 Graph Ro-2-3248|azapetine phosphate|ilidar|ilidar phosphate|peridil Ro-2-3248|azapetine phosphate|ilidar|ilidar phosphate|peridil http://purl.obolibrary.org/obo/CHEBI_134955 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134958 biolink:ChemicalEntity thioacetazone cas:104-06-3|drugcentral:2631 Graph ambathizon|amithiozone|benthiozone|benzothiozane|benzothiozon|thiacetazone|thiocarbazil|thiocarbazyl ambathizon|amithiozone|benthiozone|benzothiozane|benzothiozon|thiacetazone|thiocarbazil|thiocarbazyl http://purl.obolibrary.org/obo/CHEBI_134958 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134966 biolink:ChemicalEntity rufinamide cas:106308-44-5|drugcentral:3534 Graph CGP 33101|CGP-33101|banzel|inovelon CGP 33101|CGP-33101|banzel|inovelon http://purl.obolibrary.org/obo/CHEBI_134966 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13497 biolink:ChemicalEntity UDP-alpha-D-glucosamine A UDP-amino sugar having α-D-glucosamine as the amino-sugar component. kegg.compound:C02200 Graph UDPglucosamine|uridine 5'-[3-(2-amino-2-deoxyglucopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-amino-2-deoxyglucopyranosyl) dihydrogen diphosphate] UDPglucosamine|uridine 5'-[3-(2-amino-2-deoxyglucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_13497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:134972 biolink:ChemicalEntity flosequinan cas:76568-02-0|drugcentral:1182 Graph flosequinon|manoplax flosequinon|manoplax http://purl.obolibrary.org/obo/CHEBI_134972 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134975 biolink:ChemicalEntity fluindione cas:957-56-2|drugcentral:1194 Graph previscan previscan http://purl.obolibrary.org/obo/CHEBI_134975 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134979 biolink:ChemicalEntity budralazine cas:36798-79-5|drugcentral:421 Graph budralazine HCl|budralazine hydrochloride|budralazine monohydrochloride|buterazine budralazine HCl|budralazine hydrochloride|budralazine monohydrochloride|buterazine http://purl.obolibrary.org/obo/CHEBI_134979 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134983 biolink:ChemicalEntity enfenamic acid cas:23049-93-6|drugcentral:3176 Graph tromaril tromaril http://purl.obolibrary.org/obo/CHEBI_134983 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134989 biolink:ChemicalEntity taribavirin cas:119567-79-2|drugcentral:3582 Graph ribamidine|taribavirin HCl|taribavirin hydrochloride|viramidine ribamidine|taribavirin HCl|taribavirin hydrochloride|viramidine http://purl.obolibrary.org/obo/CHEBI_134989 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134990 biolink:ChemicalEntity agomelatine cas:138112-76-2|drugcentral:99|hmdb:HMDB0015636 Graph S-20098|S20098|thymanax|valdoxan S-20098|S20098|thymanax|valdoxan http://purl.obolibrary.org/obo/CHEBI_134990 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:134991 biolink:ChemicalEntity frovatriptan cas:158747-02-5|drugcentral:1251|hmdb:HMDB0015133 Graph (R)-Frovatriptan|SB 209509|VML251|frovatriptan succinate|frovatriptan succinate hydrate (R)-Frovatriptan|SB 209509|VML251|frovatriptan succinate|frovatriptan succinate hydrate http://purl.obolibrary.org/obo/CHEBI_134991 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135004 biolink:ChemicalEntity nefiracetam cas:77191-36-7|drugcentral:3376 Graph DM 9384|DM-9384|translon DM 9384|DM-9384|translon http://purl.obolibrary.org/obo/CHEBI_135004 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135005 biolink:ChemicalEntity milnacipran cas:92623-85-3|drugcentral:1808 Graph (+/-)-Milnacipran|midalcipran|milnacipran HCl|milnacipran hydrochloride (+/-)-Milnacipran|midalcipran|milnacipran HCl|milnacipran hydrochloride http://purl.obolibrary.org/obo/CHEBI_135005 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135010 biolink:ChemicalEntity enoximone cas:77671-31-9|drugcentral:1014|hmdb:HMDB0015599 Graph fenoximone fenoximone http://purl.obolibrary.org/obo/CHEBI_135010 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135013 biolink:ChemicalEntity trimecaine cas:616-68-2|drugcentral:3633 Graph diethylglycinemesidide|mesdicain|mesidicaine|trimecain diethylglycinemesidide|mesdicain|mesidicaine|trimecain http://purl.obolibrary.org/obo/CHEBI_135013 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135014 biolink:ChemicalEntity erdosteine cas:84611-23-4|drugcentral:1041 Graph dithiosteine dithiosteine http://purl.obolibrary.org/obo/CHEBI_135014 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135019 biolink:ChemicalEntity olprinone cas:106730-54-5|drugcentral:1987 Graph E-1020|loprinone|olprinone HCl|olprinone hydrochloride|olprinone hydrochloride hydrate E-1020|loprinone|olprinone HCl|olprinone hydrochloride|olprinone hydrochloride hydrate http://purl.obolibrary.org/obo/CHEBI_135019 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135026 biolink:ChemicalEntity xibenolol cas:30187-90-7|drugcentral:3657 Graph http://purl.obolibrary.org/obo/CHEBI_135026 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135028 biolink:ChemicalEntity pirprofen cas:31793-07-4|drugcentral:2213 Graph racemic pirprofen|rengasil racemic pirprofen|rengasil http://purl.obolibrary.org/obo/CHEBI_135028 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135046 biolink:ChemicalEntity tofenacin cas:15301-93-6|drugcentral:2692|hmdb:HMDB0060632 Graph demethylorphenadrine|elamol|tofenacin HCl|tofenacin hydrochloride|tofenacin monohydrochloride|tofenacine demethylorphenadrine|elamol|tofenacin HCl|tofenacin hydrochloride|tofenacin monohydrochloride|tofenacine http://purl.obolibrary.org/obo/CHEBI_135046 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135048 biolink:ChemicalEntity dimemorfan cas:36309-01-0|drugcentral:900 Graph dimemorfan phosphate|dimemorphan dimemorfan phosphate|dimemorphan http://purl.obolibrary.org/obo/CHEBI_135048 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135057 biolink:ChemicalEntity clorindione cas:1146-99-2|drugcentral:3111 Graph chlophenadione|chlorathrombon|chlorindion|chlorindione|chlorphenadione|chlorphenindione|chlorphenindone|chlorphenylindandione chlophenadione|chlorathrombon|chlorindion|chlorindione|chlorphenadione|chlorphenindione|chlorphenindone|chlorphenylindandione http://purl.obolibrary.org/obo/CHEBI_135057 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135063 biolink:ChemicalEntity glycerylphosphorylcholine cas:563-24-6|drugcentral:3906 Graph glycerol phosphorylcholine|glycerophosphocholine|glycerophosphoric acid choline ester|glycerophosphorylcholine|glycerylphosphocholine glycerol phosphorylcholine|glycerophosphocholine|glycerophosphoric acid choline ester|glycerophosphorylcholine|glycerylphosphocholine http://purl.obolibrary.org/obo/CHEBI_135063 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135076 biolink:ChemicalEntity setiptiline A tetracyclic antidepressant that is 2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine carrying a methyl group at position 2. Its maleate salt is used for the treatment of depression in Japan. cas:57262-94-9|chemspider:5016|drugbank:DB09304|drugcentral:2438|kegg.drug:D08511|lincs.smallmolecule:LSM-45982|patent:CN101851201|patent:US2006039867|pubmed:12935454|pubmed:1942625|pubmed:2045013|pubmed:2881854|pubmed:32285503|pubmed:3774630|pubmed:3792961|pubmed:8048280|pubmed:8968382|pubmed:9737336|reaxys:1650422|wikipedia.en:Setiptiline Graph 2,3,4,9-tetrahydro-2-methyl-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine|2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine|MO 8282|MO-8282|Org 8282|Org-8282|setiptilina|setiptiline|setiptilinum|teciptilline 2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine 2,3,4,9-tetrahydro-2-methyl-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine|2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine|MO 8282|MO-8282|Org 8282|Org-8282|setiptilina|setiptiline|setiptilinum|teciptilline http://purl.obolibrary.org/obo/CHEBI_135076 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135078 biolink:ChemicalEntity cicletanine cas:89943-82-8|drugcentral:634 Graph (+/-)-Cicletanine|cicletanide|cycletanide (+/-)-Cicletanine|cicletanide|cycletanide http://purl.obolibrary.org/obo/CHEBI_135078 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135089 biolink:ChemicalEntity propacetamol cas:66532-85-2|drugcentral:2290 Graph proparacetamol proparacetamol http://purl.obolibrary.org/obo/CHEBI_135089 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135122 biolink:ChemicalEntity delmopinol cas:79874-76-3|drugcentral:3131 Graph decapinol|delmopinol HCl|delmopinol hydrochloride decapinol|delmopinol HCl|delmopinol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135122 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135123 biolink:ChemicalEntity bupranolol cas:14556-46-8|drugcentral:433|hmdb:HMDB0015697 Graph (+/-)-Bupranolol|bupranol|bupranolol HCl|bupranolol hydrochloride (+/-)-Bupranolol|bupranol|bupranolol HCl|bupranolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135123 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135127 biolink:ChemicalEntity pilsicainide A secondary carboxamide resulting from the formal condensation of the amino group of 2,6-dimethylaniline with the carboxy group of (tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetic acid. It is a sodium channel blocker which is used as an antiarrhythmic drug for the management of atrial tachyarrhythmias in Japan. cas:88069-67-4|drugbank:DB12712|drugcentral:2167|kegg.drug:D08377|pubmed:15988120|pubmed:16723783|pubmed:17112301|pubmed:18642016|pubmed:20205487|pubmed:20590641|pubmed:21869589|pubmed:22333385|pubmed:22466963|pubmed:24480637|pubmed:24653743|pubmed:27920831|pubmed:28364267|pubmed:28607619|pubmed:28765762|pubmed:30028738|pubmed:6089001|wikipedia.en:Pilsicainide Graph N-(2,6-dimethylphenyl)-2-(tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetamide|pilsicainida|pilsicainide|pilsicainidum|pilzicainide N-(2,6-dimethylphenyl)-2-(tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetamide N-(2,6-dimethylphenyl)-2-(tetrahydro-1H-pyrrolizin-7a(5H)-yl)acetamide|pilsicainida|pilsicainide|pilsicainidum|pilzicainide http://purl.obolibrary.org/obo/CHEBI_135127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135136 biolink:ChemicalEntity nifuroxazide cas:965-52-6|drugcentral:1928 Graph dicoferin|nifuroxazid|pentofuryl dicoferin|nifuroxazid|pentofuryl http://purl.obolibrary.org/obo/CHEBI_135136 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135155 biolink:ChemicalEntity acecarbromal cas:77-66-7|drugcentral:42 Graph acetcarbromal|acetylcarbromal|paxarel acetcarbromal|acetylcarbromal|paxarel http://purl.obolibrary.org/obo/CHEBI_135155 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135156 biolink:ChemicalEntity ramosetron cas:132036-88-5|drugcentral:2357 Graph ibsetron|ibsetron HCl|ibsetron hydrochloride|irribow|ramosetron HCl|ramosetron hydrochloride ibsetron|ibsetron HCl|ibsetron hydrochloride|irribow|ramosetron HCl|ramosetron hydrochloride http://purl.obolibrary.org/obo/CHEBI_135156 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135168 biolink:ChemicalEntity terodiline cas:15793-40-5|drugcentral:2603|hmdb:HMDB0240275 Graph dl-Terodiline|terodiline HCl|terodiline hydrochloride dl-Terodiline|terodiline HCl|terodiline hydrochloride http://purl.obolibrary.org/obo/CHEBI_135168 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135172 biolink:ChemicalEntity trolnitrate cas:7077-34-1|drugcentral:2770 Graph aminotrate|etamin|nitranole|nitranolum|nitretamine|triethanolamine trinitrate|trolnitrat|trolnitrate phosphate aminotrate|etamin|nitranole|nitranolum|nitretamine|triethanolamine trinitrate|trolnitrat|trolnitrate phosphate http://purl.obolibrary.org/obo/CHEBI_135172 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135177 biolink:ChemicalEntity iprindole cas:5560-72-5|drugcentral:1478 Graph pramindole pramindole http://purl.obolibrary.org/obo/CHEBI_135177 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135179 biolink:ChemicalEntity bromebric acid cas:5711-40-0|drugcentral:400 Graph mebryl|sodium bromebrate mebryl|sodium bromebrate http://purl.obolibrary.org/obo/CHEBI_135179 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135187 biolink:ChemicalEntity thenalidine cas:86-12-4|drugcentral:2617 Graph thenaldine|thenalidin|thenophenopiperidine thenaldine|thenalidin|thenophenopiperidine http://purl.obolibrary.org/obo/CHEBI_135187 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135192 biolink:ChemicalEntity chlorproguanil cas:537-21-3|drugcentral:620 Graph http://purl.obolibrary.org/obo/CHEBI_135192 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135200 biolink:ChemicalEntity adrafinil cas:63547-13-7|drugcentral:95 Graph CRL-40028|adrafinyl|benzhydrylsulfinylacetohydroxamic acid|olmifon CRL-40028|adrafinyl|benzhydrylsulfinylacetohydroxamic acid|olmifon http://purl.obolibrary.org/obo/CHEBI_135200 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135204 biolink:ChemicalEntity caramiphen cas:77-22-5|drugcentral:486 Graph caraminphen|caramiphen HCl|caramiphen edisilate|caramiphen hydrochloride caraminphen|caramiphen HCl|caramiphen edisilate|caramiphen hydrochloride http://purl.obolibrary.org/obo/CHEBI_135204 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135209 biolink:ChemicalEntity procaterol cas:72332-33-3|drugcentral:2273 Graph (+/-)-Procaterol|(R,S)-Procaterol (+/-)-Procaterol|(R,S)-Procaterol http://purl.obolibrary.org/obo/CHEBI_135209 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135212 biolink:ChemicalEntity befunolol cas:39552-01-7|drugcentral:295 Graph befunolol HCl|befunolol hydrochloride|bentos befunolol HCl|befunolol hydrochloride|bentos http://purl.obolibrary.org/obo/CHEBI_135212 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135215 biolink:ChemicalEntity lobenzarit cas:63329-53-3|drugcentral:1591 Graph http://purl.obolibrary.org/obo/CHEBI_135215 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135217 biolink:ChemicalEntity cloranolol cas:39563-28-5|drugcentral:710 Graph chloranolol|tobanum chloranolol|tobanum http://purl.obolibrary.org/obo/CHEBI_135217 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135222 biolink:ChemicalEntity dimetindene cas:5636-83-9|drugcentral:903|hmdb:HMDB0015691 Graph dimethindene|dimethindene maleate|dimetindene maleate dimethindene|dimethindene maleate|dimetindene maleate http://purl.obolibrary.org/obo/CHEBI_135222 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135223 biolink:ChemicalEntity perfosfamide cas:62435-42-1|drugcentral:3430 Graph hydroperoxycyclofosfamide hydroperoxycyclofosfamide http://purl.obolibrary.org/obo/CHEBI_135223 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135224 biolink:ChemicalEntity amitriptylinoxide cas:4317-14-0|drugcentral:181 Graph amitriptyline N-oxide|amitriptyline oxide amitriptyline N-oxide|amitriptyline oxide http://purl.obolibrary.org/obo/CHEBI_135224 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135228 biolink:ChemicalEntity budipine cas:57982-78-2|drugcentral:420 Graph http://purl.obolibrary.org/obo/CHEBI_135228 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135235 biolink:ChemicalEntity tiadenol cas:6964-20-1|drugcentral:2647 Graph finlipol|fonlipol|thiadenol|tiaterol finlipol|fonlipol|thiadenol|tiaterol http://purl.obolibrary.org/obo/CHEBI_135235 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135244 biolink:ChemicalEntity tertatolol cas:83688-84-0|drugcentral:2605|hmdb:HMDB0042026 Graph dl-Tertatolol dl-Tertatolol http://purl.obolibrary.org/obo/CHEBI_135244 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135254 biolink:ChemicalEntity fenclofenac cas:34645-84-6|drugcentral:1147 Graph fenclofenac sodium|flenac fenclofenac sodium|flenac http://purl.obolibrary.org/obo/CHEBI_135254 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135272 biolink:ChemicalEntity etifoxine cas:21715-46-8|drugcentral:1099 Graph etafenoxine|etafenoxine hydrochloride|etifoxin|etifoxine hydrochloride etafenoxine|etafenoxine hydrochloride|etifoxin|etifoxine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135272 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135276 biolink:ChemicalEntity dihydrocodeine cas:125-28-0|drugcentral:886 Graph codhydrine|cohydrin|dehacodin|dihydrocodeine bitartrate|dihydrocodeine phosphate|dihydroneopine|hydrocodeine|hydrocodin|parzone bitartrate codhydrine|cohydrin|dehacodin|dihydrocodeine bitartrate|dihydrocodeine phosphate|dihydroneopine|hydrocodeine|hydrocodin|parzone bitartrate http://purl.obolibrary.org/obo/CHEBI_135276 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135278 biolink:ChemicalEntity terizidone cas:25683-71-0|drugcentral:2602 Graph terivalidin|terizidon terivalidin|terizidon http://purl.obolibrary.org/obo/CHEBI_135278 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135283 biolink:ChemicalEntity methenolone cas:153-00-4|drugcentral:1743|hmdb:HMDB0041928 Graph metenolone|methenolon metenolone|methenolon http://purl.obolibrary.org/obo/CHEBI_135283 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135285 biolink:ChemicalEntity vildagliptin cas:274901-16-5|drugcentral:3642|hmdb:HMDB0015596 Graph NVP-LAF237|galvus|jalra|vildagliptin HCl|vildagliptin hydrochloride|xiliarx NVP-LAF237|galvus|jalra|vildagliptin HCl|vildagliptin hydrochloride|xiliarx http://purl.obolibrary.org/obo/CHEBI_135285 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135288 biolink:ChemicalEntity chlorphenoxamine cas:77-38-3|drugcentral:617|hmdb:HMDB0240223 Graph chlorphenoxamine hydrochloride chlorphenoxamine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135288 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135291 biolink:ChemicalEntity tilisolol cas:85136-71-6|drugcentral:2665 Graph selecal|tilisolol HCl|tilisolol hydrochloride selecal|tilisolol HCl|tilisolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135291 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135292 biolink:ChemicalEntity quinupramine cas:31721-17-2|drugcentral:2348 Graph kevopril|kinupril|quinupramine HCl|quinupramine hydrochloride|quinupramine monohydrochloride|quinupramine tartrate kevopril|kinupril|quinupramine HCl|quinupramine hydrochloride|quinupramine monohydrochloride|quinupramine tartrate http://purl.obolibrary.org/obo/CHEBI_135292 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135293 biolink:ChemicalEntity mesterolone cas:1424-00-6|drugcentral:3342|hmdb:HMDB0006036 Graph androviron|mesteranum|mestoranum androviron|mesteranum|mestoranum http://purl.obolibrary.org/obo/CHEBI_135293 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135295 biolink:ChemicalEntity delorazepam cas:2894-67-9|drugcentral:800 Graph chlordemethyldiazepam|chlordesmethyldiazepam|chlorodesmethyldiazepam chlordemethyldiazepam|chlordesmethyldiazepam|chlorodesmethyldiazepam http://purl.obolibrary.org/obo/CHEBI_135295 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135297 biolink:ChemicalEntity bucumolol cas:58409-59-9|drugcentral:418 Graph CS-359|bucumolol HCl|bucumolol hydrochloride CS-359|bucumolol HCl|bucumolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135297 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135314 biolink:ChemicalEntity indecainide cas:74517-78-5|drugcentral:1434|hmdb:HMDB0014338 Graph decabid|indecainide HCl|indecainide hydrochloride|ricainide decabid|indecainide HCl|indecainide hydrochloride|ricainide http://purl.obolibrary.org/obo/CHEBI_135314 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135316 biolink:ChemicalEntity liarozole cas:115575-11-6|drugcentral:3321 Graph R-75251|liarozole HCl|liarozole fumarate|liarozole hydrochloride|liarozole monohydrochloride R-75251|liarozole HCl|liarozole fumarate|liarozole hydrochloride|liarozole monohydrochloride http://purl.obolibrary.org/obo/CHEBI_135316 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135322 biolink:ChemicalEntity cetamolol cas:34919-98-7|drugcentral:3079 Graph cetamolol HCl|cetamolol hydrochloride cetamolol HCl|cetamolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135322 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135323 biolink:ChemicalEntity gestodene cas:60282-87-3|drugcentral:1291|hmdb:HMDB0015668 Graph gestinol gestinol http://purl.obolibrary.org/obo/CHEBI_135323 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135335 biolink:ChemicalEntity artemotil cas:75887-54-6|drugcentral:246 Graph arteether|dihydroartemisinin ethyl ether|dihydroqinghaosu ethyl ether arteether|dihydroartemisinin ethyl ether|dihydroqinghaosu ethyl ether http://purl.obolibrary.org/obo/CHEBI_135335 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135338 biolink:ChemicalEntity guggulsterone cas:95975-55-6|drugcentral:3953 Graph Z/E-Guggulsterone Z/E-Guggulsterone http://purl.obolibrary.org/obo/CHEBI_135338 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13534 biolink:ChemicalEntity acyl-carrier protein Graph ACP ACP http://purl.obolibrary.org/obo/CHEBI_13534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135340 biolink:ChemicalEntity benorilate cas:5003-48-5|drugcentral:310 Graph benoral|benortan|benorylate|fenasprate|quinexin benoral|benortan|benorylate|fenasprate|quinexin http://purl.obolibrary.org/obo/CHEBI_135340 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135342 biolink:ChemicalEntity reboxetine cas:71620-89-8|drugcentral:2361 Graph edronax|norebox|reboxetine mesilate|reboxetine mesylate|reboxitine edronax|norebox|reboxetine mesilate|reboxetine mesylate|reboxitine http://purl.obolibrary.org/obo/CHEBI_135342 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135343 biolink:ChemicalEntity oxyfedrine cas:15687-41-9|drugcentral:2030 Graph oxyfedrin|oxyfedrine HCl|oxyfedrine hydrochloride|oxyphedrine oxyfedrin|oxyfedrine HCl|oxyfedrine hydrochloride|oxyphedrine http://purl.obolibrary.org/obo/CHEBI_135343 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135349 biolink:ChemicalEntity mitiglinide cas:145375-43-5|drugcentral:1818 Graph KAD-1229|S 21403|mitiglinide calcium|mitiglinide calcium hydrate KAD-1229|S 21403|mitiglinide calcium|mitiglinide calcium hydrate http://purl.obolibrary.org/obo/CHEBI_135349 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135351 biolink:ChemicalEntity rotigotine cas:99755-59-6|drugcentral:2407 Graph (S)-(-)-Rotigotine|leganto|neupro (S)-(-)-Rotigotine|leganto|neupro http://purl.obolibrary.org/obo/CHEBI_135351 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135357 biolink:ChemicalEntity zimeldine cas:56775-88-3|drugcentral:2863 Graph cis-Zimelidine|zimeldine hydrochloride hydrate|zimelidine|zimelidine HCl|zimelidine dihydrochloride|zimelidine dihydrochloride hydrate|zimelidine dihydrochloride monohydrate|zimelidine hydrochloride cis-Zimelidine|zimeldine hydrochloride hydrate|zimelidine|zimelidine HCl|zimelidine dihydrochloride|zimelidine dihydrochloride hydrate|zimelidine dihydrochloride monohydrate|zimelidine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135357 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135359 biolink:ChemicalEntity denopamine cas:71771-90-9|drugcentral:806 Graph carguto|kalgut carguto|kalgut http://purl.obolibrary.org/obo/CHEBI_135359 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135361 biolink:ChemicalEntity methscopolamine cas:13265-10-6|drugcentral:1757|hmdb:HMDB0014605 Graph N-Methylhyoscine|N-Methylscopolamine|methscopolamine bromide|methscopolamine nitrate|methylscopolamine|methylscopolamine bromide N-Methylhyoscine|N-Methylscopolamine|methscopolamine bromide|methscopolamine nitrate|methylscopolamine|methylscopolamine bromide http://purl.obolibrary.org/obo/CHEBI_135361 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135370 biolink:ChemicalEntity aprindine cas:37640-71-4|drugcentral:231|hmdb:HMDB0015498 Graph amidonal|aprindin|aprindine HCl|aprindine hydrochloride|aprinidine|fiboran amidonal|aprindin|aprindine HCl|aprindine hydrochloride|aprinidine|fiboran http://purl.obolibrary.org/obo/CHEBI_135370 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135377 biolink:ChemicalEntity cicloprolol cas:94651-09-9|drugcentral:637 Graph cicloprolol HCl|cicloprolol hydrochloride|cycloprolol cicloprolol HCl|cicloprolol hydrochloride|cycloprolol http://purl.obolibrary.org/obo/CHEBI_135377 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135406 biolink:ChemicalEntity bornaprine cas:20448-86-6|drugcentral:390 Graph bornaprine HCl|bornaprine hydrochloride bornaprine HCl|bornaprine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135406 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135418 biolink:ChemicalEntity oxitropium cas:99571-64-9|drugcentral:2022 Graph oxitropium bromide|oxitropium iodide|oxytropium bromide oxitropium bromide|oxitropium iodide|oxytropium bromide http://purl.obolibrary.org/obo/CHEBI_135418 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135422 biolink:ChemicalEntity progabide cas:62666-20-0|drugcentral:2278 Graph gabren|gabrene|halogabide gabren|gabrene|halogabide http://purl.obolibrary.org/obo/CHEBI_135422 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135436 biolink:ChemicalEntity pirmenol cas:68252-19-7|drugcentral:2207|kegg.drug:D08394|pubmed:1375681|pubmed:1381764|pubmed:1708056|pubmed:1959843|pubmed:2019027|pubmed:2164163|pubmed:2352380|pubmed:2438922|pubmed:2466056|pubmed:3281517|pubmed:3281518|pubmed:3392237|pubmed:7053896|pubmed:7371711|pubmed:7952796 Graph pirmenol|pirmenolum|racemic pirmenol pirmenol|pirmenolum|racemic pirmenol http://purl.obolibrary.org/obo/CHEBI_135436 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135440 biolink:ChemicalEntity rociverine cas:53716-44-2|drugcentral:2395 Graph rilaten rilaten http://purl.obolibrary.org/obo/CHEBI_135440 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135445 biolink:ChemicalEntity canrenone cas:976-71-6|drugcentral:478|hmdb:HMDB0003033 Graph aldadiene|phanurane aldadiene|phanurane http://purl.obolibrary.org/obo/CHEBI_135445 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135459 biolink:ChemicalEntity clorotepine cas:13448-22-1|drugcentral:3912 Graph (+/-)-Clothepin|chlorothepin|clotepin|clothepin|octoclothepin|octoclothepine (+/-)-Clothepin|chlorothepin|clotepin|clothepin|octoclothepin|octoclothepine http://purl.obolibrary.org/obo/CHEBI_135459 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135466 biolink:ChemicalEntity nafamostat cas:81525-10-2|drugcentral:1867 Graph FUT-175|nafamostat HCl|nafamostat dihydrochloride|nafamostat hydrochloride|nafamostat mesilate|nafamostat mesylate|nafamstat|ronastat FUT-175|nafamostat HCl|nafamostat dihydrochloride|nafamostat hydrochloride|nafamostat mesilate|nafamostat mesylate|nafamstat|ronastat http://purl.obolibrary.org/obo/CHEBI_135466 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135470 biolink:ChemicalEntity indoramin cas:26844-12-2|drugcentral:1443 Graph Wy 21901|Wy-21901|Wy21901|indoramine Wy 21901|Wy-21901|Wy21901|indoramine http://purl.obolibrary.org/obo/CHEBI_135470 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135479 biolink:ChemicalEntity dipipanone cas:467-83-4|drugcentral:921 Graph dipipanon|piperidylamidone dipipanon|piperidylamidone http://purl.obolibrary.org/obo/CHEBI_135479 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135483 biolink:ChemicalEntity pipoxolan cas:23744-24-3|drugcentral:2194 Graph http://purl.obolibrary.org/obo/CHEBI_135483 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135486 biolink:ChemicalEntity posatirelin cas:78664-73-0|drugcentral:3484 Graph RGH-2202|posatireline|pyladox RGH-2202|posatireline|pyladox http://purl.obolibrary.org/obo/CHEBI_135486 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135491 biolink:ChemicalEntity acetylmethadol cas:509-74-0|drugcentral:1729|hmdb:HMDB0015502 Graph acemethadone|acetmethadon|acetylmethadone|methadyl|methadyl acetate acemethadone|acetmethadon|acetylmethadone|methadyl|methadyl acetate http://purl.obolibrary.org/obo/CHEBI_135491 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135499 biolink:ChemicalEntity xipamide cas:14293-44-8|drugcentral:2853 Graph chronexan|diurex|diurexan chronexan|diurex|diurexan http://purl.obolibrary.org/obo/CHEBI_135499 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135507 biolink:ChemicalEntity dopexamine cas:86197-47-9|drugcentral:948|hmdb:HMDB0041882 Graph http://purl.obolibrary.org/obo/CHEBI_135507 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135511 biolink:ChemicalEntity rebeccamycin beilstein:4732638|cas:93908-02-2 Graph 1,11-dichloro-12-(4-O-methyl-beta-D-glucopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione|rebeccamycin 1,11-dichloro-12-(4-O-methyl-beta-D-glucopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione 1,11-dichloro-12-(4-O-methyl-beta-D-glucopyranosyl)-12,13-dihydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione|rebeccamycin http://purl.obolibrary.org/obo/CHEBI_135511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135514 biolink:ChemicalEntity chlorisondamine cas:69-27-2|drugcentral:598 Graph chlorisondamin|chlorisondamine chloride|ecolid|ecolid chloride|hisindamon chlorisondamin|chlorisondamine chloride|ecolid|ecolid chloride|hisindamon http://purl.obolibrary.org/obo/CHEBI_135514 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135525 biolink:ChemicalEntity carbocromen cas:804-10-4|drugcentral:3098 Graph carbochromen|carbochromene|carbocromene|chromonar|chromonar HCl|chromonar hydrochloride carbochromen|carbochromene|carbocromene|chromonar|chromonar HCl|chromonar hydrochloride http://purl.obolibrary.org/obo/CHEBI_135525 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135531 biolink:ChemicalEntity dexetimide cas:21888-98-2|drugcentral:831 Graph dexbenzetimide dexbenzetimide http://purl.obolibrary.org/obo/CHEBI_135531 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135544 biolink:ChemicalEntity ilaprazole cas:172152-36-2|drugcentral:3961 Graph IY 81149|IY-81149|IY81149|noltec IY 81149|IY-81149|IY81149|noltec http://purl.obolibrary.org/obo/CHEBI_135544 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135550 biolink:ChemicalEntity phenoperidine cas:562-26-5|drugcentral:3441 Graph fenoperidina|fenoperidine|phenoperidin|phenoperidine HCl|phenoperidine hydrochloride fenoperidina|fenoperidine|phenoperidin|phenoperidine HCl|phenoperidine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135550 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135552 biolink:ChemicalEntity prucalopride cas:179474-81-8|drugcentral:3502 Graph R093877|prucalopride succinate|resolor R093877|prucalopride succinate|resolor http://purl.obolibrary.org/obo/CHEBI_135552 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135554 biolink:ChemicalEntity pyritinol cas:1098-97-1|drugcentral:2333 Graph Vitamin B6 disulfide|bonifen|dipyridoxolyl disulfide|encefabol|piritinol|pyridoxine disulfide|pyrithioxin Vitamin B6 disulfide|bonifen|dipyridoxolyl disulfide|encefabol|piritinol|pyridoxine disulfide|pyrithioxin http://purl.obolibrary.org/obo/CHEBI_135554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135560 biolink:ChemicalEntity prajmalium cas:35080-11-6|drugcentral:2230 Graph N-Propylajmaline|N-Propylajmalinium|N4-Propylajmalinium|prajmaline|prajmaline bitartrate N-Propylajmaline|N-Propylajmalinium|N4-Propylajmalinium|prajmaline|prajmaline bitartrate http://purl.obolibrary.org/obo/CHEBI_135560 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135566 biolink:ChemicalEntity rimexolone cas:49697-38-3|drugcentral:2384 Graph rimexel|trimexolone rimexel|trimexolone http://purl.obolibrary.org/obo/CHEBI_135566 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135569 biolink:ChemicalEntity arotinolol cas:68377-92-4|drugcentral:243 Graph arotinolol HCl|arotinolol hydrochloride arotinolol HCl|arotinolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135569 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135574 biolink:ChemicalEntity nabilone cas:51022-71-0|drugcentral:1862 Graph LY 109514|LY-109514|cesamet LY 109514|LY-109514|cesamet http://purl.obolibrary.org/obo/CHEBI_135574 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135576 biolink:ChemicalEntity bunazosin cas:80755-51-7|drugcentral:429 Graph bunazosin HCl|bunazosin hydrochloride|detantol bunazosin HCl|bunazosin hydrochloride|detantol http://purl.obolibrary.org/obo/CHEBI_135576 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135578 biolink:ChemicalEntity cicaprost cas:94079-80-8|drugcentral:631 Graph ZK-96480|cicaprost betadex|cicaprost dihydrochloride ZK-96480|cicaprost betadex|cicaprost dihydrochloride http://purl.obolibrary.org/obo/CHEBI_135578 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135581 biolink:ChemicalEntity fluocortolone cas:152-97-6|drugcentral:1206 Graph flucortolone|fluocortolon flucortolone|fluocortolon http://purl.obolibrary.org/obo/CHEBI_135581 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135585 biolink:ChemicalEntity sulfinalol cas:66264-77-5|drugcentral:3568 Graph sulfinalol HCl|sulfinalol hydrochloride sulfinalol HCl|sulfinalol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135585 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135589 biolink:ChemicalEntity etoperidone cas:52942-31-1|drugcentral:1111 Graph clopradone|etoperidone HCl|etoperidone hydrochloride|triazolinone clopradone|etoperidone HCl|etoperidone hydrochloride|triazolinone http://purl.obolibrary.org/obo/CHEBI_135589 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135590 biolink:ChemicalEntity ambroxol cas:18683-91-5|drugcentral:147 Graph ambroxils|ambroxol HCl|ambroxol hydrochloride|lasolvan ambroxils|ambroxol HCl|ambroxol hydrochloride|lasolvan http://purl.obolibrary.org/obo/CHEBI_135590 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135594 biolink:ChemicalEntity limaprost cas:74397-12-9|drugcentral:1581 Graph http://purl.obolibrary.org/obo/CHEBI_135594 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135600 biolink:ChemicalEntity veralipride cas:66644-81-3|drugcentral:2814 Graph (+/-)-Veralipride (+/-)-Veralipride http://purl.obolibrary.org/obo/CHEBI_135600 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135627 biolink:ChemicalEntity quinagolide cas:87056-78-8|drugcentral:2339 Graph norprolac norprolac http://purl.obolibrary.org/obo/CHEBI_135627 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135628 biolink:ChemicalEntity cloricromen cas:68206-94-0|drugcentral:713 Graph AD6|cloricromen hydrochloride|cloricromene|proendotel AD6|cloricromen hydrochloride|cloricromene|proendotel http://purl.obolibrary.org/obo/CHEBI_135628 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135632 biolink:ChemicalEntity camostat A benzoate ester resulting from the formal condensation of the carboxy group of 4-guanidinobenzoic acid with the hydroxy group of 2-(dimethylamino)-2-oxoethyl (4-hydroxyphenyl)acetate. It is a potent inhibitor of the human transmembrane protease serine 2 (TMPRSS2) and its mesylate salt is currently under investigation for its effectiveness in COVID-19 patients. cas:59721-28-7|chemspider:2440|drugbank:DB13729|drugcentral:471|kegg.drug:D07606|pmc:PMC7809394|pubmed:23412700|pubmed:26166259|pubmed:26887332|pubmed:33176395|pubmed:33225308|pubmed:33505639|pubmed:33564221|pubmed:33676899|pubmed:7341342|wikipedia.en:Camostat Graph 4-{2-[(dimethylcarbamoyl)methoxy]-2-oxoethyl}phenyl 4-carbamimidamidobenzoate|4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenyl 4-carbamimidamidobenzoate|N,N-dimethylcarbamoylmethyl 4-(4-guanidinobenzoyloxy)phenylacetate|camostat|camostatum 4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenyl 4-carbamimidamidobenzoate 4-{2-[(dimethylcarbamoyl)methoxy]-2-oxoethyl}phenyl 4-carbamimidamidobenzoate|4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenyl 4-carbamimidamidobenzoate|N,N-dimethylcarbamoylmethyl 4-(4-guanidinobenzoyloxy)phenylacetate|camostat|camostatum http://purl.obolibrary.org/obo/CHEBI_135632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135633 biolink:ChemicalEntity beraprost An organic heterotricyclic compound that is (3aS,8bS)-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan in which the hydrogens at positions 1R, 2R and 5 are replaced by (3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl, hydroxy and 3-carboxypropyl groups, respectively. It is a prostaglandin receptor agonist which is approved to treat pulmonary arterial hypertension in Asia. cas:88430-50-6|chemspider:5293169|drugbank:DB05229|drugcentral:343|kegg.drug:D02720|pubmed:11411125|pubmed:12821234|pubmed:15006984|pubmed:18378784|pubmed:26734111|pubmed:26825901|pubmed:27461927|pubmed:28231006|pubmed:28399721|pubmed:28476928|pubmed:29755548|pubmed:30276833|pubmed:31008926|pubmed:31158340|pubmed:31189158|pubmed:33235027|pubmed:3913423|pubmed:7596955|wikipedia.en:Beraprost Graph 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoic acid|MDL 201229|MDL-201229|MDL201229|ML 1229|ML-1229|ML1229|beraprost|beraprostum 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoic acid 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoic acid|MDL 201229|MDL-201229|MDL201229|ML 1229|ML-1229|ML1229|beraprost|beraprostum http://purl.obolibrary.org/obo/CHEBI_135633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135636 biolink:ChemicalEntity fursultiamine cas:804-30-8|drugcentral:1259 Graph diteftin|fursultiamin|fursultiamine HCl|fursultiamine hydrochloride|tetrahydrofurfuryl thiamine disulfide|thiamin tetrahydrofurfuryl disulfide|thiamine tetrahydrofurfuryl disulfide diteftin|fursultiamin|fursultiamine HCl|fursultiamine hydrochloride|tetrahydrofurfuryl thiamine disulfide|thiamin tetrahydrofurfuryl disulfide|thiamine tetrahydrofurfuryl disulfide http://purl.obolibrary.org/obo/CHEBI_135636 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135642 biolink:ChemicalEntity cinitapride cas:66564-14-5|drugcentral:652|hmdb:HMDB0015698 Graph cinitapride tartrate|paxapride|rogastril cinitapride tartrate|paxapride|rogastril http://purl.obolibrary.org/obo/CHEBI_135642 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135649 biolink:ChemicalEntity alpidem cas:82626-01-5|drugcentral:134 Graph ananxyl ananxyl http://purl.obolibrary.org/obo/CHEBI_135649 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135652 biolink:ChemicalEntity flunarizine cas:52468-60-7|drugcentral:1200|hmdb:HMDB0015589 Graph flunarizine HCl|flunarizine dihydrochloride|flunarizine hydrochloride|sibelium flunarizine HCl|flunarizine dihydrochloride|flunarizine hydrochloride|sibelium http://purl.obolibrary.org/obo/CHEBI_135652 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135654 biolink:ChemicalEntity imidapril A member of the class of imidazolidines that is (4S)-1-methyl-2-oxoimidazolidine-4-carboxylic acid in which the hydrogen of the imidazolidine nitrogen has been substituted by (1S)-1-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}ethyl group. It is the prodrug for imidaprilat, an ACE inhibitor used for the treatment of chronic heart failure. cas:89371-37-9|cba:639749|drugbank:DB11783|drugcentral:1424|hmdb:HMDB0041907|kegg.drug:D08068|pubmed:17094051|pubmed:20364557|pubmed:23161146|pubmed:28044266|reaxys:4847938|vsdb:1837|wikipedia.en:Imidapril Graph (4S)-1-methyl-3-[(2S)-2-[N-((1S)-1-ethoxycarbonyl-3-phenylpropyl)amino]propionyl]-2-oxo-imidazolidine-4-carboxylic acid|(4S)-3-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid|(S)-3-(N-((S)-1-Ethoxycarbonyl-3-phenylpropyl)-L-alanyl)-1-methyl-2-oxoimidazoline-4-carboxylic acid|imidapril|imidaprilum|tanatril (4S)-3-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid (4S)-1-methyl-3-[(2S)-2-[N-((1S)-1-ethoxycarbonyl-3-phenylpropyl)amino]propionyl]-2-oxo-imidazolidine-4-carboxylic acid|(4S)-3-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid|(S)-3-(N-((S)-1-Ethoxycarbonyl-3-phenylpropyl)-L-alanyl)-1-methyl-2-oxoimidazoline-4-carboxylic acid|imidapril|imidaprilum|tanatril http://purl.obolibrary.org/obo/CHEBI_135654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135660 biolink:ChemicalEntity omapatrilat cas:167305-00-2|drugcentral:1989 Graph BMS-186716 BMS-186716 http://purl.obolibrary.org/obo/CHEBI_135660 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135679 biolink:ChemicalEntity levocabastine cas:79516-68-0|drugcentral:1564 Graph levocabastine HCl|levocabastine hydrochloride|levophta|livostin levocabastine HCl|levocabastine hydrochloride|levophta|livostin http://purl.obolibrary.org/obo/CHEBI_135679 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135682 biolink:ChemicalEntity mopidamol cas:13665-88-8|drugcentral:1838 Graph RA-233|rapenton RA-233|rapenton http://purl.obolibrary.org/obo/CHEBI_135682 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135686 biolink:ChemicalEntity alvimopan cas:156053-89-3|drugcentral:143|hmdb:HMDB0015631 Graph LY-246736|LY246736|alvimopan anhydrous|alvimopan dihydrate|entereg LY-246736|LY246736|alvimopan anhydrous|alvimopan dihydrate|entereg http://purl.obolibrary.org/obo/CHEBI_135686 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135697 biolink:ChemicalEntity sarpogrelate cas:125926-17-2|drugcentral:2423 Graph MCI-9042|anplag|sarpogrelate HCl|sarpogrelate hydrochloride MCI-9042|anplag|sarpogrelate HCl|sarpogrelate hydrochloride http://purl.obolibrary.org/obo/CHEBI_135697 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135699 biolink:ChemicalEntity piritramide cas:302-41-0|drugcentral:3478|hmdb:HMDB0041990 Graph dipidolor|dipiritramide|pirdolan|piridolan|pirinitramide dipidolor|dipiritramide|pirdolan|piridolan|pirinitramide http://purl.obolibrary.org/obo/CHEBI_135699 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135702 biolink:ChemicalEntity belotecan cas:256411-32-2|drugcentral:296 Graph CKD-602|CKD602|belotecan hydrochloride|camtobell CKD-602|CKD602|belotecan hydrochloride|camtobell http://purl.obolibrary.org/obo/CHEBI_135702 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135704 biolink:ChemicalEntity sivelestat cas:127373-66-4|drugcentral:2452 Graph http://purl.obolibrary.org/obo/CHEBI_135704 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135710 biolink:ChemicalEntity trimazosin cas:35795-16-5|drugcentral:2747 Graph rimazosin hydrochloride monohydrate|trimazosin HCl|trimazosin hydrochloride rimazosin hydrochloride monohydrate|trimazosin HCl|trimazosin hydrochloride http://purl.obolibrary.org/obo/CHEBI_135710 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135720 biolink:ChemicalEntity deflazacort cas:14484-47-0|drugcentral:793 Graph azacort|azacortinol|calcort|dezacor|dezacort|flantadin|lantadin|oxazacort azacort|azacortinol|calcort|dezacor|dezacort|flantadin|lantadin|oxazacort http://purl.obolibrary.org/obo/CHEBI_135720 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135735 biolink:ChemicalEntity delapril cas:83435-66-9|drugcentral:798 Graph CV-3317|alindapril|indalapril CV-3317|alindapril|indalapril http://purl.obolibrary.org/obo/CHEBI_135735 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135737 biolink:ChemicalEntity lacidipine cas:103890-78-4|drugcentral:1532 Graph GR-43659X|lacipil|lacirex|motens GR-43659X|lacipil|lacirex|motens http://purl.obolibrary.org/obo/CHEBI_135737 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135738 biolink:ChemicalEntity clevidipine cas:167221-71-8|drugcentral:674 Graph clevelox|cleviprex clevelox|cleviprex http://purl.obolibrary.org/obo/CHEBI_135738 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135741 biolink:ChemicalEntity testosterone undecanoate cas:5949-44-0|drugcentral:2608 Graph testosterone undecylate testosterone undecylate http://purl.obolibrary.org/obo/CHEBI_135741 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135742 biolink:ChemicalEntity ormeloxifene cas:31477-60-8|drugcentral:570 Graph centchroman|centron|ormeloxifen centchroman|centron|ormeloxifen http://purl.obolibrary.org/obo/CHEBI_135742 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135745 biolink:ChemicalEntity prednisolone succinate A hemisuccinate resulting from the formal condensation of the 21-hydroxy group prednisolone with one of the carboxy groups of succinic acid. It is used to treat mild to moderate non-infectious eye allergies and inflammation, including damage caused by chemical and thermal burns. cas:2920-86-7|drugbank:DB14633|drugcentral:2246|kegg.drug:D02156|lincs.smallmolecule:LSM-36396|pubmed:1029643|pubmed:10959575|pubmed:11446168|pubmed:1235505|pubmed:13371916|pubmed:13439215|pubmed:13704303|pubmed:13822491|pubmed:14483331|pubmed:2253583|pubmed:29175410|pubmed:3213042|pubmed:3441354|pubmed:3580023|pubmed:3964328|pubmed:3994138|pubmed:4084667|pubmed:4433653 Graph 11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione 21-hemisuccinate|4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoic acid|Delta(1)-hydrocortisone 21-hemisuccinate|Delta(1)-hydrocortisone succinate|Prednisolut|prednisolone 21-(hydrogen succinate)|prednisolone 21-hemisuccinate|prednisolone 21-succinate|prednisolone bisuccinate|prednisolone hemisuccinate 4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoic acid 11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione 21-hemisuccinate|4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoic acid|Delta(1)-hydrocortisone 21-hemisuccinate|Delta(1)-hydrocortisone succinate|Prednisolut|prednisolone 21-(hydrogen succinate)|prednisolone 21-hemisuccinate|prednisolone 21-succinate|prednisolone bisuccinate|prednisolone hemisuccinate http://purl.obolibrary.org/obo/CHEBI_135745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135747 biolink:ChemicalEntity dexloxiglumide cas:119817-90-2|drugcentral:834 Graph D-Loxiglumide D-Loxiglumide http://purl.obolibrary.org/obo/CHEBI_135747 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135752 biolink:ChemicalEntity tafenoquine A racemate comprising equimolar amounts of (R)- and (S)-tafenoquine. cas:106635-80-7|drugbank:DB06608|drugcentral:3578|kegg.drug:D10490|pubmed:23701202|pubmed:25663384|pubmed:25870069|pubmed:25891812|pubmed:25921416|pubmed:26187807|pubmed:26195527|pubmed:26500351|pubmed:26610844|pubmed:26888075|pubmed:27405118|pubmed:27528800|pubmed:27697758|pubmed:27855400|pubmed:28043395|pubmed:28214869|pubmed:28319724|pubmed:28495354|pubmed:28495355|pubmed:28526056|pubmed:28749773|pubmed:29121061|pubmed:29677199|pubmed:29869298|reaxys:6493037|wikipedia.en:Tafenoquine Graph Arakoda|Krintafel|WR 238,605|WR238605|etaquine|rac-N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine|tafenoquina|tafenoquine|tafenoquinum rac-N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine Arakoda|Krintafel|WR 238,605|WR238605|etaquine|rac-N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine|tafenoquina|tafenoquine|tafenoquinum http://purl.obolibrary.org/obo/CHEBI_135752 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135753 biolink:ChemicalEntity asulacrine cas:80841-47-0|drugcentral:252 Graph amsalog amsalog http://purl.obolibrary.org/obo/CHEBI_135753 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135754 biolink:ChemicalEntity loprazolam cas:61197-73-7|drugcentral:1602 Graph loprazolam mesilate|loprazolam mesylate loprazolam mesilate|loprazolam mesylate http://purl.obolibrary.org/obo/CHEBI_135754 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135755 biolink:ChemicalEntity sulprostone cas:60325-46-4|drugcentral:2538 Graph sulproston sulproston http://purl.obolibrary.org/obo/CHEBI_135755 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135756 biolink:ChemicalEntity spirapril An azaspiro compound resulting from the formal condensation of the amino group of (8S)-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid with the carboxy group of N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanine. It is a prodrug for the antihypertensive drug spiraprilat. cas:83647-97-6|drugbank:DB01348|drugcentral:2474|hmdb:HMDB0015438|kegg.drug:D08529|pubmed:10499560|pubmed:10499561|pubmed:12613273|pubmed:8638865|pubmed:9345854|reaxys:4277924|wikipedia.en:Spirapril Graph (8S)-7-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid (8S)-7-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid (8S)-7-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_135756 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135757 biolink:ChemicalEntity edatrexate cas:80576-83-6|drugcentral:986 Graph http://purl.obolibrary.org/obo/CHEBI_135757 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135762 biolink:ChemicalEntity methylprednisolone aceponate cas:86401-95-8|drugcentral:1769 Graph advantan advantan http://purl.obolibrary.org/obo/CHEBI_135762 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135765 biolink:ChemicalEntity methylprednisolone succinate cas:2921-57-5|drugcentral:1771 Graph methylprednisolone hemisuccinate|methylprednisolone sodium succinate methylprednisolone hemisuccinate|methylprednisolone sodium succinate http://purl.obolibrary.org/obo/CHEBI_135765 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135774 biolink:ChemicalEntity ebrotidine cas:100981-43-9|drugcentral:979|hmdb:HMDB0041885 Graph FI-3542|ebrodin|ulsanic FI-3542|ebrodin|ulsanic http://purl.obolibrary.org/obo/CHEBI_135774 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135777 biolink:ChemicalEntity (S)-nicardipine The S-enantiomer of nicardipine. cas:76093-36-2|chemspider:5036700|drugcentral:5|pubmed:10204680|pubmed:15832820|pubmed:3023614|pubmed:3350056|pubmed:7503807|pubmed:8641321|pubmed:9367206 Graph (+)-nicardipine|(S)-YC-93 free base|2-[benzyl(methyl)amino]ethyl methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|S-(+)-nicardipine 2-[benzyl(methyl)amino]ethyl methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate (+)-nicardipine|(S)-YC-93 free base|2-[benzyl(methyl)amino]ethyl methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|S-(+)-nicardipine http://purl.obolibrary.org/obo/CHEBI_135777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135778 biolink:ChemicalEntity clocapramine cas:47739-98-0|drugcentral:687 Graph clocapramine HCl|clocapramine hydrochloride|clocarpramine clocapramine HCl|clocapramine hydrochloride|clocarpramine http://purl.obolibrary.org/obo/CHEBI_135778 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135781 biolink:ChemicalEntity fentonium cas:5868-06-4|drugcentral:1167 Graph fentonium bromide|phenthonium|phenthonium bromide|phentonium|phentonium bromide fentonium bromide|phenthonium|phenthonium bromide|phentonium|phentonium bromide http://purl.obolibrary.org/obo/CHEBI_135781 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135791 biolink:ChemicalEntity prednicarbate cas:73771-04-7|drugcentral:2243 Graph prednitop prednitop http://purl.obolibrary.org/obo/CHEBI_135791 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135793 biolink:ChemicalEntity barnidipine cas:104713-75-9|drugcentral:290 Graph mepirodipine|mepirodipine hydrobromide|mepirodipine hydrochloride|vasexten mepirodipine|mepirodipine hydrobromide|mepirodipine hydrochloride|vasexten http://purl.obolibrary.org/obo/CHEBI_135793 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135798 biolink:ChemicalEntity betamethasone benzoate cas:22298-29-9|drugcentral:351 Graph betamethasone 17-benzoate betamethasone 17-benzoate http://purl.obolibrary.org/obo/CHEBI_135798 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135806 biolink:ChemicalEntity benidipine cas:105979-17-7|drugcentral:3880 Graph benidipine HCl|benidipine hydrochloride|coniel benidipine HCl|benidipine hydrochloride|coniel http://purl.obolibrary.org/obo/CHEBI_135806 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135809 biolink:ChemicalEntity landiolol cas:133242-30-5|drugcentral:1545 Graph landiolol HCl|landiolol hydrochloride landiolol HCl|landiolol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135809 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135810 biolink:ChemicalEntity atrasentan A member of the class of pyrrolidines that is pyrrolidine substituted by 2-(dibutylamino)-2-oxoethyl, 4-methoxyphenyl, carboxy, and 1,3-benzodioxol-5-yl groups at positions 1, 2, 3, and 4, respectively (the 2R,3R,4S-stereoisomer). It is an endothelin endothelin type A receptor antagonist used to reduce proteinuria in adults with primary immunoglobulin A nephropathy. cas:173937-91-2|drugbank:DB06199|pubmed:10610291|pubmed:11739244|pubmed:12193124|pubmed:17440096|pubmed:19717985|pubmed:25189702|pubmed:28230089|pubmed:30098343|pubmed:30198212|pubmed:30217875|pubmed:31982064|pubmed:31982065|pubmed:31982067|pubmed:32195223|pubmed:34853062|pubmed:34853063|pubmed:35119336|pubmed:35772861|pubmed:35892316|pubmed:37139863|pubmed:37157922|pubmed:37235521|pubmed:37657768|pubmed:37716952|pubmed:37820676|pubmed:37981428|pubmed:38969296|pubmed:39460694|pubmed:39503150|pubmed:39661119|pubmed:39798547|pubmed:39810771|pubmed:40245183|pubmed:40303226|wikipedia.en:Atrasentan Graph (+)-A 127722|(+)-A-127722|(+)-A127722|(2R, 3R, 4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid|(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid|(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid|A 147627|A-147627|ABT 627|ABT-627|ABT627|atrasentan|atrasentanum (2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid (+)-A 127722|(+)-A-127722|(+)-A127722|(2R, 3R, 4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid|(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid|(2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid|A 147627|A-147627|ABT 627|ABT-627|ABT627|atrasentan|atrasentanum http://purl.obolibrary.org/obo/CHEBI_135810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135813 biolink:ChemicalEntity flomoxef A second-generation oxacephem antibiotic in which the oxazine ring is substituted at C-3 with a hydroxyethyl-substituted tetrazolylthiomethyl group and the azetidinone ring carries 7α-methoxy and 7β-{2-[(difluoromethyl)thiomethyl]acetamido} substituents. cas:99665-00-6|drugbank:DB11935|drugcentral:1179|kegg.drug:D07963|pubmed:12803802|pubmed:18606583|pubmed:25694055|pubmed:26100708|pubmed:26387064|pubmed:28543395|pubmed:29017833|reaxys:6993219|wikipedia.en:Flomoxef Graph (6R,7R)-7-{2-[(difluoromethyl)sulfanyl]acetamido}-3-({[1-(2-hydroxyethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-7-methoxy-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|FMOX|flomoxef|flomoxefum (6R,7R)-7-{2-[(difluoromethyl)sulfanyl]acetamido}-3-({[1-(2-hydroxyethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-7-methoxy-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-7-{2-[(difluoromethyl)sulfanyl]acetamido}-3-({[1-(2-hydroxyethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-7-methoxy-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|FMOX|flomoxef|flomoxefum http://purl.obolibrary.org/obo/CHEBI_135813 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135841 biolink:ChemicalEntity antrafenine cas:55300-29-3|drugcentral:3677|hmdb:HMDB0015488 Graph antrafenine dihydrochloride|antrafenine hydrochloride|stakane antrafenine dihydrochloride|antrafenine hydrochloride|stakane http://purl.obolibrary.org/obo/CHEBI_135841 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135849 biolink:ChemicalEntity manidipine cas:89226-50-6|drugcentral:1631 Graph (+/-)-Manidipine|franidipine|manidipine HCl|manidipine dihydrochloride|manidipine hydrochloride (+/-)-Manidipine|franidipine|manidipine HCl|manidipine dihydrochloride|manidipine hydrochloride http://purl.obolibrary.org/obo/CHEBI_135849 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135853 biolink:ChemicalEntity tirilazad cas:110101-66-1|drugcentral:4063 Graph freedox|tirilazad mesilate|tirilazad mesylate freedox|tirilazad mesilate|tirilazad mesylate http://purl.obolibrary.org/obo/CHEBI_135853 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135856 biolink:ChemicalEntity cefbuperazone A second-generation cephamycin antibiotic having [(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl and {N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino side groups located at positions 3 and 7β respectively. cas:76610-84-9|drugcentral:3072|kegg.drug:D03423|pubmed:29017833|pubmed:8904147|wikipedia.en:Cefbuperazone Graph (6R,7S)-7-({N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7S)-7-({N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydrocepham-4-carboxylic acid|CBPZ|cefbuperazona|cefbuperazone|cefbuperazonum|cerbuperazone (7S)-7-({N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydrocepham-4-carboxylic acid (6R,7S)-7-({N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7S)-7-({N-[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]-D-threonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydrocepham-4-carboxylic acid|CBPZ|cefbuperazona|cefbuperazone|cefbuperazonum|cerbuperazone http://purl.obolibrary.org/obo/CHEBI_135856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135859 biolink:ChemicalEntity efonidipine A racemate comprising of equimolar amounts of (R)- and (S)-efonidipine. It is a antihypertensive drug and a dual T-type and L-type calcium channel blocker. cas:111011-63-3|drugbank:DB09235|drugcentral:992|kegg.drug:D07886|pubmed:15545287|pubmed:17917316|pubmed:18719740|pubmed:20520612|pubmed:20558909|pubmed:21757861|pubmed:21897055|pubmed:22210483|pubmed:2241414|pubmed:22563334|pubmed:25462114|pubmed:27553261|pubmed:29748130|pubmed:30981510|pubmed:31669736|pubmed:31979744|wikipedia.en:Efonidipine Graph (+-)-efonidipine|NZ-105|NZ105|efonidipine|efonidipino|efonidipinum|rac-2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|rac-efonidipine|racemic efonidipine rac-2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate (+-)-efonidipine|NZ-105|NZ105|efonidipine|efonidipino|efonidipinum|rac-2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|rac-efonidipine|racemic efonidipine http://purl.obolibrary.org/obo/CHEBI_135859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135863 biolink:ChemicalEntity zorubicin cas:54083-22-6|drugcentral:2874 Graph daunomycin benzoylhydrazone|rubidazon|rubidazone daunomycin benzoylhydrazone|rubidazon|rubidazone http://purl.obolibrary.org/obo/CHEBI_135863 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135870 biolink:ChemicalEntity thymopentin cas:69558-55-0|drugcentral:2645 Graph thymopoietin 32-36|thymopoietin pentapeptide thymopoietin 32-36|thymopoietin pentapeptide http://purl.obolibrary.org/obo/CHEBI_135870 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135885 biolink:ChemicalEntity metildigoxin cas:30685-43-9|drugcentral:1761 Graph 4'''-Methyldigoxin|beta-Methyldigoxin|lanirapid|lanitop|medigoxin|methyldigoxin 4'''-Methyldigoxin|beta-Methyldigoxin|lanirapid|lanitop|medigoxin|methyldigoxin http://purl.obolibrary.org/obo/CHEBI_135885 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135888 biolink:ChemicalEntity pimecrolimus cas:137071-32-0|drugcentral:2168 Graph elidel|picrolimus elidel|picrolimus http://purl.obolibrary.org/obo/CHEBI_135888 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135894 biolink:ChemicalEntity saralasin cas:34273-10-4|drugcentral:3542 Graph aralasin|saralasin acetate|saralasin acetate hydrate aralasin|saralasin acetate|saralasin acetate hydrate http://purl.obolibrary.org/obo/CHEBI_135894 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135897 biolink:ChemicalEntity zotarolimus cas:221877-54-9|drugcentral:2949 Graph ABT-578|ABT578 ABT-578|ABT578 http://purl.obolibrary.org/obo/CHEBI_135897 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135898 biolink:ChemicalEntity lanatoside C cas:17575-22-3|drugcentral:1543 Graph Digilanide C|Digilanogen C|Lanatigen C|allocor|cedilanid|ceglunat|ceglunate|celadigal|celanid|celanide|cetosanol|isolanid|isolanide Digilanide C|Digilanogen C|Lanatigen C|allocor|cedilanid|ceglunat|ceglunate|celadigal|celanid|celanide|cetosanol|isolanid|isolanide http://purl.obolibrary.org/obo/CHEBI_135898 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135899 biolink:ChemicalEntity atosiban cas:90779-69-4|drugcentral:3008 Graph Antocin II|antocin|atosiban acetate|tractocil|tractocile Antocin II|antocin|atosiban acetate|tractocil|tractocile http://purl.obolibrary.org/obo/CHEBI_135899 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135901 biolink:ChemicalEntity lanreotide cas:108736-35-2|drugcentral:1546 Graph angiopeptin|ipstyl|lanreotide acetate|lanreotide autogel|somatulin-autogel|somatuline angiopeptin|ipstyl|lanreotide acetate|lanreotide autogel|somatulin-autogel|somatuline http://purl.obolibrary.org/obo/CHEBI_135901 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135905 biolink:ChemicalEntity terlipressin cas:14636-12-5|drugcentral:2967|hmdb:HMDB0015569 Graph Triglycyl-8-lysine-vasopressin|glycylpressin|glypressin|remestyp Triglycyl-8-lysine-vasopressin|glycylpressin|glypressin|remestyp http://purl.obolibrary.org/obo/CHEBI_135905 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135907 biolink:ChemicalEntity buserelin cas:57982-77-1|drugcentral:436 Graph etilamide|receptal etilamide|receptal http://purl.obolibrary.org/obo/CHEBI_135907 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135915 biolink:ChemicalEntity thymalfasin cas:62304-98-7|drugcentral:2643 Graph Thymosin alpha1|zadaxin Thymosin alpha1|zadaxin http://purl.obolibrary.org/obo/CHEBI_135915 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135923 biolink:ChemicalEntity migalastat cas:108147-54-2|drugcentral:5110 Graph 1-Deoxygalactonojirimycin|1-Deoxygalactonojirimycin hydrochloride|GR181413A|galafold|migalastat HCl|migalastat hydrochloride 1-Deoxygalactonojirimycin|1-Deoxygalactonojirimycin hydrochloride|GR181413A|galafold|migalastat HCl|migalastat hydrochloride http://purl.obolibrary.org/obo/CHEBI_135923 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135926 biolink:ChemicalEntity udenafil cas:268203-93-6|drugcentral:4141|hmdb:HMDB0015628 Graph DA-8159|zydena DA-8159|zydena http://purl.obolibrary.org/obo/CHEBI_135926 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135928 biolink:ChemicalEntity doripenem cas:148016-81-3|drugcentral:4149|hmdb:HMDB0041883 Graph doribax|doripenem hydrate doribax|doripenem hydrate http://purl.obolibrary.org/obo/CHEBI_135928 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135929 biolink:ChemicalEntity silodosin cas:160970-54-7|drugcentral:4151 Graph rapaflo|silodoshin|silodyx|urief|urorec rapaflo|silodoshin|silodyx|urief|urorec http://purl.obolibrary.org/obo/CHEBI_135929 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135930 biolink:ChemicalEntity lercanidipine cas:100427-26-7|drugcentral:4157|hmdb:HMDB0014669 Graph lercanidipine HCl|lercanidipine hydrochloride|masnidipine|zanidip lercanidipine HCl|lercanidipine hydrochloride|masnidipine|zanidip http://purl.obolibrary.org/obo/CHEBI_135930 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135935 biolink:ChemicalEntity tapentadol cas:175591-09-0|drugcentral:4283 Graph nucynta|tapentadol HCl|tapentadol hydrochloride nucynta|tapentadol HCl|tapentadol hydrochloride http://purl.obolibrary.org/obo/CHEBI_135935 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135938 biolink:ChemicalEntity lasofoxifene A member of the class of tetralins that is 5,6,7,8-tetrahydronaphthalen-2-ol in which the hydrogens at positions 5 and 6 are replaced by 4-[2-(pyrrolidin-1-yl)ethoxy]phenyl and phenyl groups, respectively (the 5R,6S-stereoisomer). It is a selective estrogen receptor modulator indicated for the prevention and treatment of osteoporosis in post-menopausal women. cas:180916-16-9|drugbank:DB06202|drugcentral:4308|pdb-ccd:C3D|pmc:PMC6553177|pubmed:10566027|pubmed:10746637|pubmed:11112634|pubmed:11316005|pubmed:15801869|pubmed:17456742|pubmed:19898646|pubmed:20181970|pubmed:20446861|pubmed:20568309|pubmed:20568310|pubmed:21080249|pubmed:23604900|pubmed:24275139|pubmed:26424839|pubmed:9528995|wikipedia.en:Lasofoxifene Graph (-)-cis-(5R,6S)-6-phenyl-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5,6,7,8-tetrahydronaphthalen-2-ol|(-)-cis-5,6,7,8-tetrahydro-6-phenyl-5-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)-2-naphthol|(5R,6S)-6-phenyl-5-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}-5,6,7,8-tetrahydronaphthalen-2-ol|CP 336156|CP-336,156|CP-336156|Oporia|lasofoxifene|lasofoxifeno|lasofoxifenum (5R,6S)-6-phenyl-5-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}-5,6,7,8-tetrahydronaphthalen-2-ol (-)-cis-(5R,6S)-6-phenyl-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5,6,7,8-tetrahydronaphthalen-2-ol|(-)-cis-5,6,7,8-tetrahydro-6-phenyl-5-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)-2-naphthol|(5R,6S)-6-phenyl-5-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}-5,6,7,8-tetrahydronaphthalen-2-ol|CP 336156|CP-336,156|CP-336156|Oporia|lasofoxifene|lasofoxifeno|lasofoxifenum http://purl.obolibrary.org/obo/CHEBI_135938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:135946 biolink:ChemicalEntity sincalide cas:25126-32-3|drugcentral:4627 Graph SQ 19844|SQ-19844|cholecystokinin-8 SQ 19844|SQ-19844|cholecystokinin-8 http://purl.obolibrary.org/obo/CHEBI_135946 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135947 biolink:ChemicalEntity bazedoxifene cas:198481-32-2|drugcentral:4334 Graph TSE-424|TSE424|bazedoxifene acetate|conbriza TSE-424|TSE424|bazedoxifene acetate|conbriza http://purl.obolibrary.org/obo/CHEBI_135947 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135948 biolink:ChemicalEntity amifampridine cas:54-96-6|drugcentral:4336 Graph 3,4-DAP|DAP|amifampridin|amifampridine phosphate|firdapse 3,4-DAP|DAP|amifampridin|amifampridine phosphate|firdapse http://purl.obolibrary.org/obo/CHEBI_135948 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135949 biolink:ChemicalEntity ambrisentan cas:177036-94-1|drugcentral:4337 Graph LU 208075|LU208075|letairis|volibris LU 208075|LU208075|letairis|volibris http://purl.obolibrary.org/obo/CHEBI_135949 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135956 biolink:ChemicalEntity vernakalant cas:794466-70-9|drugcentral:4365 Graph RSD1235|brinavess|vernakalant HCl|vernakalant hydrochloride RSD1235|brinavess|vernakalant HCl|vernakalant hydrochloride http://purl.obolibrary.org/obo/CHEBI_135956 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135962 biolink:ChemicalEntity dapoxetine cas:119356-77-3|drugcentral:4381 Graph LY-210448|dapoxetine hydrochloride|priligy LY-210448|dapoxetine hydrochloride|priligy http://purl.obolibrary.org/obo/CHEBI_135962 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135964 biolink:ChemicalEntity clevudine cas:163252-36-6|drugcentral:4394 Graph levovir levovir http://purl.obolibrary.org/obo/CHEBI_135964 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135967 biolink:ChemicalEntity casopitant cas:414910-27-3|drugcentral:4401 Graph GW-679769|GW679769|casopitant mesilate|casopitant mesylate|zunrisa GW-679769|GW679769|casopitant mesilate|casopitant mesylate|zunrisa http://purl.obolibrary.org/obo/CHEBI_135967 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135971 biolink:ChemicalEntity etilevodopa cas:37178-37-3|drugcentral:4422 Graph levodopa ethyl ester levodopa ethyl ester http://purl.obolibrary.org/obo/CHEBI_135971 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135983 biolink:ChemicalEntity teriparatide cas:52232-67-4|drugcentral:4514 Graph forsteo|hPTH 1-34|parathar|teriparatide acetate|teriparatide recombinant human forsteo|hPTH 1-34|parathar|teriparatide acetate|teriparatide recombinant human http://purl.obolibrary.org/obo/CHEBI_135983 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135984 biolink:ChemicalEntity fazadinium cas:36653-54-0|drugcentral:4535 Graph fazadinium bromide|fazadinium dibromide|fazadon fazadinium bromide|fazadinium dibromide|fazadon http://purl.obolibrary.org/obo/CHEBI_135984 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:135990 biolink:ChemicalEntity gepirone A member of the class of piperidones that is piperidine-2,6-dione substituted by a 4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl group at position 1 and two methyl groups at position 4. cas:83928-76-1|drugbank:DB12184|drugcentral:4562|hmdb:HMDB0252698|pubmed:11892924|pubmed:12949996|pubmed:21707926|pubmed:22240272|pubmed:31347611|pubmed:37856644|pubmed:38079093|pubmed:38335641|pubmed:6140299|wikipedia.en:Gepirone Graph 4,4-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2,6-piperidinedione|4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione|gepirona|gepirone|gepironum 4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione 4,4-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2,6-piperidinedione|4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione|gepirona|gepirone|gepironum http://purl.obolibrary.org/obo/CHEBI_135990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136003 biolink:ChemicalEntity levomethadone A 6-(dimethylamino)-4,4-diphenylheptan-3-one that has (R)-configuration. It is the active enantiomer of methadone and its hydrochloride salt is used to treat adults who are addicted to drugs such as heroin and morphine. cas:125-58-6|chemspider:20904|drugbank:DB13515|drugcentral:4586|kegg.drug:D08121|pubmed:20308640|pubmed:21371149|pubmed:25669614|pubmed:27974484|pubmed:29393208|pubmed:29902789|pubmed:31842942|pubmed:32302325|pubmed:32586692|pubmed:32903474|pubmed:33345336|pubmed:33423953|reaxys:3213668|wikipedia.en:Levomethadone Graph (-)-(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(-)-methadone|(6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one|(6R)-methadone|(R)-(-)-methadone|(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(R)-methadone|L-6-(dimethylamino)-4,4-diphenyl-3-heptanone|R-methadone|l-methadone|levometadona|levomethadone|levomethadonum (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one (-)-(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(-)-methadone|(6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one|(6R)-methadone|(R)-(-)-methadone|(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(R)-methadone|L-6-(dimethylamino)-4,4-diphenyl-3-heptanone|R-methadone|l-methadone|levometadona|levomethadone|levomethadonum http://purl.obolibrary.org/obo/CHEBI_136003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136004 biolink:ChemicalEntity linsidomine cas:33876-97-0|drugcentral:4589 Graph linsidomine HCl|linsidomine hydrochloride linsidomine HCl|linsidomine hydrochloride http://purl.obolibrary.org/obo/CHEBI_136004 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136007 biolink:ChemicalEntity methylnaltrexone cas:83387-25-1|drugcentral:4616 Graph methylnaltrexone bromide|methylnaltrexonium|relistor methylnaltrexone bromide|methylnaltrexonium|relistor http://purl.obolibrary.org/obo/CHEBI_136007 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136009 biolink:ChemicalEntity (6S)-5-methyltetrahydrofolic acid A 5-methyltetrahydrofolic acid that has 6S-configuration. cas:31690-09-2|chemspider:392351|drugcentral:4621|hmdb:HMDB0254053|kegg.drug:D09353|patent:US2007190596|patent:US2010151533|pdb-ccd:C2F|pubmed:15612825|pubmed:17622258|pubmed:20423084|pubmed:32370802|pubmed:33255787|pubmed:33375730|pubmed:33925570|pubmed:34953391|wikipedia.en:Levomefolic_acid Graph (6S)-5-methyl-5,6,7,8-tetrahydrofolic acid|(6S)-5-methyl-THF|(6S)-5-methylTHFA|L-5-methyltetrahydrofolate|L-5-methyltetrahydrofolic acid|N-[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|acide levomefolique|acido levomefolico|acidum levomefolicum|levomefolic acid N-[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid (6S)-5-methyl-5,6,7,8-tetrahydrofolic acid|(6S)-5-methyl-THF|(6S)-5-methylTHFA|L-5-methyltetrahydrofolate|L-5-methyltetrahydrofolic acid|N-[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|acide levomefolique|acido levomefolico|acidum levomefolicum|levomefolic acid http://purl.obolibrary.org/obo/CHEBI_136009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13601 biolink:ChemicalEntity 3-oxo-5alpha-steroid A 3-oxo steroid that has α configuration at position 5. kegg.compound:C02940|metacyc.compound:3-Oxo-5-Alpha-Steroids Graph 3-oxo 5alpha- steroid|3-oxo 5alpha- steroids|3-oxo 5alpha-steroids|a 3-oxo-5-alpha-steroid 3-oxo 5alpha- steroid|3-oxo 5alpha- steroids|3-oxo 5alpha-steroids|a 3-oxo-5-alpha-steroid http://purl.obolibrary.org/obo/CHEBI_13601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136039 biolink:ChemicalEntity phenibut cas:1078-21-3|drugcentral:4863 Graph bifren|fenibut|fenibut citrate|phenibut HCl|phenibut citrate|phenibut hydrochloride|phenigamma|phenyl-GABA bifren|fenibut|fenibut citrate|phenibut HCl|phenibut citrate|phenibut hydrochloride|phenigamma|phenyl-GABA http://purl.obolibrary.org/obo/CHEBI_136039 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136044 biolink:ChemicalEntity fimasartan cas:247257-48-3|drugcentral:4906 Graph BR-A-657|fimasartan potassium|fimasartan potassium hydrate|fimasartan potassium trihydrate|kanarb BR-A-657|fimasartan potassium|fimasartan potassium hydrate|fimasartan potassium trihydrate|kanarb http://purl.obolibrary.org/obo/CHEBI_136044 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136051 biolink:ChemicalEntity lusutrombopag cas:1110766-97-6|drugcentral:5059 Graph S 888711|S-888711|mulpleta S 888711|S-888711|mulpleta http://purl.obolibrary.org/obo/CHEBI_136051 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136056 biolink:ChemicalEntity (18S)-resolvin E2(1-) An icosanoid anion that is the conjugate base of (18S)-resolvin E2, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:21206090 Graph (5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosapentaenoate|18S-RvE2(1-)|18S-resolvin E2 (5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate (5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoate|(5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoate|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosapentaenoate|18S-RvE2(1-)|18S-resolvin E2 http://purl.obolibrary.org/obo/CHEBI_136056 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136057 biolink:ChemicalEntity (18S)-resolvin E1(1-) An icosanoid anion that is the conjugate base of (18S)-resolvin E1, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:21206090 Graph (5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-eicosapentaenoate|(5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-icosapentaenoate|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoate|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosapentaenoate|18S-RvE1(1-)|18S-resolvin E1 (5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoate (5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-eicosapentaenoate|(5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-icosapentaenoate|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoate|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosapentaenoate|18S-RvE1(1-)|18S-resolvin E1 http://purl.obolibrary.org/obo/CHEBI_136057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136067 biolink:ChemicalEntity 3-aci-nitropropanoate A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of 3-aci-nitropropanoic acid. kegg.compound:C03071 Graph 3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoate|3-aci-nitropropanoate|propionate 3-nitronate 3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoate|3-aci-nitropropanoate 3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoate|3-aci-nitropropanoate|propionate 3-nitronate http://purl.obolibrary.org/obo/CHEBI_136067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136078 biolink:ChemicalEntity 4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate A polyprenyl glycosyl diphosphate having eleven prenyl units and with 4-O-[di(2R)-1-glycerylphosphono]--N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosamine as the glycosyl fragment. metacyc.compound:CPD-19301 Graph 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-3-({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy](hydroxy)phosphoryl}-beta-D-mannoopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl ditrans,octacis-diphosphate 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-3-({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy](hydroxy)phosphoryl}-beta-D-mannoopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose 2-acetamido-4-O-(2-acetamido-2-deoxy-4-O-{[(2R)-3-({[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy](hydroxy)phosphoryl}-beta-D-mannoopyranosyl)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-glucopyranose|4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl ditrans,octacis-diphosphate http://purl.obolibrary.org/obo/CHEBI_136078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13610 biolink:ChemicalEntity 3beta-hydroxysterol ester A sterol ester obtained by formal condensation of the carboxy group of any carboxylic acid with the 3-hydroxy group of a 3β-hydroxysterol. kegg.compound:C03587 Graph 3beta-hydroxysteroid ester|3beta-hydroxysteroid esters|3beta-hydroxysterol esters|a 3-beta-hydroxysteroid ester 3beta-hydroxysteroid ester|3beta-hydroxysteroid esters|3beta-hydroxysterol esters|a 3-beta-hydroxysteroid ester http://purl.obolibrary.org/obo/CHEBI_13610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13611 biolink:ChemicalEntity 4-hydroxy carboxylic acid Any hydroxy carboxylic acid which contains a hydroxy substituent γ to a carboxy group. Graph 4-hydroxy carboxylic acids|4-hydroxyacids|4-hydroxycarboxylic acid|4-hydroxycarboxylic acids|a 4-hydroxyacid|gamma-hydroxy carboxylic acid|gamma-hydroxyacid|gamma-hydroxyacids|gamma-hydroxycarboxylic acid|gamma-hydroxycarboxylic acids 4-hydroxy carboxylic acids|4-hydroxyacids|4-hydroxycarboxylic acid|4-hydroxycarboxylic acids|a 4-hydroxyacid|gamma-hydroxy carboxylic acid|gamma-hydroxyacid|gamma-hydroxyacids|gamma-hydroxycarboxylic acid|gamma-hydroxycarboxylic acids http://purl.obolibrary.org/obo/CHEBI_13611 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136113 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosahexaenoic acid A docosanoid that is (4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying a hydroperoxy substituent at position 17S. lipidmaps:LMFA04000051|metacyc.compound:CPD66-80|pubmed:19324874|pubmed:23919613|reaxys:14339389 Graph (17S)-HPDHA|(17S)-HPDoHE|(17S)-hydroperoxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-hydroperoxydocosahexaenoic acid|17S-HpDHA|17S-hydroperoxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid (17S)-HPDHA|(17S)-HPDoHE|(17S)-hydroperoxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-hydroperoxydocosahexaenoic acid|17S-HpDHA|17S-hydroperoxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_136113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13614 biolink:ChemicalEntity 6,7-dihydropteridines Any member of the class of pteridines in which the the pteridine ring has been reduced by the formal addition of one molecule of hydrogen to positions 6 and 7. Graph http://purl.obolibrary.org/obo/CHEBI_13614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136179 biolink:ChemicalEntity (+)-7-isojasmonate A jasmonate anion resulting from the removal of a proton from the carboxy group of (+)-7-isojasmonic acid. The major species at pH 7.3. metacyc.compound:CPD-731 Graph (+)-7-isojasmonate|{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate {(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate (+)-7-isojasmonate|{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate http://purl.obolibrary.org/obo/CHEBI_136179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136180 biolink:ChemicalEntity N-[(+)-7-isojasmonyl]-L-isoleucinate An N-jasmonyl-L-α-amino acid anion obtained by deprotonation of the carboxy group of N-[(+)-7-isojasmonyl]-L-isoleucine; major species at pH 7.3. metacyc.compound:CPD-11259 Graph (+)-7-epi-jasmonoyl-L-isoleucinate|(+)-7-isojasmonic acid-L-isoleucinate conjugate|(+)-7-isojasmonyl-L-isoleucinate|(2S,3S)-3-methyl-2-(2-{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate|L-isoleucine-(+)-7-isojasmonate|N-({(R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucinate|N-[(+)-7-isojasmonyl]isoleucinate (2S,3S)-3-methyl-2-(2-{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate (+)-7-epi-jasmonoyl-L-isoleucinate|(+)-7-isojasmonic acid-L-isoleucinate conjugate|(+)-7-isojasmonyl-L-isoleucinate|(2S,3S)-3-methyl-2-(2-{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate|L-isoleucine-(+)-7-isojasmonate|N-({(R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucinate|N-[(+)-7-isojasmonyl]isoleucinate http://purl.obolibrary.org/obo/CHEBI_136180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136181 biolink:ChemicalEntity N-[(+)-12-hydroxy-7-isojasmonyl]-L-isoleucinate An N-jasmonyl-L-α-amino acid anion obtained by deprotonation of the carboxy group of N-[(+)-12-hydroxy-7-isojasmonyl]-L-isoleucine; major species at pH 7.3. metacyc.compound:CPD-13420 Graph (+)-7-iso-12-hydroxyjasmonoyl-L-isoleucinate|(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate|(3R,7S)-12-OH-JA-Ile(1-)|(3R,7S)-12-hydroxyjasmonoyl-L-isoleucinate|L-isoleucine-(+)-12-hydroxy-7-isojasmonate|N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucinate|N-[(+)-12-hydroxy-7-isojasmonyl]isoleucinate (2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate (+)-7-iso-12-hydroxyjasmonoyl-L-isoleucinate|(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate|(3R,7S)-12-OH-JA-Ile(1-)|(3R,7S)-12-hydroxyjasmonoyl-L-isoleucinate|L-isoleucine-(+)-12-hydroxy-7-isojasmonate|N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucinate|N-[(+)-12-hydroxy-7-isojasmonyl]isoleucinate http://purl.obolibrary.org/obo/CHEBI_136181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136182 biolink:ChemicalEntity tuberonate A 5-oxo monocarboxylic acid anion that is the conjugate base of tuberonic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph tuberonate|{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetate {(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetate tuberonate|{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetate http://purl.obolibrary.org/obo/CHEBI_136182 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136183 biolink:ChemicalEntity N-jasmonyl-L-alpha-amino acid anion An N-acyl-L-α-amino acid anion obtained by deprotonation of the carboxy group of any N-jasmonyl-L-α-amino acid; major species at pH 7.3. Graph a jasmonyl-L-amino acid a jasmonyl-L-amino acid http://purl.obolibrary.org/obo/CHEBI_136183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136184 biolink:ChemicalEntity jasmonic acid anion A 5-oxo monocarboxylic acid anion obtained by deprotonation of the carboxy group of any diastereomer of jasmonic acid; major species at pH 7.3. metacyc.compound:Jasmonic-Acids Graph a jasmonate|jasmonate anion|{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate {3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate a jasmonate|jasmonate anion|{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate http://purl.obolibrary.org/obo/CHEBI_136184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136188 biolink:ChemicalEntity phosphatidylethanolamine P-34:2 A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine in which the alkyl chain at position 1 and the acyl group at position 2 contain a total of 34 carbons and 2 additional double bonds. Graph PE P(34:2)|PE P-34:2|PE(P-34:2)|phosphatidylethanolamine(P-34:2) PE P(34:2)|PE P-34:2|PE(P-34:2)|phosphatidylethanolamine(P-34:2) http://purl.obolibrary.org/obo/CHEBI_136188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136203 biolink:ChemicalEntity phosphatidylethanolamine P-38:4 A 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine in which the alkyl chain at position 1 and the acyl group at position 2 contain a total of 38 carbons and 4 additional double bonds. Graph PE P(38:4)|PE P-38:4|PE(P-38:4)|phosphatidylethanolamine(P-38:4) PE P(38:4)|PE P-38:4|PE(P-38:4)|phosphatidylethanolamine(P-38:4) http://purl.obolibrary.org/obo/CHEBI_136203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136220 biolink:ChemicalEntity phosphatidylglycerol 32:1 A phosphatidylglycerol in which the two acyl groups contain a total of 32 carbon atoms and 1 double bond. Graph PG 32:1|PG(32:1)|phosphatidylglycerol(32:1) PG 32:1|PG(32:1)|phosphatidylglycerol(32:1) http://purl.obolibrary.org/obo/CHEBI_136220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136225 biolink:ChemicalEntity phosphatidylglycerol 34:1 A phosphatidylglycerol in which the two acyl groups contain a total of 34 carbon atoms and 1 double bond. Graph PG 34:1|PG(34:1)|phosphatidylglycerol(34:1) PG 34:1|PG(34:1)|phosphatidylglycerol(34:1) http://purl.obolibrary.org/obo/CHEBI_136225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136229 biolink:ChemicalEntity phosphatidylglycerol 36:2 A phosphatidylglycerol in which the two acyl groups contain a total of 36 carbon atoms and 2 double bonds. Graph PG 36:2|PG(36:2)|phosphatidylglycerol(36:2) PG 36:2|PG(36:2)|phosphatidylglycerol(36:2) http://purl.obolibrary.org/obo/CHEBI_136229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136234 biolink:ChemicalEntity phosphatidylserine 34:1 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 34 carbon atoms and 1 double bond. Graph PS 34:1|PS(34:1)|phosphatidyl-L-serine 34:1|phosphatidyl-L-serine(34:1)|phosphatidylserine(34:1) PS 34:1|PS(34:1)|phosphatidyl-L-serine 34:1|phosphatidyl-L-serine(34:1)|phosphatidylserine(34:1) http://purl.obolibrary.org/obo/CHEBI_136234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136235 biolink:ChemicalEntity phosphatidylinositol 36:4 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 36 carbon atoms and 4 double bonds. Graph PI 36:4|PI(36:4)|phosphatidylinositol 36:4|phosphatidylinositol(36:4) PI 36:4|PI(36:4)|phosphatidylinositol 36:4|phosphatidylinositol(36:4) http://purl.obolibrary.org/obo/CHEBI_136235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136236 biolink:ChemicalEntity phosphatidylinositol 36:2 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 36 carbon atoms and 2 double bonds. Graph PI 36:2|PI(36:2)|phosphatidylinositol 36:2|phosphatidylinositol(36:2) PI 36:2|PI(36:2)|phosphatidylinositol 36:2|phosphatidylinositol(36:2) http://purl.obolibrary.org/obo/CHEBI_136236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136239 biolink:ChemicalEntity phosphatidylinositol 38:4 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 38 carbon atoms and 4 double bonds. Graph PI 38:4|PI(38:4)|phosphatidylinositol 38:4|phosphatidylinositol(38:4) PI 38:4|PI(38:4)|phosphatidylinositol 38:4|phosphatidylinositol(38:4) http://purl.obolibrary.org/obo/CHEBI_136239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136240 biolink:ChemicalEntity phosphatidylinositol 34:1 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 34 carbon atoms and 1 double bond. Graph PI 34:1|PI(34:1)|phosphatidylinositol 34:1|phosphatidylinositol(34:1) PI 34:1|PI(34:1)|phosphatidylinositol 34:1|phosphatidylinositol(34:1) http://purl.obolibrary.org/obo/CHEBI_136240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136243 biolink:ChemicalEntity phosphatidylinositol 34:2 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 34 carbon atoms and 2 double bonds. Graph PI 34:2|PI(34:2)|phosphatidylinositol 34:2|phosphatidylinositol(34:2) PI 34:2|PI(34:2)|phosphatidylinositol 34:2|phosphatidylinositol(34:2) http://purl.obolibrary.org/obo/CHEBI_136243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136245 biolink:ChemicalEntity phosphatidylinositol 36:1 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 36 carbon atoms and 1 double bond. Graph PI 36:1|PI(36:1)|phosphatidylinositol 36:1|phosphatidylinositol(36:1) PI 36:1|PI(36:1)|phosphatidylinositol 36:1|phosphatidylinositol(36:1) http://purl.obolibrary.org/obo/CHEBI_136245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136247 biolink:ChemicalEntity phosphatidylserine 36:4 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 36 carbon atoms and 4 double bonds. Graph PS 36:4|PS(36:4)|phosphatidylserine(36:4) PS 36:4|PS(36:4)|phosphatidylserine(36:4) http://purl.obolibrary.org/obo/CHEBI_136247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136248 biolink:ChemicalEntity phosphatidylserine 34:2 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 34 carbon atoms and 2 double bonds. Graph PS 34:2|PS(34:2)|phosphatidylserine(34:2) PS 34:2|PS(34:2)|phosphatidylserine(34:2) http://purl.obolibrary.org/obo/CHEBI_136248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136252 biolink:ChemicalEntity phosphatidylserine 38:6 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 38 carbon atoms and 6 double bonds. Graph PS 38:6|PS(38:6)|phosphatidylserine(38:6) PS 38:6|PS(38:6)|phosphatidylserine(38:6) http://purl.obolibrary.org/obo/CHEBI_136252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136256 biolink:ChemicalEntity phosphatidylserine 36:1 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 36 carbon atoms and 1 double bond. Graph PS 36:1|PS(36:1)|phosphatidylserine(36:1) PS 36:1|PS(36:1)|phosphatidylserine(36:1) http://purl.obolibrary.org/obo/CHEBI_136256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136257 biolink:ChemicalEntity phosphatidylserine 36:2 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 36 carbon atoms and 2 double bonds. Graph PS 36:2|PS(36:2)|phosphatidylserine(36:2) PS 36:2|PS(36:2)|phosphatidylserine(36:2) http://purl.obolibrary.org/obo/CHEBI_136257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136258 biolink:ChemicalEntity phosphatidylserine 38:3 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 38 carbon atoms and 3 double bonds. Graph PS 38:3|PS(38:3)|phosphatidylserine(38:3) PS 38:3|PS(38:3)|phosphatidylserine(38:3) http://purl.obolibrary.org/obo/CHEBI_136258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136259 biolink:ChemicalEntity phosphatidylserine 38:4 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 38 carbon atoms and 4 double bonds. Graph PS 38:4|PS(38:4)|phosphatidylserine(38:4) PS 38:4|PS(38:4)|phosphatidylserine(38:4) http://purl.obolibrary.org/obo/CHEBI_136259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136260 biolink:ChemicalEntity phosphatidylserine 38:5 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 38 carbon atoms and 5 double bonds. Graph PS 38:5|PS(38:5)|phosphatidylserine(38:5) PS 38:5|PS(38:5)|phosphatidylserine(38:5) http://purl.obolibrary.org/obo/CHEBI_136260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136263 biolink:ChemicalEntity phosphatidylserine 40:6 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 40 carbon atoms and 6 double bonds. Graph PS 40:6|PS(40:6)|phosphatidylserine(40:6) PS 40:6|PS(40:6)|phosphatidylserine(40:6) http://purl.obolibrary.org/obo/CHEBI_136263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136265 biolink:ChemicalEntity phosphatidylserine 40:7 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 40 carbon atoms and 7 double bonds. Graph PS 40:7|PS(40:7)|phosphatidylserine(40:7) PS 40:7|PS(40:7)|phosphatidylserine(40:7) http://purl.obolibrary.org/obo/CHEBI_136265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136268 biolink:ChemicalEntity phosphatidylserine 40:5 A 3-sn-phosphatidyl-L-serine in which the two acyl groups contain a total of 40 carbon atoms and 5 double bonds. Graph PS 40:5|PS(40:5)|phosphatidylserine(40:5) PS 40:5|PS(40:5)|phosphatidylserine(40:5) http://purl.obolibrary.org/obo/CHEBI_136268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136288 biolink:ChemicalEntity sphingomyelin 43:2 A sphingomyelin in which the total number of carbons in the sphingoid base and fatty acyl groups is 43 with 2 double bonds. Graph SM 43:2|SM(43:2)|sphingomyelin 43:2|sphingomyelin(43:2) SM 43:2|SM(43:2)|sphingomyelin 43:2|sphingomyelin(43:2) http://purl.obolibrary.org/obo/CHEBI_136288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136352 biolink:ChemicalEntity (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoic acid A hydroperoxydocosapentaenoic acid that is (7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid carrying a hydroperoxy substituent at position 17. An intermediate of specialised proresolving mediators. pubmed:19324874 Graph (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid|(7Z,10Z,13Z,15E,19Z)-hydroperoxydocosapentaenoic acid|17-HPDPA(n-3)|17-HPDoPE(n-3)|17-hydroperoxy-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid|(7Z,10Z,13Z,15E,19Z)-hydroperoxydocosapentaenoic acid|17-HPDPA(n-3)|17-HPDoPE(n-3)|17-hydroperoxy-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_136352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136353 biolink:ChemicalEntity (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoic acid A hydroperoxydocosapentaenoic acid that is (7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid carrying a hydroperoxy substituent at position 14. pubmed:19324874 Graph (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid|14-HPDPA(n-3)|14-HPDoPE|14-HPDoPE(n-3)|14-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid|14-HPDPA(n-3)|14-HPDoPE|14-HPDoPE(n-3)|14-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_136353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13637 biolink:ChemicalEntity flavanone 7-O-beta-D-glucoside A β-D-glucoside having a flavanon-7-yl moiety at the anomeric position. Graph flavanone 7-O-beta-D-glucosides flavanone 7-O-beta-D-glucosides http://purl.obolibrary.org/obo/CHEBI_13637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136397 biolink:ChemicalEntity (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate A carbohydrate acid derivative anion arising from deprotonation of the carboxy and phosphate OH groups of (2ξ)-3-deoxy-7-O-phospho-β-D-threo-hept-6-ulopyranosonic acid; major species at pH 7.3. pubmed:15326172 Graph (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate|7-phospho-2-dehydro-3-deoxy-D-arabino-heptonate (ring form) (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate|7-phospho-2-dehydro-3-deoxy-D-arabino-heptonate (ring form) http://purl.obolibrary.org/obo/CHEBI_136397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136398 biolink:ChemicalEntity N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactoside(1-) An N-acetylneuraminate obtained by deprotonation of the carboxy group of any N-acetyl-α-neuraminyl-(2→6)-β-D-galactoside metacyc.compound:ALPHA-N-ACETYLNEURAMINYL-26-BETA-D-GALA Graph an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl derivative an N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_136398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136412 biolink:ChemicalEntity 5'-end 2'-deoxyribonucleotide(2-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of any 5'-end 2'-deoxyribonucleotide residue; major species at pH 7.3. Graph 5'-phosphate 2'-deoxynucleoside residue 5'-phosphate 2'-deoxynucleoside residue http://purl.obolibrary.org/obo/CHEBI_136412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136416 biolink:ChemicalEntity 5'-end 2'-deoxyribonucleoside residue A nucleoside residue derived from any 2'-deoxyribonucleoside having the linkage point at position 3'. metacyc.compound:5-Dephospho-DNA Graph 5'-end 2'-deoxyribonucleoside 5'-end 2'-deoxyribonucleoside http://purl.obolibrary.org/obo/CHEBI_136416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136419 biolink:ChemicalEntity 3'-end 2'-deoxyribonucleotide-3'-diphospho-5'-guanosine(3-) residue An organic anionic group obtained by deprotonation of the phosphate and diphosphate OH groups of any 3'-end 2'-deoxyribonucleotide-3'-diphospho-5'-guanosine residue; major species at pH 7.3. metacyc.compound:DNA-with-3-prime-pp-5-prime-G-cap Graph 3'-end 2'-deoxyribonucleotide-3'-diphospho-5'-guanosine residue 3'-end 2'-deoxyribonucleotide-3'-diphospho-5'-guanosine residue http://purl.obolibrary.org/obo/CHEBI_136419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136420 biolink:ChemicalEntity 3'-end 5'-phosphate-ribonucleotide(3-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of any 3'-end 5'-phosphate-ribonucleotide residue; major species at pH 7.3. metacyc.compound:3-Prime-Phosphate-Terminated-DNAs Graph 3'-end 2'-deoxyribonucleotide 3'-phosphate residue 3'-end 2'-deoxyribonucleotide 3'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_136420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136422 biolink:ChemicalEntity (Z)-desulfoglucotropeolin A desulfoglucotropeolin in which the C=N double bond has Z configuration. kegg.compound:C01069|metacyc.compound:BENZYL-DESULFOGLUCOSINOLATE Graph (Z)-desulfoglucotropeolin|1-S-[(1Z)-N-hydroxy-2-phenylethanimidoyl]-1-thio-beta-D-glucopyranose 1-S-[(1Z)-N-hydroxy-2-phenylethanimidoyl]-1-thio-beta-D-glucopyranose (Z)-desulfoglucotropeolin|1-S-[(1Z)-N-hydroxy-2-phenylethanimidoyl]-1-thio-beta-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_136422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136425 biolink:ChemicalEntity omega-(methylsulfanyl)alkyl desulfoglucosinolate A desulfoglucosinolic acid resulting from the formal condensation of the thiol group of any ω-[(methylsulfanyl)alkyl]thiohydroximic acid with β-D-glucopyranose. metacyc.compound:Desulfoaliphaticglucosinolates Graph alpha-(methylsulfanyl)-omega-[3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl|an aliphatic desulfo-glucosinolate alpha-(methylsulfanyl)-omega-[3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl alpha-(methylsulfanyl)-omega-[3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl|an aliphatic desulfo-glucosinolate http://purl.obolibrary.org/obo/CHEBI_136425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136428 biolink:ChemicalEntity N-hydroxyimidothioate An imidothioate in which the nitrogen is substituted by a hydroxy group. Graph N-hydroxyimidothioates N-hydroxyimidothioates http://purl.obolibrary.org/obo/CHEBI_136428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13643 biolink:ChemicalEntity glycol A diol in which the two hydroxy groups are on different carbon atoms, usually but not necessarily adjacent. Graph Glykol|glycols glycols Glykol|glycols http://purl.obolibrary.org/obo/CHEBI_13643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136434 biolink:ChemicalEntity omega-[(methylsulfanyl)alkyl]glucosinolate A thia-alkylglucosinolate resulting from the removal of the proton of the hydrogen sulfate group of any ω-[(methylsulfanyl)alkyl]glucosinolic acid. metacyc.compound:Aliphatic-glucosinolates Graph an omega-(methylsulfanyl)-N-sulfo-alkylhydroximate S-glucoside an omega-(methylsulfanyl)-N-sulfo-alkylhydroximate S-glucoside http://purl.obolibrary.org/obo/CHEBI_136434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136438 biolink:ChemicalEntity D-thioglucoside A thioglucoside in which the thioglucosyl moiety has D configuration. Graph http://purl.obolibrary.org/obo/CHEBI_136438 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:136440 biolink:ChemicalEntity beta-D-thioglucoside A D-thioglucoside that has β configuration at position 1. Graph 1-thio-beta-D-glucopyranoside|1-thio-beta-D-glucopyranosides|beta-D-thioglucosides 1-thio-beta-D-glucopyranoside 1-thio-beta-D-glucopyranoside|1-thio-beta-D-glucopyranosides|beta-D-thioglucosides http://purl.obolibrary.org/obo/CHEBI_136440 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:136442 biolink:ChemicalEntity desulfoglucosinolic acid A β-D-thioglucoside formed by the formal condensation of the thiol group of an N-hydroxyimidothioate with β-D-glucose. Graph desulfoglucosinolic acids desulfoglucosinolic acids http://purl.obolibrary.org/obo/CHEBI_136442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136469 biolink:ChemicalEntity phosphatidylethanolamine 33:1 A 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the two acyl groups contain a total of 33 carbons and 1 double bond. Graph PE 33:1|PE(33:1)|phosphatidylethanolamine(33:1) PE 33:1|PE(33:1)|phosphatidylethanolamine(33:1) http://purl.obolibrary.org/obo/CHEBI_136469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136479 biolink:ChemicalEntity phosphatidylglycerol 34:2 A phosphatidylglycerol in which the two acyl groups contain a total of 34 carbon atoms and 2 double bonds. Graph PG 34:2|PG(34:2)|phosphatidylglycerol(34:2) PG 34:2|PG(34:2)|phosphatidylglycerol(34:2) http://purl.obolibrary.org/obo/CHEBI_136479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136489 biolink:ChemicalEntity phosphatidylinositol 36:3 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 36 carbon atoms and 3 double bonds. Graph PI 36:3|PI(36:3)|phosphatidylinositol(36:3) PI 36:3|PI(36:3)|phosphatidylinositol(36:3) http://purl.obolibrary.org/obo/CHEBI_136489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136505 biolink:ChemicalEntity homocysteine derivative A non-proteinogenic amino acid derivative resulting from reaction of homocysteine at the amino group, the carboxy group, or the side-chain amino group, or from the replacement of any hydrogen of homocysteine by a heteroatom. The definition normally excludes peptides containing homocysteine residues. Graph homocysteine derivatives homocysteine derivatives http://purl.obolibrary.org/obo/CHEBI_136505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136514 biolink:ChemicalEntity indol-3-ylmethylamine(1+) A primary ammonium ion obtained by protonation of the primary amino function of indol-3-ylmethylamine; major species at pH 7.3. metacyc.compound:CPD-8913 Graph (1H-indol-3-yl)methanaminium|3-(aminomethyl)indole|3-(ammoniomethyl)indole (1H-indol-3-yl)methanaminium (1H-indol-3-yl)methanaminium|3-(aminomethyl)indole|3-(ammoniomethyl)indole http://purl.obolibrary.org/obo/CHEBI_136514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136515 biolink:ChemicalEntity 3-(methylaminomethyl)indole(1+) An organic cation obtained by protonation of the secondary amino function of 3-(methylaminomethyl)indole; major species at pH 7.3. Graph (1H-indol-3-yl)-N-methylmethanamine|(1H-indol-3-yl)-N-methylmethanaminium|(indol-3-yl)-N-methylmethanamine(1+)|N-methyl-3-aminomethylindole(1+) (1H-indol-3-yl)-N-methylmethanaminium (1H-indol-3-yl)-N-methylmethanamine|(1H-indol-3-yl)-N-methylmethanaminium|(indol-3-yl)-N-methylmethanamine(1+)|N-methyl-3-aminomethylindole(1+) http://purl.obolibrary.org/obo/CHEBI_136515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136525 biolink:ChemicalEntity (14R)-HDoHE(1-) A 14-HDoHE(1−) that is the conjugate base of (14R)-HDoHE, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25200603 Graph (14R)-HDHA(1-)|(14R)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosahexaenoate|14(R)-HDoHE(1-) (4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate (14R)-HDHA(1-)|(14R)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosahexaenoate|14(R)-HDoHE(1-) http://purl.obolibrary.org/obo/CHEBI_136525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136526 biolink:ChemicalEntity (14S)-HDoHE(1-) A 14-HDoHE(1−) that is the conjugate base of (14S)-HDoHE, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25200603 Graph (14S)-HDHA(1-)|(14S)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosahexaenoate|14(S)-HDoHE(1-) (4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate (14S)-HDHA(1-)|(14S)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosahexaenoate|14(S)-HDoHE(1-) http://purl.obolibrary.org/obo/CHEBI_136526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136528 biolink:ChemicalEntity dihydroxydocosahexaenoate A hydroxy polyunsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any dihydroxydocosahexaenoic acid. Graph DiHDHA(1-)|DiHDoHE(1-) DiHDHA(1-)|DiHDoHE(1-) http://purl.obolibrary.org/obo/CHEBI_136528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136529 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25200603 Graph (14S,22)-DiHDoHE(1-)|(14S,22)-diHDHA(1-)|(14S,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|maresin-L1(1-) (4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14S,22)-DiHDoHE(1-)|(14S,22)-diHDHA(1-)|(14S,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|maresin-L1(1-) http://purl.obolibrary.org/obo/CHEBI_136529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136530 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25200603 Graph (14R,22)-DiHDoHE(1-)|(14R,22)-diHDHA(1-)|(14R,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|maresin-L2(1-) (4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14R,22)-DiHDoHE(1-)|(14R,22)-diHDHA(1-)|(14R,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|maresin-L2(1-) http://purl.obolibrary.org/obo/CHEBI_136530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136533 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:19965612 Graph (14S,21R)-DiHDoHE(1-)|(14S,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14S,21R-diHDHA(1-) (4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14S,21R)-DiHDoHE(1-)|(14S,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14S,21R-diHDHA(1-) http://purl.obolibrary.org/obo/CHEBI_136533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136534 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (14S,21S)-DiHDoHE(1-)|(14S,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14S,21S-diHDHA(1-) (4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14S,21S)-DiHDoHE(1-)|(14S,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14S,21S-diHDHA(1-) http://purl.obolibrary.org/obo/CHEBI_136534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136535 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:19965612 Graph (14R,21R)-DiHDoHE(1-)|(14R,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14R,21R-diHDHA(1-) (4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14R,21R)-DiHDoHE(1-)|(14R,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14R,21R-diHDHA(1-) http://purl.obolibrary.org/obo/CHEBI_136535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136536 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-dihydroxydocosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-dihydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:19965612 Graph (14R,21S)-DiHDoHE(1-)|(14R,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14R,21S-diHDHA(1-) (4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate (14R,21S)-DiHDoHE(1-)|(14R,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoate|14R,21S-diHDHA(1-) http://purl.obolibrary.org/obo/CHEBI_136536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136538 biolink:ChemicalEntity ethylisopropylamiloride A member of the class of pyrazines that is amiloride in which the amino substitutent of the pyrazine ring that is adjacent to the chloro substituent has been substituted by an ethyl group and by an isopropyl group. cas:1154-25-2|pubmed:10482815|pubmed:12897821|pubmed:15968466|pubmed:20338684|pubmed:23075671|pubmed:23864606|pubmed:25985899|pubmed:26547075|pubmed:9486355 Graph 3-amino-N-(aminoiminomethyl)-6-chloro-5-(ethyl(1-methylethyl)amino)pyrazinecarboxamide|3-amino-N-carbamimidoyl-6-chloro-5-[ethyl(isopropyl)amino]pyrazine-2-carboxamide|5-(N-ethyl-N-isopropyl)amiloride|5-(ethylisopropyl)amiloride|EIPA|N-amidino-3-amino-5-ethylisopropylamino-6-chloropyrazine carboxamide|ethyl isopropyl amiloride 3-amino-N-carbamimidoyl-6-chloro-5-[ethyl(isopropyl)amino]pyrazine-2-carboxamide 3-amino-N-(aminoiminomethyl)-6-chloro-5-(ethyl(1-methylethyl)amino)pyrazinecarboxamide|3-amino-N-carbamimidoyl-6-chloro-5-[ethyl(isopropyl)amino]pyrazine-2-carboxamide|5-(N-ethyl-N-isopropyl)amiloride|5-(ethylisopropyl)amiloride|EIPA|N-amidino-3-amino-5-ethylisopropylamino-6-chloropyrazine carboxamide|ethyl isopropyl amiloride http://purl.obolibrary.org/obo/CHEBI_136538 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136539 biolink:ChemicalEntity 11-dehydro-thromboxane B2(1-) A thromboxane anion that is the conjugate base of 11-dehydro-thromboxane B2, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:8200461 Graph (5Z)-7-{(2R,3S,4S)-4-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-6-oxooxan-3-yl}hept-5-enoate|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oate|11-dehydro-TXB22(1-)|11-dehydro-thromboxane B2 (5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oate (5Z)-7-{(2R,3S,4S)-4-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-6-oxooxan-3-yl}hept-5-enoate|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oate|11-dehydro-TXB22(1-)|11-dehydro-thromboxane B2 http://purl.obolibrary.org/obo/CHEBI_136539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136545 biolink:ChemicalEntity alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide(1-) A carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of any α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminide; major species ar pH 7.3. Graph an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_136545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136564 biolink:ChemicalEntity (R)-dyspropterin A dyspropterin in which the stereocentre at position 6 has R-configuration. metacyc.compound:6-PYRUVOYL-5678-TETRAHYDROPTERIN Graph (6R)-6-pyruvoyl-5,6,7,8-tetrahydropterin|6-pyruvoyl-5,6,7,8-tetrahydropterin (6R)-6-pyruvoyl-5,6,7,8-tetrahydropterin|6-pyruvoyl-5,6,7,8-tetrahydropterin http://purl.obolibrary.org/obo/CHEBI_136564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136565 biolink:ChemicalEntity (6R)-6-lactoyl-5,6,7,8-tetrahydropterin A 6-lactoyl-5,6,7,8-tetrahydropterin in which the stereocentre at position 6 has R-configuration. metacyc.compound:6-LACTOYL-5678-TETRAHYDROPTERIN Graph (6R)-2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(1H)-one|6-lactoyl-5,6,7,8-tetrahydropterin (6R)-2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(1H)-one (6R)-2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(1H)-one|6-lactoyl-5,6,7,8-tetrahydropterin http://purl.obolibrary.org/obo/CHEBI_136565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136572 biolink:ChemicalEntity (6R)-5,10-methylenetetrahydrofolate poly(gamma-L-glutamate) macromolecule A 5,10-methylenetetrahydrofolate polyglutamate macromolecule in which the stereocentre at position 6 on the tetrahydrofolyl moiety has R-configuration. Graph (6R)-5,10-methylenetetrahydrofolyl-(gamma-L-Glu)n (6R)-5,10-methylenetetrahydrofolyl-(gamma-L-Glu)n http://purl.obolibrary.org/obo/CHEBI_136572 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136579 biolink:ChemicalEntity cholesterol sulfate(1-) A steroid sulfate oxoanion obtained by deprotonation of the sulfo group of cholesterol sulfate; major species at pH 7.3. pubmed:12145317 Graph (3beta)-cholest-5-en-3-yl sulfate|cholest-5-en-3beta-yl sulfate|cholesterol sulfate cholest-5-en-3beta-yl sulfate (3beta)-cholest-5-en-3-yl sulfate|cholest-5-en-3beta-yl sulfate|cholesterol sulfate http://purl.obolibrary.org/obo/CHEBI_136579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136582 biolink:ChemicalEntity 17beta-estradiol 3-sulfate(1-) A steroid sulfate oxoanion obtained by deprotonation of the sulfo group of 17β-estradiol 3-sulfate; major species at pH 7.3. pubmed:7779757|reaxys:3705507 Graph (17beta)-17-hydroxyestra-1(10),2,4-trien-3-yl sulfate|17beta-estradiol 3-sulfate|17beta-hydroxyestra-1(10),2,4-trien-3-yl sulfate 17beta-hydroxyestra-1(10),2,4-trien-3-yl sulfate (17beta)-17-hydroxyestra-1(10),2,4-trien-3-yl sulfate|17beta-estradiol 3-sulfate|17beta-hydroxyestra-1(10),2,4-trien-3-yl sulfate http://purl.obolibrary.org/obo/CHEBI_136582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136591 biolink:ChemicalEntity D-erythronate An erythronate that is the conjugate base of D-erythronic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD-19877|reaxys:4664614 Graph (2R,3R)-2,3,4-trihydroxybutanoate|D-erythronate (2R,3R)-2,3,4-trihydroxybutanoate (2R,3R)-2,3,4-trihydroxybutanoate|D-erythronate http://purl.obolibrary.org/obo/CHEBI_136591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136596 biolink:ChemicalEntity 4-hydroxy monocarboxylic acid anion A hydroxy monocarboxylic acid anion resulting from the deprotonation of the carboxy group of a 4-hydroxycarboxylic acid. metacyc.compound:CPD-8575 Graph 4-hydroxy monocarboxylic acid anions|4-hydroxyacid anions|4-hydroxycarboxylate|4-hydroxycarboxylates|4-hydroxycarboxylic acid anions|4-hydroxymonocarboxylate|4-hydroxymonocarboxylates|4-hydroxymonocarboxylic acid anion|4-hydroxymonocarboxylic acid anions|a 4-hydroxyacid|a 4-hydroxyacid anion 4-hydroxy monocarboxylic acid anions|4-hydroxyacid anions|4-hydroxycarboxylate|4-hydroxycarboxylates|4-hydroxycarboxylic acid anions|4-hydroxymonocarboxylate|4-hydroxymonocarboxylates|4-hydroxymonocarboxylic acid anion|4-hydroxymonocarboxylic acid anions|a 4-hydroxyacid|a 4-hydroxyacid anion http://purl.obolibrary.org/obo/CHEBI_136596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136598 biolink:ChemicalEntity 3-amino-D-alanine A 3-aminoalanine that has R configuration. cas:1915-96-4|pdb-ccd:2RA|pubmed:6814950|reaxys:1721399 Graph (2R)-2,3-bis(azanyl)propanoic acid|(2R)-2,3-diaminopropanoic acid|(2R)-2,3-diaminopropionic acid|(R)-2,3-diaminopropanoic acid|(R)-2,3-diaminopropionic acid|3-amino-D-alanine|D-2,3-diaminopropanoic acid|D-2,3-diaminopropionic acid|D-DAP|D-Dap-OH 3-amino-D-alanine (2R)-2,3-bis(azanyl)propanoic acid|(2R)-2,3-diaminopropanoic acid|(2R)-2,3-diaminopropionic acid|(R)-2,3-diaminopropanoic acid|(R)-2,3-diaminopropionic acid|3-amino-D-alanine|D-2,3-diaminopropanoic acid|D-2,3-diaminopropionic acid|D-DAP|D-Dap-OH http://purl.obolibrary.org/obo/CHEBI_136598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136599 biolink:ChemicalEntity 3-amino-D-alanine zwitterion The zwitterion resulting from the transfer of a proton from the carboxy group to the β-amino group of 3-amino-D-alanine. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Graph (2R)-2-amino-3-azaniumylpropanoate|(R)-2,3-diaminopropanoate (2R)-2-amino-3-azaniumylpropanoate (2R)-2-amino-3-azaniumylpropanoate|(R)-2,3-diaminopropanoate http://purl.obolibrary.org/obo/CHEBI_136599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136602 biolink:ChemicalEntity (1->4)-6-phospho-alpha-D-glucan A glucan derivative that is (1→4)-α-D-glucan in which the 6-position of the repeating unit has been phosphorylated. Graph http://purl.obolibrary.org/obo/CHEBI_136602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136609 biolink:ChemicalEntity theaflavin A biflavonoid that is 3,4,5-trihydroxybenzocyclohepten-6-one which is substituted at positions 1 and 8 by (2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl groups. It is the main red pigment in black tea. cas:4670-05-7|chemspider:102754|foodb.food:FDB012511|hmdb:HMDB0005788|knapsack:C00009348|patent:KR20080052675|pubmed:26386739|pubmed:26851019|pubmed:27237789|pubmed:27756182|pubmed:27838465|pubmed:28190756|pubmed:28381812|pubmed:28639145|pubmed:28939421|reaxys:25497520|wikipedia.en:Theaflavin Graph (-)-theaflavin|1,8-bis((2R,3R)-3,5,7-trihydroxy-2H-1-benzopyran-2-yl)-3,4,6-trihydroxy-5H-benzocyclohepten-5-one|1,8-bis(3-alpha,5,7-trihydroxy-2-alpha-chromanyl)-5H-benzocyclohepten-5-one|3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzo[7]annulen-6-one|3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzocyclohepten-6-one|theaflavine 3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzocyclohepten-6-one (-)-theaflavin|1,8-bis((2R,3R)-3,5,7-trihydroxy-2H-1-benzopyran-2-yl)-3,4,6-trihydroxy-5H-benzocyclohepten-5-one|1,8-bis(3-alpha,5,7-trihydroxy-2-alpha-chromanyl)-5H-benzocyclohepten-5-one|3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzo[7]annulen-6-one|3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzocyclohepten-6-one|theaflavine http://purl.obolibrary.org/obo/CHEBI_136609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136622 biolink:ChemicalEntity aci-nitro compound Organonitrogen compounds that have the general structure R1(R2)C=N(O)OH (R1,R2 = H, organyl). They are tautomers of C-nitro compounds. Graph aci-nitro compounds|oxime N-oxide|oxime N-oxides aci-nitro compounds|oxime N-oxide|oxime N-oxides http://purl.obolibrary.org/obo/CHEBI_136622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136637 biolink:ChemicalEntity steroid glucosiduronic acid anion A steroid conjugate anion formed by deprotonation of the carboxy group of any steroid glucosiduronic acid. Graph steroid glucosiduronic acid anions|steroid glucuronide anion|steroid glucuronide anions steroid glucosiduronic acid anions|steroid glucuronide anion|steroid glucuronide anions http://purl.obolibrary.org/obo/CHEBI_136637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136643 biolink:ChemicalEntity propesticide A prodrug that, on administration, undergoes chemical conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the pharmacologically active pesticide for which it is a propesticide. agr:IND84086009|pubmed:26449612 Graph pro-pesticide|pro-pesticides|propesticides pro-pesticide|pro-pesticides|propesticides http://purl.obolibrary.org/obo/CHEBI_136643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136644 biolink:ChemicalEntity proinsecticide A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active insecticide for which it is a proinsecticide. agr:IND20386178|agr:IND84086011|agr:IND89021681|agr:IND92003154|pubmed:16172027|pubmed:26449612|pubmed:27414472|pubmed:27976502 Graph pro-insecticide|pro-insecticides|proinsecticides pro-insecticide|pro-insecticides|proinsecticides http://purl.obolibrary.org/obo/CHEBI_136644 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136651 biolink:ChemicalEntity S100 calcium-binding protein B inhibitor Any inhibitor of S100 calcium-binding protein B. wikipedia.en:S100B Graph S100 calcium-binding protein B inhibitors|S100B inhibitor|S100B inhibitors S100 calcium-binding protein B inhibitors|S100B inhibitor|S100B inhibitors http://purl.obolibrary.org/obo/CHEBI_136651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136655 biolink:ChemicalEntity 13(R)-HODE(1-) A 13-HODE(1−) that is the conjugate base of 13(R)-HODE, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:9866708 Graph (13R)-HODE(1-)|(13R)-hydroxy-(9Z,11E)-octadecadienoate|(9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoate|(9Z,11E,13R)-13-hydroxyoctadecadienoate (9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoate (13R)-HODE(1-)|(13R)-hydroxy-(9Z,11E)-octadecadienoate|(9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoate|(9Z,11E,13R)-13-hydroxyoctadecadienoate http://purl.obolibrary.org/obo/CHEBI_136655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136670 biolink:ChemicalEntity (S)-2,4-dihydroxy-3-oxobutanoate A hydroxy monocarboxylic acid anion that is the conjugate base of (S)-2,4-dihydroxy-3-oxobutanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD-19884 Graph (2S)-2,4-dihydroxy-3-oxobutanoate|3-dehydro-D-threonate|3-dehydro-L-erythronate (2S)-2,4-dihydroxy-3-oxobutanoate (2S)-2,4-dihydroxy-3-oxobutanoate|3-dehydro-D-threonate|3-dehydro-L-erythronate http://purl.obolibrary.org/obo/CHEBI_136670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136678 biolink:ChemicalEntity 4',7-dihydroxyflavanone A dihydroxyflavanone in which the two hydroxy substituents are located at positions 4' and 7. agr:IND44142906|chemspider:1818|pubmed:15787450|pubmed:16667124|pubmed:19352635|pubmed:20839627|pubmed:22976322|pubmed:23983320|pubmed:5489831|reaxys:89403 Graph 7,4'-dihydroxyflavanone|7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one 7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one 7,4'-dihydroxyflavanone|7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one http://purl.obolibrary.org/obo/CHEBI_136678 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136685 biolink:ChemicalEntity pivaloyloxymethyl ester A acetal obtained from a carboxylic acid by replacement of the hydrogen attached to the carboxy group by a pivaloyloxymethyl group. Graph POM ester|POM esters|[(2,2-dimethylpropanoyl)oxy]methyl ester|[(2,2-dimethylpropanoyl)oxy]methyl esters|methylacetyloxymethyl esters|pivaloyloxymethyl esters|pivolxil ester|pivolxil esters|trimethylacetyloxymethyl ester [(2,2-dimethylpropanoyl)oxy]methyl ester|[(2,2-dimethylpropanoyl)oxy]methyl esters|methylacetyloxymethyl esters|trimethylacetyloxymethyl ester POM ester|POM esters|[(2,2-dimethylpropanoyl)oxy]methyl ester|[(2,2-dimethylpropanoyl)oxy]methyl esters|methylacetyloxymethyl esters|pivaloyloxymethyl esters|pivolxil ester|pivolxil esters|trimethylacetyloxymethyl ester http://purl.obolibrary.org/obo/CHEBI_136685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136690 biolink:ChemicalEntity haloxyfop-P(1-) A monocarboxylic acid anion resulting from deprotonation of the carboxy group of haloxyfop-P. Graph (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate|(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionate|(R)-haloxyfop|(R)-haloxyfop anion|(R)-haloxyfop(1-)|haloxyfop-P anion (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate (2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate|(2R)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionate|(R)-haloxyfop|(R)-haloxyfop anion|(R)-haloxyfop(1-)|haloxyfop-P anion http://purl.obolibrary.org/obo/CHEBI_136690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136692 biolink:ChemicalEntity (S)-haloxyfop A 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid that has S configuration. It is the least-active enantiomer of the (racemic) herbicide haloxyfop. cas:95977-27-8|pubmed:22395649|pubmed:2568910|pubmed:25742319|reaxys:8571971 Graph (-)-haloxyfop|(2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid|(S)-(-)-haloxyfop|(S)-haloxyfop-acid (2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid (-)-haloxyfop|(2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid|(S)-(-)-haloxyfop|(S)-haloxyfop-acid http://purl.obolibrary.org/obo/CHEBI_136692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136694 biolink:ChemicalEntity 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid A monocarboxylic acid that is 2-phenoxypropanoic acid in which the hydrogen at the para position of the phenyl ring has been replaced by a [3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy group. ppdb:1066 Graph 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid|2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionic acid 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid|2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionic acid http://purl.obolibrary.org/obo/CHEBI_136694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1367 biolink:ChemicalEntity 3,3',4,4'-tetrachlorobiphenyl A tetrachlorobiphenyl that is biphenyl in which the hydrogens at position 3 and 4 on each phenyl group are replaced by chlorines. beilstein:2051251|cas:32598-13-3|kegg.compound:C11057 Graph 3,3',4,4'-tetrachloro-1,1'-biphenyl|3,4,3',4'-Tetra coplanar polychlorinated biphenyl|3,4,3',4'-Tetrachlorobiphenyl|PCB 77 3,3',4,4'-tetrachloro-1,1'-biphenyl 3,3',4,4'-tetrachloro-1,1'-biphenyl|3,4,3',4'-Tetra coplanar polychlorinated biphenyl|3,4,3',4'-Tetrachlorobiphenyl|PCB 77 http://purl.obolibrary.org/obo/CHEBI_1367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136702 biolink:ChemicalEntity ximelagatran (hydroxylamine form) A member of the class of azetidines that is melagatran in which the carboxylic acid group has been converted into the corresponding ethyl ester and in which the amidine group has been converted to the corresponding hydroxylamine. Tautomeric with the oxime form of ximelagatran. pubmed:28338626|reaxys:9741940 Graph ethyl ({(1R)-1-cyclohexyl-2-[(2S)-2-({[4-(N-hydroxycarbamimidoyl)phenyl]methyl}carbamoyl)azetidin-1-yl]-2-oxoethyl}amino)acetate ethyl ({(1R)-1-cyclohexyl-2-[(2S)-2-({[4-(N-hydroxycarbamimidoyl)phenyl]methyl}carbamoyl)azetidin-1-yl]-2-oxoethyl}amino)acetate ethyl ({(1R)-1-cyclohexyl-2-[(2S)-2-({[4-(N-hydroxycarbamimidoyl)phenyl]methyl}carbamoyl)azetidin-1-yl]-2-oxoethyl}amino)acetate http://purl.obolibrary.org/obo/CHEBI_136702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136712 biolink:ChemicalEntity pivaloyl-CoA(4-) A short chain fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of pivaloyl-CoA; major species at pH 7.3. pubmed:22167181 Graph 2,2-dimethylpropanoyl-CoA|2,2-dimethylpropanoyl-CoA(4-)|pivalyl-CoA(4-) 2,2-dimethylpropanoyl-CoA|2,2-dimethylpropanoyl-CoA(4-)|pivalyl-CoA(4-) http://purl.obolibrary.org/obo/CHEBI_136712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136716 biolink:ChemicalEntity N-(fatty acyl)-L-alpha-amino acid anion The conjugate base of a N-fatty-acyl-L-α-amino acid arising from deprotonation of the carboxy group; major species at pH 7.3. Graph N-fatty-acyl-L-alpha-amino acid|an N-fatty-acyl-L-alpha-amino acid N-fatty-acyl-L-alpha-amino acid|an N-fatty-acyl-L-alpha-amino acid http://purl.obolibrary.org/obo/CHEBI_136716 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136718 biolink:ChemicalEntity (S)-haloxyfop(1-) A monocarboxylic acid anion resulting from deprotonation of the carboxy group of (S)-haloxyfop. Graph (2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate|(2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionate (2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate (2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate|(2S)-2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propionate http://purl.obolibrary.org/obo/CHEBI_136718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136721 biolink:ChemicalEntity telomeric repeat-containing RNA "also abbreviated as TERRA: a long non-coding RNA transcript (lncRNA) expressed from the subtelomeric sequences, and also from the G-rich telomeric sequences which cap the ends of chromosomes. In vertebrates, TERRA contains the telomeric repeat RNA sequence UUAGGG. TERRA lncRNAs can be anywhere in length between 200bp and several kilobases in length. TERRA is implicated in telomere maintenance in a telomerase-dependent manner where TERRA acts as a negative regulator of telomerase activity. It is also implicated in telomere maintenance via the telomerase-independent mechanism called ALT (Alternative Lengthening of Telomeres). PDB entries: 2M18 and 3IBK." pubmed:25926849|pubmed:26581519|pubmed:27604461 Graph TERRA TERRA http://purl.obolibrary.org/obo/CHEBI_136721 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136730 biolink:ChemicalEntity (S)-all-trans-4-hydroxyretinoic acid An all-trans-4-hydroxyretinoic acid in which the 4-hydroxy group has S-configuration. pubmed:25492813|pubmed:26999080|reaxys:23145310 Graph (4S)-4-hydroxyretinoic acid|(4S)-OH-atRA|(4S,7E,9E,11E,13E)-4-hydroxyretinoic acid|(S)-4-hydroxyretinoic acid (4S)-4-hydroxyretinoic acid (4S)-4-hydroxyretinoic acid|(4S)-OH-atRA|(4S,7E,9E,11E,13E)-4-hydroxyretinoic acid|(S)-4-hydroxyretinoic acid http://purl.obolibrary.org/obo/CHEBI_136730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136757 biolink:ChemicalEntity long-chain (3S)-hydroxy fatty acyl-CoA(4-) A (3S)-hydroxyacyl-CoA arising from deprotonation of the phosphate and diphosphate OH groups of any long-chain (3S)-hydroxy fatty acyl-CoA; major species at pH 7.3. Graph a long-chain (3S)-3-hydroxy fatty acyl-CoA a long-chain (3S)-3-hydroxy fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_136757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136758 biolink:ChemicalEntity long-chain 3-oxo-fatty acyl-CoA(4-) A 3-oxo-fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any long-chain 3-oxo-fatty acyl-CoA; major species at pH 7.3. Graph a long-chain 3-oxo-fatty acyl-CoA a long-chain 3-oxo-fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_136758 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136760 biolink:ChemicalEntity short-chain (3S)-hydroxy fatty acyl-CoA(4-) A (3S)-3-hydroxyacyl-CoA arising from deprotonation of the phosphate and diphosphate OH groups of any short-chain (3S)-hydroxy fatty acyl-CoA; major species at pH 7.3. Graph (3S)-short-chain hydroxy fatty acyl-CoA(4-)|a short-chain (3S)-3-hydroxyacyl-CoA (3S)-short-chain hydroxy fatty acyl-CoA(4-)|a short-chain (3S)-3-hydroxyacyl-CoA http://purl.obolibrary.org/obo/CHEBI_136760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136798 biolink:ChemicalEntity 4-thiouridine 5'-phosphate(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of 5-thiouridine 5'-phosphate residue; major species at pH 7.3. metacyc.compound:tRNA-4-thiouridine Graph 4-thiouridine 5'-phosphate residue 4-thiouridine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_136798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136806 biolink:ChemicalEntity flamenol A member of the class of resorcinols that is phloroglucinol in which one of the phenolic hydrogens has been replaced by a methyl group. cas:2174-64-3|chemspider:64709|hmdb:HMDB0132905|metacyc.compound:CPD-9494|patent:US2010317894|pubmed:15122041|pubmed:15808422|pubmed:16109305|pubmed:18500808|pubmed:7813485|reaxys:1423578 Graph 3,5-dihydroxyanisole|5-Methoxyresorcinol|5-methoxybenzene-1,3-diol|flamenol|flamenolum|phloroglucinol monomethyl ether 5-methoxybenzene-1,3-diol 3,5-dihydroxyanisole|5-Methoxyresorcinol|5-methoxybenzene-1,3-diol|flamenol|flamenolum|phloroglucinol monomethyl ether http://purl.obolibrary.org/obo/CHEBI_136806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136824 biolink:ChemicalEntity mandelamide A monocarboxylic acid amide that is phenylacetamide in which one of the benzylic hydrogens has been replaced by a hydroxy group. cas:4410-31-5|reaxys:2208677 Graph 2-hydroxy-2-phenylacetamide 2-hydroxy-2-phenylacetamide 2-hydroxy-2-phenylacetamide http://purl.obolibrary.org/obo/CHEBI_136824 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136838 biolink:ChemicalEntity 2-methoxyethyl ester A carboxylic ester resulting from the formal condensation between a carboxylic acid and the hydroxy group of 2-methoxyethanol. In contrast to many other water-solubilising esters, the 2-methoxyethyl esters of many amino acids are crystalline, allowing them to be easily purified. Graph 2-methoxyethyl esters 2-methoxyethyl esters http://purl.obolibrary.org/obo/CHEBI_136838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136848 biolink:ChemicalEntity beta-bitter acid An alicyclic ketone obtained by prenylation at positions 4, 6 and 6 of any 2-acylphloroglucinol. β-bitter acids are well known for their contribution to the bitter taste of beer. metacyc.compound:BETA-ACIDS|pubmed:25564559|pubmed:27976466 Graph beta-bitter acids beta-bitter acids http://purl.obolibrary.org/obo/CHEBI_136848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136849 biolink:ChemicalEntity 3-oxo-Delta(4)-steroid group An organic group derived from any 3-oxo-Δ4-steroid. Graph a 3-oxo-Delta4-steroid group a 3-oxo-Delta4-steroid group http://purl.obolibrary.org/obo/CHEBI_136849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136853 biolink:ChemicalEntity 3-(acyloxy)acyl group Graph a 3-(acyloxy)acyl derivative of bacterial toxin a 3-(acyloxy)acyl derivative of bacterial toxin http://purl.obolibrary.org/obo/CHEBI_136853 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:136856 biolink:ChemicalEntity O-succinyl-L-serinate(1-) An α-amino-acid anion that is the conjugate base of O-succinyl-L-serine having anionic carboxy groups and a protonated amino group; major species at pH 7.3. Graph 4-[(2S)-2-azaniumyl-2-carboxylatoethoxy]-4-oxobutanoate|O-succinyl-L-serine 4-[(2S)-2-azaniumyl-2-carboxylatoethoxy]-4-oxobutanoate 4-[(2S)-2-azaniumyl-2-carboxylatoethoxy]-4-oxobutanoate|O-succinyl-L-serine http://purl.obolibrary.org/obo/CHEBI_136856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136859 biolink:ChemicalEntity pro-agent A compound that, on administration, undergoes conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the active agent for which it is a pro-agent. pubmed:26449612 Graph pro-agents|proagent|proagents pro-agents|proagent|proagents http://purl.obolibrary.org/obo/CHEBI_136859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136860 biolink:ChemicalEntity antidote to sarin poisoning A role borne by a molecule that acts to counteract or neutralise the nerve agent sarin. Graph http://purl.obolibrary.org/obo/CHEBI_136860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136873 biolink:ChemicalEntity oligoglycosyl-(1->4)-beta-D-glucose Graph an oligoglycosyl-(1->4)-beta-D-glucose an oligoglycosyl-(1->4)-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_136873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136874 biolink:ChemicalEntity piperazinium(2+) A secondary aliphatic ammonium ion obtained by protonation of both amino groups of piperazine. Graph piperazine-1,4-diium|piperazinium dication piperazine-1,4-diium piperazine-1,4-diium|piperazinium dication http://purl.obolibrary.org/obo/CHEBI_136874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136875 biolink:ChemicalEntity oligoglycosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide A glycosylceramide in which the oligoglycosyl component can be any oligoglycosyl-(1→4)-β-D-glucosyl residue. Graph an oligoglycosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide an oligoglycosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide http://purl.obolibrary.org/obo/CHEBI_136875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136876 biolink:ChemicalEntity 1-(3,4-dihydroxybenzoyl)-beta-D-glucopyranose An O-acyl carbohydrate that is β-D-glucopyranose in which the anomeric hydroxy hydrogen has been replaced by a 3,4-dihydroxybenzoyl group. pubmed:24412325|reaxys:7823578 Graph 1-(3,4-dihydroxybenzoyl)-beta-D-glucose|1-O-(3,4-dihydroxy-benzoyl)-beta-D-glucose|1-O-(3,4-dihydroxybenzoyl)-beta-D-glucopyranose|1-O-(3,4-dihydroxybenzoyl)-beta-D-glucose|1-O-protocatechuoyl-beta-D-glucopyranose|1-O-protocatechuoyl-beta-D-glucose|1-protocatechuoyl-beta-D-glucopyranose|1-protocatechuoyl-beta-D-glucose|beta-D-glucosyl 3,4-dihydroxybenzoate 1-O-(3,4-dihydroxybenzoyl)-beta-D-glucopyranose 1-(3,4-dihydroxybenzoyl)-beta-D-glucose|1-O-(3,4-dihydroxy-benzoyl)-beta-D-glucose|1-O-(3,4-dihydroxybenzoyl)-beta-D-glucopyranose|1-O-(3,4-dihydroxybenzoyl)-beta-D-glucose|1-O-protocatechuoyl-beta-D-glucopyranose|1-O-protocatechuoyl-beta-D-glucose|1-protocatechuoyl-beta-D-glucopyranose|1-protocatechuoyl-beta-D-glucose|beta-D-glucosyl 3,4-dihydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_136876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136879 biolink:ChemicalEntity 5-(carboxymethoxy)uridine 5'-phosphate(2-) residue An organic anionic group obtained by deprotonation of the carboxy and phosphate OH groups of 5-(carboxymethoxy)uridine 5'-phosphate residue. Major microspecies at pH 7.4. pubmed:23676670|pubmed:25855808 Graph 5-(carboxymethoxy)uridine 5'-phosphate residue 5-(carboxymethoxy)uridine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_136879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136881 biolink:ChemicalEntity 3-carboxy-3-hydroxypropanoyl-CoA(5-) An ω-carboxyacyl-CoA(5−) obtained by deprotonation of the phosphate, diphosphate and carboxy groups of any 3-carboxy-3-hydroxypropanoyl-CoA; major species at pH 7.3. metacyc.compound:CPD-15846 Graph 3-carboxy-3-hydroxypropanoyl-CoA|3-malyl-CoA(5-)|malyl-CoA(5-) 3-carboxy-3-hydroxypropanoyl-CoA|3-malyl-CoA(5-)|malyl-CoA(5-) http://purl.obolibrary.org/obo/CHEBI_136881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136889 biolink:ChemicalEntity 5beta steroid Any steroid that has β-configuration at position 5. Graph 5beta steroids|5beta-steroid|5beta-steroids 5beta steroids|5beta-steroid|5beta-steroids http://purl.obolibrary.org/obo/CHEBI_136889 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136891 biolink:ChemicalEntity 2'-unsubstituted isoflavones An isoflavone that has an H at position 2' Graph a 2'-unsubstituted isoflavone a 2'-unsubstituted isoflavone http://purl.obolibrary.org/obo/CHEBI_136891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136895 biolink:ChemicalEntity dTDP-L-rhamnose(2-) A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of dTDP-L-rhamnose; major species at pH 7.3. Graph dTDP-L-rhamnose dTDP-L-rhamnose http://purl.obolibrary.org/obo/CHEBI_136895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136896 biolink:ChemicalEntity 5'-(5'-triphosphoguanosine)-(purine-ribonucleotide)(3-) residue An organic anionic group obtained by deprotonation of the triphosphate OH groups of any 5'-(5'-triphosphoguanosine)-(purine-ribonucleotide) residue; major species at pH 7.3. metacyc.compound:G5-pppR-mRNAs Graph a 5'-(5'-triphosphoguanosine)-(purine-ribonucleoside) residue a 5'-(5'-triphosphoguanosine)-(purine-ribonucleoside) residue http://purl.obolibrary.org/obo/CHEBI_136896 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136909 biolink:ChemicalEntity ginkgolide Organic heterohexacyclic compounds that are diterpenoid trilactones found in the ginkgo tree (also known as the maidenhair tree, Ginkgo biloba). They have a cage skeleton consisting of six 5-membered rings (a spiro[4.4]nonane carbobicyclic ring, three lactones and a tetrahydrofuran ring) which includes a tert-butyl substituent. The ginkolides vary only in the number and positions of their hydroxy substituents. pubmed:15038029|pubmed:15993092|pubmed:18179689|pubmed:20707065|pubmed:21614751|pubmed:23922456|pubmed:27562518|pubmed:27743504|pubmed:27915195|wikipedia.en:Ginkgolide Graph ginkgolides ginkgolides http://purl.obolibrary.org/obo/CHEBI_136909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136912 biolink:ChemicalEntity 1,2-diacyl-sn-glycero-3-phospholipid A glycerophospholipid, where R1 and R2 are acyl chains and R3 any of the groups that represent the different phospholipid classes (choline, ethanolamine, glycerol, etc). Graph 1,2-diacyl-sn-glycero-3-phospholipids|a glycerophospholipid 1,2-diacyl-sn-glycero-3-phospholipids|a glycerophospholipid http://purl.obolibrary.org/obo/CHEBI_136912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136913 biolink:ChemicalEntity monoacyl-sn-glycero-3-phospholipid A glycerophospholipid that is a lysophospholipid where only R1 or R2 is an acyl chain, the other is a hydrogen, and R3 is any group that represents the different classes of glycerophospholipids (choline, ethanolamine, inositol, etc). Graph a monoacylglycerophospholipid a monoacylglycerophospholipid http://purl.obolibrary.org/obo/CHEBI_136913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136960 biolink:ChemicalEntity ditrans,polycis-polyprenyl diphosphate(3-) An organophosphate oxoanion obtained by deprotonation of the diphosphate OH groups of any ditrans,polycis-polyprenyl diphosphate; major species at pH 7.3. Graph alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-2-methyl-4-{[(phosphonatooxy)phosphinato]oxy}but-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dehydrodolichol diphosphate(3-)|dehydrodolichyl diphosphate(3-)|di-trans,poly-cis-polyprenyl diphosphate alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-2-methyl-4-{[(phosphonatooxy)phosphinato]oxy}but-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-2-methyl-4-{[(phosphonatooxy)phosphinato]oxy}but-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dehydrodolichol diphosphate(3-)|dehydrodolichyl diphosphate(3-)|di-trans,poly-cis-polyprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_136960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136962 biolink:ChemicalEntity peptidylamide(1+) A peptide cation obtained by protonation of the amino terminus of any peptidylamide; major species at pH 7.3. Graph peptidyl amide(1+)|peptidylamide peptidyl amide(1+)|peptidylamide http://purl.obolibrary.org/obo/CHEBI_136962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136966 biolink:ChemicalEntity 3beta-hydroxysteroid-4alpha-carboxylate A steroid acid anion that has a carboxylate group located at the 4α-position together with a hydroxy substituent located at the 3β-position. Major microspecies at pH 7.4. metacyc.compound:3beta-hydroxy-4alpha-carboxy-sterols|pubmed:9811880 Graph 3beta-hydroxy-4alpha-carboxylato steroid|3beta-hydroxy-4alpha-carboxylato steroids|3beta-hydroxy-4alpha-carboxylato-steroid|3beta-hydroxy-4alpha-carboxylato-steroids|3beta-hydroxysteroid-4alpha-carboxylates|a 3beta-hydroxysteroid-4alpha-carboxylate 3beta-hydroxy-4alpha-carboxylato steroid|3beta-hydroxy-4alpha-carboxylato steroids|3beta-hydroxy-4alpha-carboxylato-steroid|3beta-hydroxy-4alpha-carboxylato-steroids|3beta-hydroxysteroid-4alpha-carboxylates|a 3beta-hydroxysteroid-4alpha-carboxylate http://purl.obolibrary.org/obo/CHEBI_136966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136989 biolink:ChemicalEntity N-[(5Z,11Z,14Z)-8,9-epoxyicosatrienoyl]ethanolamine An N-(polyunsaturated fatty acyl)ethanolamine obtained by formal epoxidation across the 8,9-double bond of anandamide. lipidmaps:LMFA08040033|pubmed:20702771|pubmed:21689782|pubmed:27000802|reaxys:11069012 Graph (5Z)-N-(2-hydroxyethyl)-7-{3-[(2Z,5Z)-undeca-2,5-dien-1-yl]oxiran-2-yl}hept-5-enamide|8(9)-EpETrE-EA|8,9-EET-EA|N-(8,9-epoxy-5Z,11Z,14Z-eicosatrienoyl)-ethanolamine|N-(8,9-epoxy-5Z,11Z,14Z-icosatrienoyl)ethanolamine (5Z)-N-(2-hydroxyethyl)-7-{3-[(2Z,5Z)-undeca-2,5-dien-1-yl]oxiran-2-yl}hept-5-enamide (5Z)-N-(2-hydroxyethyl)-7-{3-[(2Z,5Z)-undeca-2,5-dien-1-yl]oxiran-2-yl}hept-5-enamide|8(9)-EpETrE-EA|8,9-EET-EA|N-(8,9-epoxy-5Z,11Z,14Z-eicosatrienoyl)-ethanolamine|N-(8,9-epoxy-5Z,11Z,14Z-icosatrienoyl)ethanolamine http://purl.obolibrary.org/obo/CHEBI_136989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136990 biolink:ChemicalEntity N-[(5Z,8Z,14Z)-11,12-epoxyicosatrienoyl]ethanolamine An N-(polyunsaturated fatty acyl)ethanolamine obtained by formal epoxidation across the 11,12-double bond of anandamide. hmdb:HMDB0013652|lipidmaps:LMFA08040034|pubmed:20702771|pubmed:21689782|pubmed:27000802|reaxys:11069011 Graph (5Z,8Z)-N-(2-hydroxyethyl)-10-{3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,8-dienamide|11(12)-EET-EA|11(12)-EpETrE-EA|11,12-EET-EA|N-(11,12-epoxy-5Z,8Z,14Z-eicosatrienoyl)-ethanolamine|N-(11,12-epoxy-5Z,8Z,14Z-icosatrienoyl)ethanolamine (5Z,8Z)-N-(2-hydroxyethyl)-10-{3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,8-dienamide (5Z,8Z)-N-(2-hydroxyethyl)-10-{3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,8-dienamide|11(12)-EET-EA|11(12)-EpETrE-EA|11,12-EET-EA|N-(11,12-epoxy-5Z,8Z,14Z-eicosatrienoyl)-ethanolamine|N-(11,12-epoxy-5Z,8Z,14Z-icosatrienoyl)ethanolamine http://purl.obolibrary.org/obo/CHEBI_136990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136991 biolink:ChemicalEntity N-[(5Z,8Z,11Z)-14,15-epoxyicosatrienoyl]ethanolamine An N-(polyunsaturated fatty acyl)ethanolamine obtained by formal epoxidation across the 14,15-double bond of anandamide. lipidmaps:LMFA08040035|pubmed:17272674|pubmed:18698000|pubmed:20702771|pubmed:21289075|pubmed:21689782|pubmed:27000802|reaxys:11069010 Graph (5Z,8Z,11Z)-N-(2-hydroxyethyl)-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienamide|14(15)-EET-EA|14(15)-EpETrE-EA|14,15-EET-EA|14,15-epoxy-5,8,11-icosatrienoic acid ethanolamide|N-(14,15-epoxy-5Z,8Z,11Z-eicosatrienoyl)-ethanolamine|N-(14,15-epoxy-5Z,8Z,11Z-icosatrienoyl)ethanolamine|N-[(5Z,8Z,11Z)-14,15-epoxyicosatrienoyl]ethanolamine (5Z,8Z,11Z)-N-(2-hydroxyethyl)-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienamide (5Z,8Z,11Z)-N-(2-hydroxyethyl)-13-(3-pentyloxiran-2-yl)trideca-5,8,11-trienamide|14(15)-EET-EA|14(15)-EpETrE-EA|14,15-EET-EA|14,15-epoxy-5,8,11-icosatrienoic acid ethanolamide|N-(14,15-epoxy-5Z,8Z,11Z-eicosatrienoyl)-ethanolamine|N-(14,15-epoxy-5Z,8Z,11Z-icosatrienoyl)ethanolamine|N-[(5Z,8Z,11Z)-14,15-epoxyicosatrienoyl]ethanolamine http://purl.obolibrary.org/obo/CHEBI_136991 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:136997 biolink:ChemicalEntity L-polyhomomethionine A class of sulfur-containing amino acids consisting of homologues of methionine where there is a minimum of four methylene groups between the α-carbon and sulfur atoms. metacyc.compound:N-homo-methionine Graph L-polyhomomethionines|methionine homolog|methionine homologs|methionine homologue|methionine homologues L-polyhomomethionines|methionine homolog|methionine homologs|methionine homologue|methionine homologues http://purl.obolibrary.org/obo/CHEBI_136997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137000 biolink:ChemicalEntity C-terminal Xaa-Gly(1-) residue An organic anionic group obtained by deprotonation of the OH group of C-terminal Xaa-Gly residue Graph C-terminal Xaa-Gly residue C-terminal Xaa-Gly residue http://purl.obolibrary.org/obo/CHEBI_137000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137001 biolink:ChemicalEntity C-terminal alpha-amino-acid amide residue An alkylamino group derived from any α-amino-acid amide. pubmed:15198673|pubmed:2207061 Graph C-terminal alpha-amino-acid amide residue C-terminal alpha-amino-acid amide residue http://purl.obolibrary.org/obo/CHEBI_137001 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137003 biolink:ChemicalEntity C-terminal Xaa-hydroxyglycino(1-) residue An organic anionic group obtained by deprotonation of the OH group of C-terminal Xaa-hydroxyglycino residue. pubmed:15198673|pubmed:2207061|pubmed:3453894 Graph C-terminal Xaa-hydroxyglycino residue C-terminal Xaa-hydroxyglycino residue http://purl.obolibrary.org/obo/CHEBI_137003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137011 biolink:ChemicalEntity resolvin T1 A docosanoid that is (8E,10Z,14E,16Z,18E)-docosapentaenoic acid carrying three hydroxy substituents at positions 7, 13 and 20. pubmed:26236990|pubmed:27704804 Graph (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoic acid|(8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosapentaenoic acid|RvT1 (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoic acid (8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosa-8,10,14,16,18-pentaenoic acid|(8E,10Z,14E,16Z,18E)-7,13,20-trihydroxydocosapentaenoic acid|RvT1 http://purl.obolibrary.org/obo/CHEBI_137011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137018 biolink:ChemicalEntity resolvin T2 A docosanoid that is (8Z,10E,14E,16Z,19Z)-docosapentaenoic acid carrying three hydroxy substituents at positions 7, 12 and 13. pubmed:26236990|pubmed:27704804 Graph (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoic acid|(8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosapentaenoic acid|13-series resolvin 2|RvT2 (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoic acid (8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosa-8,10,14,16,19-pentaenoic acid|(8Z,10E,14E,16Z,19Z)-7,12,13-trihydroxydocosapentaenoic acid|13-series resolvin 2|RvT2 http://purl.obolibrary.org/obo/CHEBI_137018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137019 biolink:ChemicalEntity resolvin T3 A docosanoid that is (9E,11E,14E,16Z,19Z)-docosapentaenoic acid carrying three hydroxy substituents at positions 7, 8 and 13. pubmed:26236990|pubmed:27704804 Graph (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoic acid|(9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosapentaenoic acid|13-series resolvin 3|RvT3 (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoic acid (9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosa-9,11,14,16,19-pentaenoic acid|(9E,11E,14E,16Z,19Z)-7,8,13-trihydroxydocosapentaenoic acid|13-series resolvin 3|RvT3 http://purl.obolibrary.org/obo/CHEBI_137019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137020 biolink:ChemicalEntity resolvin T4 A docosanoid that is (8E,10Z,14E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 7 and 13. pubmed:26236990|pubmed:27704804 Graph (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoic acid|(8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosapentaenoic acid|13-series resolvin 4|RvT4 (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoic acid (8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosa-8,10,14,16,19-pentaenoic acid|(8E,10Z,14E,16Z,19Z)-7,13-dihydroxydocosapentaenoic acid|13-series resolvin 4|RvT4 http://purl.obolibrary.org/obo/CHEBI_137020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137034 biolink:ChemicalEntity (18S)-resolvin E2 A member of the class of resolvins that is (6E,8Z,11Z,14Z,16E)-icosapentaenoic acid carrying two hydroxy substituents at positions 5 and 18 (the 5S,18S stereoisomer). lipidmaps:LMFA03070036|pubmed:21206090|pubmed:21712098 Graph (5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosapentaenoic acid|18S-RvE2|18S-resolvin E2|5S,18S-dihydroxy-6E,8Z,11Z,14Z,16E-eicosapentaenoic acid (5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoic acid (5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-eicosapentaenoic acid|(5S,18S)-dihydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoic acid|(5S,6E,8Z,11Z,14Z,16E,18S)-5,18-dihydroxyicosapentaenoic acid|18S-RvE2|18S-resolvin E2|5S,18S-dihydroxy-6E,8Z,11Z,14Z,16E-eicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_137034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137038 biolink:ChemicalEntity (18S)-resolvin E1 A resolvin that is (6Z,8E,10E,14Z,16E)-icosa-6,8,10,14,16-pentaenoic acid which is substituted at positions 5, 12 and 18 by hydroxy groups (the 5S,12R,18S stereoisomer). lipidmaps:LMFA03070035|pubmed:21206090|pubmed:21712098 Graph (5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-eicosapentaenoic acid|(5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-icosapentaenoic acid|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoic acid|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosapentaenoic acid|18S-RvE1|18S-resolvin E1|5S,12R,18S-trihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid (5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoic acid (5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-eicosapentaenoic acid|(5S,12R,18S)-trihydroxy-(6Z,8E,10E,14Z,16E)-icosapentaenoic acid|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosa-6,8,10,14,16-pentaenoic acid|(5S,6Z,8E,10E,12R,14Z,16E,18S)-5,12,18-trihydroxyicosapentaenoic acid|18S-RvE1|18S-resolvin E1|5S,12R,18S-trihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_137038 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137040 biolink:ChemicalEntity short chain fatty acyl-CoA(4-) A fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any short-chain fatty acyl-CoA; major species at pH 7.3. Graph a short-chain fatty acyl-CoA a short-chain fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_137040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137041 biolink:ChemicalEntity quinine(1+) The monoprotonated form of quinine, the predominant species at pH7.3. Graph (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium|quinine (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium|quinine http://purl.obolibrary.org/obo/CHEBI_137041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137043 biolink:ChemicalEntity N-[(+)-7-isojasmonyl]-L-isoleucine An L-isoleucine derivative resulting from the formal condensation of the carboxy group of (+)-7-isojasmonic acid with the amino group of L-isoleucine. metacyc.compound:CPD-11259|pubmed:19349968|pubmed:19716757|pubmed:19796781|pubmed:20012084|pubmed:20025249|pubmed:20391333|pubmed:20404483|pubmed:22825635|pubmed:23011567|pubmed:23821155|pubmed:24691578|pubmed:25008776|pubmed:26675361|pubmed:27756820|reaxys:18883677 Graph (+)-7-iso-JA-Ile|(+)-7-iso-JA-L-Ile|(+)-7-isojasmonic acid-L-isoleucine conjugate|(+)-7-isojasmonyl-L-isoleucine|(2S,3S)-3-methyl-2-(2-{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoic acid|(3R,7S)-JA-L-Ile|N-({(R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine|N-[(+)-7-isojasmonyl]isoleucine|iso-JA-Ile N-({(R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine (+)-7-iso-JA-Ile|(+)-7-iso-JA-L-Ile|(+)-7-isojasmonic acid-L-isoleucine conjugate|(+)-7-isojasmonyl-L-isoleucine|(2S,3S)-3-methyl-2-(2-{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoic acid|(3R,7S)-JA-L-Ile|N-({(R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine|N-[(+)-7-isojasmonyl]isoleucine|iso-JA-Ile http://purl.obolibrary.org/obo/CHEBI_137043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137044 biolink:ChemicalEntity N-[(+)-12-hydroxy-7-isojasmonyl]isoleucine An L-isoleucine derivative resulting from the formal condensation of the carboxy group of (+)-12-hydroxy-7-isojasmonic acid with the amino group of L-isoleucine. metacyc.compound:CPD-13420 Graph (+)-7-iso-12-hydroxyjasmonoyl-L-isoleucine|(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoic acid|(3R,7S)-12-OH-JA-Ile|(3R,7S)-12-hydroxyjasmonoyl-L-isoleucine|(3R,7S)-12-hydroxyjasmonoyl-isoleucine|12-OH-7-iso-JA-Ile|12-OH-7-iso-JA-L-Ile|7-iso-12-OH-JA-Ile|7-iso-12-OH-JA-L-Ile|N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine|N-[(3R,7S)-12-hydroxyjasmonyl]-L-isoleucine|N-tuberonyl-L-isoleucine|N-tuberonylisoleucine N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine (+)-7-iso-12-hydroxyjasmonoyl-L-isoleucine|(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoic acid|(3R,7S)-12-OH-JA-Ile|(3R,7S)-12-hydroxyjasmonoyl-L-isoleucine|(3R,7S)-12-hydroxyjasmonoyl-isoleucine|12-OH-7-iso-JA-Ile|12-OH-7-iso-JA-L-Ile|7-iso-12-OH-JA-Ile|7-iso-12-OH-JA-L-Ile|N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine|N-[(3R,7S)-12-hydroxyjasmonyl]-L-isoleucine|N-tuberonyl-L-isoleucine|N-tuberonylisoleucine http://purl.obolibrary.org/obo/CHEBI_137044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13705 biolink:ChemicalEntity acetoacetate A 3-oxo monocarboxylic acid anion that is the conjugate base of acetoacetic acid, arising from deprotonation of the carboxy group. cas:141-81-1|kegg.compound:C00164|metacyc.compound:3-KETOBUTYRATE|reaxys:4128534|umbbd.compound:c0069 Graph 3-oxobutanoate|Acetoacetate|Acetoacetate ion(1-)|Butanoic acid, 3-oxo-, ion(1-)|acetoacetate 3-oxobutanoate 3-oxobutanoate|Acetoacetate|Acetoacetate ion(1-)|Butanoic acid, 3-oxo-, ion(1-)|acetoacetate http://purl.obolibrary.org/obo/CHEBI_13705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137079 biolink:ChemicalEntity eukaryotic initiation factor 4F inhibitor Any compound that inihibits the mammalian protein, eukaryotic initiation factor 4F. Graph eIF4F inhibitor|eIF4F inhibitors|eukaryotic initiation factor 4F inhibitors eIF4F inhibitor|eIF4F inhibitors|eukaryotic initiation factor 4F inhibitors http://purl.obolibrary.org/obo/CHEBI_137079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137108 biolink:ChemicalEntity 5-dehydro-L-gluconate A ketogluconate that is the conjugate base of 5-dehydro-L-gluconic acid, obtained by deprotonation of the carboxy group. Major microspecies at pH 7.3 metacyc.compound:CPD-14806|pubmed:23038265|pubmed:23441918 Graph 5-dehydro-L-gluconate|5-keto-L-gluconate|L-5-ketogluconate|L-5-oxogluconate|L-xylo-hex-5-ulosonate L-xylo-hex-5-ulosonate 5-dehydro-L-gluconate|5-keto-L-gluconate|L-5-ketogluconate|L-5-oxogluconate|L-xylo-hex-5-ulosonate http://purl.obolibrary.org/obo/CHEBI_137108 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137109 biolink:ChemicalEntity (2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid A ketoaldonic acid phosphate consisting of (2ξ)-3-deoxy-β-D-threo-hept-6-ulopyranosonic acid carrying a single phospho substituent at position 7. Graph (2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid|7-phospho-2-dehydro-3-deoxy-D-arabino-heptonic acid (ring form) (2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid (2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid|7-phospho-2-dehydro-3-deoxy-D-arabino-heptonic acid (ring form) http://purl.obolibrary.org/obo/CHEBI_137109 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13711 biolink:ChemicalEntity acetyl phosphate(1-) An acyl monophosphate(1−) that is the conjugate base of acetyl dihydrogen phosphate. Graph acetyl hydrogen phosphate acetyl hydrogen phosphate acetyl hydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_13711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137123 biolink:ChemicalEntity EC 2.7.11.30 (receptor protein serine/threonine kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the activity of receptor protein serine/threonine kinase (EC 2.7.11.30). wikipedia.en:Receptor_protein_serine/threonine_kinase Graph ATP:[receptor-protein] phosphotransferase inhibitor|ATP:[receptor-protein] phosphotransferase inhibitors|EC 2.7.11.30 (receptor protein serine/threonine kinase) inhibitors|EC 2.7.11.30 inhibitor|EC 2.7.11.30 inhibitors|STK13 inhibitor|STK13 inhibitors|TGF-beta kinase inhibitor|TGF-beta kinase inhibitors|activin receptor kinase inhibitor|activin receptor kinase inhibitors|inhibitor of receptor protein serine/threonine kinase|receptor protein serine/threonine kinase (EC 2.7.11.30) inhibitor|receptor protein serine/threonine kinase (EC 2.7.11.30) inhibitors|receptor protein serine/threonine kinase inhibitor|receptor protein serine/threonine kinase inhibitors|receptor serine/threonine protein kinase inhibitor|receptor serine/threonine protein kinase inhibitors|receptor type I serine/threonine protein kinase inhibitor|receptor type I serine/threonine protein kinase inhibitors|receptor type II serine/threonine protein kinase inhibitor|receptor type II serine/threonine protein kinase inhibitors ATP:[receptor-protein] phosphotransferase inhibitor|ATP:[receptor-protein] phosphotransferase inhibitors|EC 2.7.11.30 (receptor protein serine/threonine kinase) inhibitors|EC 2.7.11.30 inhibitor|EC 2.7.11.30 inhibitors|STK13 inhibitor|STK13 inhibitors|TGF-beta kinase inhibitor|TGF-beta kinase inhibitors|activin receptor kinase inhibitor|activin receptor kinase inhibitors|inhibitor of receptor protein serine/threonine kinase|receptor protein serine/threonine kinase (EC 2.7.11.30) inhibitor|receptor protein serine/threonine kinase (EC 2.7.11.30) inhibitors|receptor protein serine/threonine kinase inhibitor|receptor protein serine/threonine kinase inhibitors|receptor serine/threonine protein kinase inhibitor|receptor serine/threonine protein kinase inhibitors|receptor type I serine/threonine protein kinase inhibitor|receptor type I serine/threonine protein kinase inhibitors|receptor type II serine/threonine protein kinase inhibitor|receptor type II serine/threonine protein kinase inhibitors http://purl.obolibrary.org/obo/CHEBI_137123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137132 biolink:ChemicalEntity 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid An 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid that has 1S,2S-configuration. cas:204135-86-4|foodb.food:FDB001433|kegg.compound:C04780|knapsack:C00000366|lipidmaps:LMFA02010007|pubmed:16663643 Graph (1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid|(1S,2S)-3-oxo-2-(2Z)-2-pentenyl-cyclopentaneoctanoic acid|(1S,2S)-OPC8|(9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid|8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]octanoic acid|8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid|OPC-8:0 8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid (1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid|(1S,2S)-3-oxo-2-(2Z)-2-pentenyl-cyclopentaneoctanoic acid|(1S,2S)-OPC8|(9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid|8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]octanoic acid|8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid|OPC-8:0 http://purl.obolibrary.org/obo/CHEBI_137132 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137137 biolink:ChemicalEntity (5Z,7E)-(3S)-26,26,26-trifluoro-27-nor-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol lipidmaps:LMST03020024 Graph 26,26,26-trifluoro-25-hydroxy-27-norcholecalciferol|26,26,26-trifluoro-25-hydroxy-27-norvitamin D3 26,26,26-trifluoro-25-hydroxy-27-norcholecalciferol|26,26,26-trifluoro-25-hydroxy-27-norvitamin D3 http://purl.obolibrary.org/obo/CHEBI_137137 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13714 biolink:ChemicalEntity 1-O-acetylmaltose An O-acyl carbohydrate consisting of maltose carrying an anomeric O-acetyl substituent. Graph 1-O-acetyl-4-O-alpha-D-glucopyranosyl-D-glucopyranose|1-O-acetylmaltose|alpha-D-glucopyranosyl-(1->4)-1-O-acetyl-D-glucopyranose alpha-D-glucopyranosyl-(1->4)-1-O-acetyl-D-glucopyranose 1-O-acetyl-4-O-alpha-D-glucopyranosyl-D-glucopyranose|1-O-acetylmaltose|alpha-D-glucopyranosyl-(1->4)-1-O-acetyl-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_13714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137149 biolink:ChemicalEntity 1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerol lipidmaps:LMGL02070009 Graph http://purl.obolibrary.org/obo/CHEBI_137149 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137155 biolink:ChemicalEntity phosphatidylserine 36:3 Graph PS(36:3) PS(36:3) http://purl.obolibrary.org/obo/CHEBI_137155 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137164 biolink:ChemicalEntity phosphatidic acid 36:3 Graph PA(36:3) PA(36:3) http://purl.obolibrary.org/obo/CHEBI_137164 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137179 biolink:ChemicalEntity UDP-2,3-diacyl-alpha-D-glucosamine(2-) A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups of any UDP-2,3-diacyl-α-D-glucosamine; major species at pH 7.3. pubmed:27006461 Graph UDP-2,3-diacyl-alpha-D-glucosamine UDP-2,3-diacyl-alpha-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_137179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137180 biolink:ChemicalEntity 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of any 2,3-diacyl-α-D-glucosaminyl 1-phosphate. Major microspecies at pH 7.3 pubmed:27006461 Graph 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate http://purl.obolibrary.org/obo/CHEBI_137180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137182 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc}-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAcl-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc}-Asn. metacyc.compound:N4-N-ACETYL-BETA-D-GLUCOSAMINYL-F Graph N(4)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-(alpha-L-Fuc-(1->3))-beta-D-GlcNAc)-Asn residue N(4)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-(alpha-L-Fuc-(1->3))-beta-D-GlcNAc)-Asn residue http://purl.obolibrary.org/obo/CHEBI_137182 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137186 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-[beta-D-Xyl-(1->2)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc}-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-[β-D-Xyl-(1→2)]-β-D-Man-(1→4)-β-D-GlcNAcl-(1→4)-β-D-GlcNAc}-Asn. metacyc.compound:N4-N-ACETYL-BETA-D-GLUCOSAMINYL-X Graph N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-[beta-D-Xyl-(1->2)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc}-L-Asn residue N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-[beta-D-Xyl-(1->2)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc}-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_137186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13719 biolink:ChemicalEntity acetylsalicylate A benzoate that is the conjugate base of acetylsalicylic acid, arising from deprotonation of the carboxy group. hmdb:HMDB0001879|metacyc.compound:CPD-524|reaxys:3906821 Graph 2-(acetyloxy)benzoate|acetylsalicylate 2-(acetyloxy)benzoate 2-(acetyloxy)benzoate|acetylsalicylate http://purl.obolibrary.org/obo/CHEBI_13719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1372 biolink:ChemicalEntity 1-pyrroline-5-carboxylic acid A 1-pyrrolinecarboxylic acid that is 1-pyrroline in which one of the hydrogens at position 5 is replaced by a carboxy group. cas:2906-39-0|hmdb:HMDB0001301|kegg.compound:C04322|reaxys:111941 Graph 3,4-Dihydro-2H-Pyrrole-2-carboxylate|3,4-dihydro-2H-pyrrole-2-carboxylic acid|Delta(1)-pyrroline-5-carboxylic acid 3,4-dihydro-2H-pyrrole-2-carboxylic acid 3,4-Dihydro-2H-Pyrrole-2-carboxylate|3,4-dihydro-2H-pyrrole-2-carboxylic acid|Delta(1)-pyrroline-5-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_1372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137207 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-[alpha-L-Fuc-(1->6)]-beta-D-GlcNAc}-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAcl-(1→4)-[α-L-Fuc-(1→6)]-β-D-GlcNAc}-Asn. metacyc.compound:N4-N-ACETYL-BETA-D-GLUCOSAMINYL-F6 Graph an N(4)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-(alpha-L-Fuc-(1->6))-beta-D-GlcNAc)-L-Asn residue an N(4)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-(beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6))-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-(alpha-L-Fuc-(1->6))-beta-D-GlcNAc)-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_137207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137218 biolink:ChemicalEntity 3-methyladenine DNA pubmed:10675345 Graph http://purl.obolibrary.org/obo/CHEBI_137218 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137236 biolink:ChemicalEntity ilomastat An N-acyl-amino acid obtained by formal condensation of the carboxy group of (2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoic acid with the amino group of N-methyl-L-tryptophanamide. A cell permeable broad-spectrum matrix metalloproteinase (MMP) inhibitor cas:142880-36-2|kegg.drug:D03793|lincs.smallmolecule:LSM-3143|pdb-ccd:GM6|pubmed:12410973|pubmed:14568001|pubmed:15350544|pubmed:16565079|pubmed:16712832|pubmed:18782669|pubmed:18790756|pubmed:18837084|pubmed:19545667|pubmed:20299089|pubmed:20818082|pubmed:21040999|pubmed:21146503|pubmed:22512086|pubmed:22903888|pubmed:23141517|pubmed:23870824|pubmed:24380772|pubmed:24589605|pubmed:25576979|pubmed:26171681|pubmed:26394037|pubmed:27038494|pubmed:27112177|pubmed:27296149|pubmed:27708133|pubmed:27743382|pubmed:28297575|pubmed:28298987|pubmed:28417261|reaxys:7982373|wikipedia.en:Ilomastat Graph (2R)-N(4)-hydroxy-N(1)-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide|CS 610|GM 6001|GM-6001|GM6001|galardin|ilomastat (2R)-N(4)-hydroxy-N(1)-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide (2R)-N(4)-hydroxy-N(1)-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide|CS 610|GM 6001|GM-6001|GM6001|galardin|ilomastat http://purl.obolibrary.org/obo/CHEBI_137236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137257 biolink:ChemicalEntity omega-[(methylsulfanyl)alkyl]glucosinolic acid A thia-alkylglucosinolic acid in which the thia-alkyl substituent can be any ω-(methylsulfanyl)alkyl group. metacyc.compound:Aliphatic-glucosinolates Graph omega-[(methylsulfanyl)alkyl]glucosinolic acids omega-[(methylsulfanyl)alkyl]glucosinolic acids http://purl.obolibrary.org/obo/CHEBI_137257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137328 biolink:ChemicalEntity epoxy(hydroxy)icosatrienoate An icosanoid anion obtained by the deprotonation of the carboxy group of any epoxy(hydroxy)icosatrienoic acid. Graph HEETA anion|HEETA(1-)|a hydroxy-epoxy-eicosatetraenoate|epoxy(hydroxy)eicosatrienoate|epoxy(hydroxy)eicosatrienoates|epoxy(hydroxy)icosatrienoates HEETA anion|HEETA(1-)|a hydroxy-epoxy-eicosatetraenoate|epoxy(hydroxy)eicosatrienoate|epoxy(hydroxy)eicosatrienoates|epoxy(hydroxy)icosatrienoates http://purl.obolibrary.org/obo/CHEBI_137328 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137346 biolink:ChemicalEntity (14R)-HDoHE A 14-HDoHE in which the stereocentre at position 14 has R-configuration. pubmed:19965612|pubmed:25200603|reaxys:27627498 Graph (14R)-HDHA|(14R)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosahexaenoic acid|14(R)-HDoHE (4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14R)-HDHA|(14R)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14-hydroxydocosahexaenoic acid|14(R)-HDoHE http://purl.obolibrary.org/obo/CHEBI_137346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137347 biolink:ChemicalEntity (14S)-HDoHE A 14-HDoHE in which the stereocentre at position 14 has S-configuration. pubmed:25200603|reaxys:5564836 Graph (14S)-HDHA|(14S)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosahexaenoic acid|14(S)-HDoHE|14S-HDHA (4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14S)-HDHA|(14S)-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14-hydroxydocosahexaenoic acid|14(S)-HDoHE|14S-HDHA http://purl.obolibrary.org/obo/CHEBI_137347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137348 biolink:ChemicalEntity dihydroxydocosahexaenoic acid A docosanoid that consists of any docosahexaenoic acid carrying two hydroxy substituents at unspecified positions. Graph DiHDHA|DiHDoHE DiHDHA|DiHDoHE http://purl.obolibrary.org/obo/CHEBI_137348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137349 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14S- and 22-positions. pubmed:25200603|reaxys:27627499 Graph (14S,22)-DiHDoHE|(14S,22)-diHDHA|(14S,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),22-diHDHA|14(S),22-dihydroxydocosahexaenoic acid|MaR-L1|maresin-L1 (4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14S,22)-DiHDoHE|(14S,22)-diHDHA|(14S,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),22-diHDHA|14(S),22-dihydroxydocosahexaenoic acid|MaR-L1|maresin-L1 http://purl.obolibrary.org/obo/CHEBI_137349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137350 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14R- and 22-positions. pubmed:25200603|reaxys:27627500 Graph (14R,22)-DiHDoHE|(14R,22)-diHDHA|(14R,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),22-diHDHA|14(R),22-dihydroxydocosahexaenoic acid|MaR-L2|maresin-L2 (4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14R,22)-DiHDoHE|(14R,22)-diHDHA|(14R,22)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),22-diHDHA|14(R),22-dihydroxydocosahexaenoic acid|MaR-L2|maresin-L2 http://purl.obolibrary.org/obo/CHEBI_137350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137354 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14S- and 21R-positions. pubmed:19965612|pubmed:21112969|pubmed:21839062|pubmed:21846180|pubmed:23386851 Graph (14S,21R)-DiHDoHE|(14S,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),21(R)-dihydroxydocosahexaenoic acid|14S,21R-diHDHA (4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14S,21R)-DiHDoHE|(14S,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),21(R)-dihydroxydocosahexaenoic acid|14S,21R-diHDHA http://purl.obolibrary.org/obo/CHEBI_137354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137360 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14S- and 21S-positions. pubmed:19965612 Graph (14S,21S)-DiHDoHE|(14S,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),21(S)-diHDHA|14(S),21(S)-dihydroxydocosahexaenoic acid|14S,21S-diHDHA (4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14S,21S)-DiHDoHE|(14S,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14S,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(S),21(S)-diHDHA|14(S),21(S)-dihydroxydocosahexaenoic acid|14S,21S-diHDHA http://purl.obolibrary.org/obo/CHEBI_137360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137361 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14R- and 21R-positions. pubmed:19965612 Graph (14R,21R)-DiHDoHE|(14R,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),21(R)-dihydroxydocosahexaenoic acid|14R,21R-diHDHA (4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14R,21R)-DiHDoHE|(14R,21R)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z,21R)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),21(R)-dihydroxydocosahexaenoic acid|14R,21R-diHDHA http://purl.obolibrary.org/obo/CHEBI_137361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137368 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 14R- and 21S-positions. pubmed:19965612 Graph (14R,21S)-DiHDoHE|(14R,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),21(S)-diHDHA|14(R),21(S)-dihydroxydocosahexaenoic acid|14R,21S-diHDHA (4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid (14R,21S)-DiHDoHE|(14R,21S)-dihydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid|(4Z,7Z,10Z,12E,14R,16Z,19Z,21S)-14,21-dihydroxydocosa-4,7,10,12,16,19-hexaenoic acid|14(R),21(S)-diHDHA|14(R),21(S)-dihydroxydocosahexaenoic acid|14R,21S-diHDHA http://purl.obolibrary.org/obo/CHEBI_137368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137401 biolink:ChemicalEntity capsaicin receptor agonist An agonist that binds to and activates capsaicin receptors wikipedia.en:TRPV1 Graph TRPV1 agonist|TRPV1 agonists|capsaicin agonist|capsaicin agonists|capsaicin receptor agonists|transient receptor potential cation channel subfamily V member 1 agonist|transient receptor potential cation channel subfamily V member 1 agonists|vanilloid receptor 1 agonist|vanilloid receptor 1 agonists TRPV1 agonist|TRPV1 agonists|capsaicin agonist|capsaicin agonists|capsaicin receptor agonists|transient receptor potential cation channel subfamily V member 1 agonist|transient receptor potential cation channel subfamily V member 1 agonists|vanilloid receptor 1 agonist|vanilloid receptor 1 agonists http://purl.obolibrary.org/obo/CHEBI_137401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137405 biolink:ChemicalEntity (S)-2-halocarboxylic acid anion A carboxylic acid anion obtained by deprotonation of the carboxy group of any (S)-2-halocarboxylic acid; major species at pH 7.3. metacyc.compound:S-2-Haloacids Graph (S)-2-haloacids|(S)-2-halocarboxylate|(S)-2-halocarboxylates|(S)-2-halocarboxylic acid anions|an (S)-2-haloacid (S)-2-haloacids|(S)-2-halocarboxylate|(S)-2-halocarboxylates|(S)-2-halocarboxylic acid anions|an (S)-2-haloacid http://purl.obolibrary.org/obo/CHEBI_137405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137406 biolink:ChemicalEntity (R)-2-halocarboxylic acid anion A carboxylic acid anion obtained by deprotonation of the carboxy group of any (R)-2-halocarboxylic acid; major species at pH 7.3. metacyc.compound:R-2-Haloacids Graph (R)-2-haloacids|(R)-2-halocarboxylate|(R)-2-halocarboxylates|(R)-2-halocarboxylic acid anions|an (R)-2-haloacid (R)-2-haloacids|(R)-2-halocarboxylate|(R)-2-halocarboxylates|(R)-2-halocarboxylic acid anions|an (R)-2-haloacid http://purl.obolibrary.org/obo/CHEBI_137406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137407 biolink:ChemicalEntity (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(2-) A docosanoid anion obtained by deprotonation of the three carboxy groups and protonation of the glutamyl alpha -amino group of (13R)-S-glutathionyl-(14S )-hydroxy-(4Z,7Z,9E,11E,16 Z,19Z )-docosahexaenoic acid; major species at pH 7.3. pubmed:27791009 Graph (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR1(2-) (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-{[(4S)-4-azaniumyl-4-carboxylatobutanoyl]amino}-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR1(2-) http://purl.obolibrary.org/obo/CHEBI_137407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137408 biolink:ChemicalEntity (13R)-glycinylcystein-S-yl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-) pubmed:27791009 Graph (13R)-S-cysteinylglycyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR2(1-) (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate (13R)-S-cysteinylglycyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR2(1-) http://purl.obolibrary.org/obo/CHEBI_137408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137410 biolink:ChemicalEntity (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-) pubmed:27791009 Graph (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR3(1-) (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate|MCTR3(1-) http://purl.obolibrary.org/obo/CHEBI_137410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137419 biolink:ChemicalEntity secondary ammonium ion An organic cation obtained by protonation of any secondary amino compound; major species at pH 7.3. metacyc.compound:Secondary-Amines Graph a secondary amine|secondary amine(1+) a secondary amine|secondary amine(1+) http://purl.obolibrary.org/obo/CHEBI_137419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137431 biolink:ChemicalEntity antihypotensive agent A cardiovascular drug that tends to raise reduced blood pressure. wikipedia.en:Antihypotensive_agent Graph antihypotensive agents|pressor|pressors|vasopressor agent|vasopressor agents antihypotensive agents|pressor|pressors|vasopressor agent|vasopressor agents http://purl.obolibrary.org/obo/CHEBI_137431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137442 biolink:ChemicalEntity (13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate A docosanoid anion that is the conjugate base of (13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z )-docosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:25036362 Graph (13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosahexaenoate|MaR2(1-)|maresin 2(1-) (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoate (13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoate|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosahexaenoate|MaR2(1-)|maresin 2(1-) http://purl.obolibrary.org/obo/CHEBI_137442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137443 biolink:ChemicalEntity furanochromone An organic heterotricyclic compound that is chromone which is ortho-fused to a furan ring and its substituted derivatives thereof. pubmed:12967041|pubmed:3768467|wikipedia.en:Furanochromone Graph furanochromones furanochromones http://purl.obolibrary.org/obo/CHEBI_137443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137495 biolink:ChemicalEntity 13(R)-HODE A 13-HODE in which the stereocentre at position 13 has S-configuration. cas:10219-69-9|reaxys:4316130 Graph (13R)-HODE|(13R)-hydroxy-(9Z,11E)-octadecadienoic acid|(9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoic acid|(9Z,11E,13R)-13-hydroxyoctadecadienoic acid (9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoic acid (13R)-HODE|(13R)-hydroxy-(9Z,11E)-octadecadienoic acid|(9Z,11E,13R)-13-hydroxyoctadeca-9,11-dienoic acid|(9Z,11E,13R)-13-hydroxyoctadecadienoic acid http://purl.obolibrary.org/obo/CHEBI_137495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137502 biolink:ChemicalEntity (S)-2,4-dihydroxy-3-oxobutanoic acid A ketoaldonic acid that is butyric acid carrying an oxo substituent at position 3 as well as two hydroxy substituents at positions 2 and 4 (the S-enantiomer). metacyc.compound:CPD-19884 Graph (2S)-2,4-dihydroxy-3-oxobutanoic acid|3-dehydro-D-threonic acid|3-dehydro-L-erythronic acid (2S)-2,4-dihydroxy-3-oxobutanoic acid (2S)-2,4-dihydroxy-3-oxobutanoic acid|3-dehydro-D-threonic acid|3-dehydro-L-erythronic acid http://purl.obolibrary.org/obo/CHEBI_137502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137504 biolink:ChemicalEntity quinoxaline herbicide A quinoxaline pesticide that has herbicidal activity. Graph quinoxaline herbicides quinoxaline herbicides http://purl.obolibrary.org/obo/CHEBI_137504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137507 biolink:ChemicalEntity quizalofop-P A 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid that has R configuration. An acetyl-CoA carboxylase inhibitor, it is used (generally as the corresponding ethyl or tefuryl ester proherbicides) for the control of annual and perennial grass weeds in sugar beet. cas:94051-08-8|pesticides:quizalofop-p|pubmed:24964043|pubmed:26971169|pubmed:28692891|reaxys:8395822 Graph (+)-quizalofop|(+)-quizalofop-acid|(2R)-2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid|(2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|(R)-(+)-quizalofop|(R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionic acid|(R)-quizalofop|DPX-Y 6202-31 (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid (+)-quizalofop|(+)-quizalofop-acid|(2R)-2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid|(2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|(R)-(+)-quizalofop|(R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionic acid|(R)-quizalofop|DPX-Y 6202-31 http://purl.obolibrary.org/obo/CHEBI_137507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137509 biolink:ChemicalEntity 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid A monocarboxylic acid that is 2-phenoxypropanoic acid in which the phenyl group is substituted at the para position by a (6-chloroquinoxalin-2-yl)oxy group. Graph 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid http://purl.obolibrary.org/obo/CHEBI_137509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137513 biolink:ChemicalEntity (S)-quizalofop A 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid that has S configuration. It is the (inactive) enantiomer of the herbicide quizalofop-P. Graph (-)-quizalofop|(-)-quizalofop-acid|(2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|(2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid (-)-quizalofop|(-)-quizalofop-acid|(2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid|(2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid http://purl.obolibrary.org/obo/CHEBI_137513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137514 biolink:ChemicalEntity TRPA1 channel agonist An agonist at the transient receptor potential cation channel A1 (TRPA1). wikipedia.en:TRPA1 Graph TRPA1 channel agonists|transient receptor potential ankyrin 1 agonist|transient receptor potential ankyrin 1 agonists|transient receptor potential cation channel A1 agonist|transient receptor potential cation channel A1 agonists TRPA1 channel agonists|transient receptor potential ankyrin 1 agonist|transient receptor potential ankyrin 1 agonists|transient receptor potential cation channel A1 agonist|transient receptor potential cation channel A1 agonists http://purl.obolibrary.org/obo/CHEBI_137514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137545 biolink:ChemicalEntity pivaloyl-CoA A short-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of pivalic acid. cas:137415-16-8|pdb-ccd:52O|pubmed:12429869|pubmed:1891775|pubmed:22167181|pubmed:22803641|pubmed:25720495|pubmed:26134562|reaxys:22539663 Graph 2,2-dimethylpropanoyl-CoA|2,2-dimethylpropionyl-CoA|3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(2,2-dimethylpropanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|pivalyl-CoA|pivalyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(2,2-dimethylpropanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 2,2-dimethylpropanoyl-CoA|2,2-dimethylpropionyl-CoA|3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(2,2-dimethylpropanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|pivalyl-CoA|pivalyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_137545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137550 biolink:ChemicalEntity N-(fatty acyl)-L-alpha-amino acid An N-acyl-L-α-amino acid resulting from the formal condensation of the carboxy group of any fatty acid with the amino group of any L-amino acid. Graph N-(fatty acyl)-L-alpha-amino acids N-(fatty acyl)-L-alpha-amino acids http://purl.obolibrary.org/obo/CHEBI_137550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137566 biolink:ChemicalEntity EC 2.5.1.48 (cystathionine gamma-synthase) inhibitor An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of cystathionine γ-synthase (EC 2.5.1.48). wikipedia.en:Cystathionine_gamma-synthase Graph 4-O-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitor|4-O-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitors|EC 2.5.1.48 (cystathionine gamma-synthase) inhibitors|EC 2.5.1.48 inhibitor|EC 2.5.1.48 inhibitors|O(4)-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitor|O(4)-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitors|O-succinyl-L-homoserine succinate-lyase (adding cysteine) inhibitor|O-succinyl-L-homoserine succinate-lyase (adding cysteine) inhibitors|O-succinylhomoserine (thiol)-lyase inhibitor|O-succinylhomoserine (thiol)-lyase inhibitors|O-succinylhomoserine synthase inhibitor|O-succinylhomoserine synthase inhibitors|O-succinylhomoserine synthetase inhibitor|O-succinylhomoserine synthetase inhibitors|cystathionine gamma-synthase inhibitor|cystathionine gamma-synthase inhibitors|cystathionine synthase inhibitor|cystathionine synthase inhibitors|cystathionine synthetase inhibitor|cystathionine synthetase inhibitors|homoserine O-transsuccinylase inhibitor|homoserine O-transsuccinylase inhibitors|homoserine transsuccinylase inhibitor|homoserine transsuccinylase inhibitors 4-O-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitor|4-O-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitors|EC 2.5.1.48 (cystathionine gamma-synthase) inhibitors|EC 2.5.1.48 inhibitor|EC 2.5.1.48 inhibitors|O(4)-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitor|O(4)-succinyl-L-homoserine:L-cysteine S-(3-amino-3-carboxypropyl)transferase inhibitors|O-succinyl-L-homoserine succinate-lyase (adding cysteine) inhibitor|O-succinyl-L-homoserine succinate-lyase (adding cysteine) inhibitors|O-succinylhomoserine (thiol)-lyase inhibitor|O-succinylhomoserine (thiol)-lyase inhibitors|O-succinylhomoserine synthase inhibitor|O-succinylhomoserine synthase inhibitors|O-succinylhomoserine synthetase inhibitor|O-succinylhomoserine synthetase inhibitors|cystathionine gamma-synthase inhibitor|cystathionine gamma-synthase inhibitors|cystathionine synthase inhibitor|cystathionine synthase inhibitors|cystathionine synthetase inhibitor|cystathionine synthetase inhibitors|homoserine O-transsuccinylase inhibitor|homoserine O-transsuccinylase inhibitors|homoserine transsuccinylase inhibitor|homoserine transsuccinylase inhibitors http://purl.obolibrary.org/obo/CHEBI_137566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137568 biolink:ChemicalEntity Cer(d34:0) Graph http://purl.obolibrary.org/obo/CHEBI_137568 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137569 biolink:ChemicalEntity Cer(d34:1) Graph http://purl.obolibrary.org/obo/CHEBI_137569 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13757 biolink:ChemicalEntity n-alk-2-enal An enal obtained by formal dehydrogenation across positions 2 and 3 of any n-alkanal Graph an alk-2-enal an alk-2-enal http://purl.obolibrary.org/obo/CHEBI_13757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137570 biolink:ChemicalEntity Cer(d38:1) Graph http://purl.obolibrary.org/obo/CHEBI_137570 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137571 biolink:ChemicalEntity Cer(d40:1) Graph http://purl.obolibrary.org/obo/CHEBI_137571 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137573 biolink:ChemicalEntity Cer(d43:1) Graph http://purl.obolibrary.org/obo/CHEBI_137573 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137586 biolink:ChemicalEntity alkyl,acylglyceride A glyceride in which any one of the R groups (positions not specified) is an alkyl group, another is an acyl group, while the remaining R group can be either H or an alkyl group. Graph http://purl.obolibrary.org/obo/CHEBI_137586 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:13759 biolink:ChemicalEntity alkylamine Any primary amine in which the substituent attached to nitrogen is an alkyl group. kegg.compound:C01664 Graph Alkylamine Alkylamine http://purl.obolibrary.org/obo/CHEBI_13759 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137593 biolink:ChemicalEntity (2E,4Z)-deca-2,4-dienoyl-CoA(4-) A polyunsaturated fatty acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate functions of (2E,4Z)-deca-2,4-dienoyl-CoA; major species at pH 7.3. metacyc.compound:CPD-15654|pubmed:6363415 Graph (2E,4Z)-decadienoyl-CoA (2E,4Z)-decadienoyl-CoA http://purl.obolibrary.org/obo/CHEBI_137593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137598 biolink:ChemicalEntity 4-aminosalicylate(1-) An aminobenzoate that is the conjugate base of 4-aminosalicylic acid, obtained by deprotonation of the carboxy group. Major miscrospecies at pH 7.3. metacyc.compound:CPD-8817|pubmed:23118010|reaxys:3906055 Graph 4-aminosalicylate 4-aminosalicylate http://purl.obolibrary.org/obo/CHEBI_137598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137599 biolink:ChemicalEntity long-chain 3-oxo-fatty acyl-CoA A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any long-chain (C13 to C22) 3-oxo-fatty acid. Graph http://purl.obolibrary.org/obo/CHEBI_137599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137626 biolink:ChemicalEntity EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD+ or NADP+ acceptor) inhibitor that interferes with the action of 11β-hydroxysteroid dehydrogenase (EC 1.1.1.146). Graph 11beta-hydroxy steroid dehydrogenase inhibitor|11beta-hydroxy steroid dehydrogenase inhibitors|11beta-hydroxysteroid dehydrogenase inhibitor|11beta-hydroxysteroid dehydrogenase inhibitors|11beta-hydroxysteroid dehydrogenase type 1 inhibitor|11beta-hydroxysteroid dehydrogenase type 1 inhibitors|11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitor|11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitors|EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitors|EC 1.1.1.146 inhibitor|EC 1.1.1.146 inhibitors|beta-hydroxysteroid dehydrogenase inhibitor|beta-hydroxysteroid dehydrogenase inhibitors|corticosteroid 11-reductase inhibitor|corticosteroid 11-reductase inhibitors|corticosteroid 11beta-dehydrogenase inhibitor|corticosteroid 11beta-dehydrogenase inhibitors|dehydrogenase, 11beta-hydroxy steroid inhibitor|dehydrogenase, 11beta-hydroxy steroid inhibitors 11beta-hydroxy steroid dehydrogenase inhibitor|11beta-hydroxy steroid dehydrogenase inhibitors|11beta-hydroxysteroid dehydrogenase inhibitor|11beta-hydroxysteroid dehydrogenase inhibitors|11beta-hydroxysteroid dehydrogenase type 1 inhibitor|11beta-hydroxysteroid dehydrogenase type 1 inhibitors|11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitor|11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitors|EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitors|EC 1.1.1.146 inhibitor|EC 1.1.1.146 inhibitors|beta-hydroxysteroid dehydrogenase inhibitor|beta-hydroxysteroid dehydrogenase inhibitors|corticosteroid 11-reductase inhibitor|corticosteroid 11-reductase inhibitors|corticosteroid 11beta-dehydrogenase inhibitor|corticosteroid 11beta-dehydrogenase inhibitors|dehydrogenase, 11beta-hydroxy steroid inhibitor|dehydrogenase, 11beta-hydroxy steroid inhibitors http://purl.obolibrary.org/obo/CHEBI_137626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137639 biolink:ChemicalEntity long-chain (3S)-hydroxy fatty acyl-CoA A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any long-chain (C13 to C22) (3S)-hydroxy-fatty acid. Graph http://purl.obolibrary.org/obo/CHEBI_137639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137650 biolink:ChemicalEntity short-chain (3S)-hydroxy fatty acyl-CoA A short-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any short-chain (C3 to C5) (3S)-hydroxy-fatty acid. Graph (3S)-short-chain hydroxy fatty acyl-CoA (3S)-short-chain hydroxy fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_137650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137661 biolink:ChemicalEntity allocholate A bile acid anion that is the conjugate base of allocholic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD-16581|pubmed:22021638 Graph (3alpha,5alpha,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oate|3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-oate|5alpha-cholate|allocholate 3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-oate (3alpha,5alpha,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oate|3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-oate|5alpha-cholate|allocholate http://purl.obolibrary.org/obo/CHEBI_137661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137682 biolink:ChemicalEntity methylhistidine A histidine derivative in which histidine is substituted with a methyl group. Graph methylhistidines methylhistidines http://purl.obolibrary.org/obo/CHEBI_137682 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:137684 biolink:ChemicalEntity Papio hamadryas metabolite Any mammalian metabolite produced during a metabolic reaction in Papio hamadryas. Graph P. hamadryas metabolite|P. hamadryas metabolites|Papio hamadryas metabolites P. hamadryas metabolite|P. hamadryas metabolites|Papio hamadryas metabolites http://purl.obolibrary.org/obo/CHEBI_137684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13769 biolink:ChemicalEntity aminohydroquinone beilstein:2802548 Graph 2-aminobenzene-1,4-diol|aminohydroquinone 2-aminobenzene-1,4-diol 2-aminobenzene-1,4-diol|aminohydroquinone http://purl.obolibrary.org/obo/CHEBI_13769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137700 biolink:ChemicalEntity 3-carboxy-3-hydroxypropanoyl-CoA A 3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the 3-carboxy group of 3-carboxy-3-hydroxypropanoic acid. cas:2043-93-8|metacyc.compound:CPD-15846 Graph 3-malyl-CoA|Malyl-coenzyme A|malyl-CoA 3-malyl-CoA|Malyl-coenzyme A|malyl-CoA http://purl.obolibrary.org/obo/CHEBI_137700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137740 biolink:ChemicalEntity UDP-3-O-[(3R)-hydroxyacyl]-alpha-D-glucosamine(1-) A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups and protonation of the amino group of any UDP-3-O-[(3R)-hydroxyacyl]-α-D-glucosamine. Major microspecies at pH 7.3. Graph a UDP-3-O-((3R)-3-hydroxyacyl)-alpha-D-glucosamine a UDP-3-O-((3R)-3-hydroxyacyl)-alpha-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_137740 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137748 biolink:ChemicalEntity UDP-2-N,3-O-bis[(3R)-3-hydroxyacyl]-alpha-D-glucosamine(2-) A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups of any UDP-2-N,3-O-bis[(3R)-3-hydroxyacyl]-α-D-glucosamine. Major miscrospecies at pH 7.3 Graph a UDP-2-N,3-O-bis((3R)-3-hydroxyacyl)-alpha-D-glucosamine a UDP-2-N,3-O-bis((3R)-3-hydroxyacyl)-alpha-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_137748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137811 biolink:ChemicalEntity phenoxy radical An organic radical generated from phenol. cas:2122-46-5|pubmed:30566134|pubmed:32083853|pubmed:33368926 Graph C6H5-O(.)|phenolic radical|phenoxy|phenoxyl|phenyloxidanyl phenyloxidanyl C6H5-O(.)|phenolic radical|phenoxy|phenoxyl|phenyloxidanyl http://purl.obolibrary.org/obo/CHEBI_137811 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13790 biolink:ChemicalEntity N-acetylarylamine An acetamide where at at least one of the amide hydrogens is substituted by an aryl group. RNHAc where R is an aryl group. Graph N-acetylarylamine|N-acetylarylamines|N-arylacetamide|an N-acetylarylamine N-acetylarylamine|N-acetylarylamines|N-arylacetamide|an N-acetylarylamine http://purl.obolibrary.org/obo/CHEBI_13790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13792 biolink:ChemicalEntity N-hydroxyarylamine Any hydroxylamine where the nitrogen is attached directly to an aryl group. Graph an N-hydroxyarylamine an N-hydroxyarylamine http://purl.obolibrary.org/obo/CHEBI_13792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137923 biolink:ChemicalEntity 5'-end ribonucleotide(1-) residue An organic anionic group obtained by deprotonation of one of the phosphate OH groups of any 5'-end ribonucleotide residue. Graph http://purl.obolibrary.org/obo/CHEBI_137923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137932 biolink:ChemicalEntity 5-dehydro-L-gluconic acid A ketogluconic acid that is L-gluconic acid in which the hydroxy group at position 2 has been oxidised to the corresponding ketone. metacyc.compound:CPD-14806|pubmed:23441918|reaxys:1726806 Graph 5-keto-L-gluconic acid|L-5-ketogluconic acid|L-5-oxogluconic acid|L-xylo-hex-5-ulosonic acid L-xylo-hex-5-ulosonic acid 5-keto-L-gluconic acid|L-5-ketogluconic acid|L-5-oxogluconic acid|L-xylo-hex-5-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_137932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137933 biolink:ChemicalEntity N(4)-methyl-dCMP(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of an N4-methyl-dCMP residue; major species at pH 7.3. Graph N(4)-methyl-dCMP residue N(4)-methyl-dCMP residue http://purl.obolibrary.org/obo/CHEBI_137933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137934 biolink:ChemicalEntity polyprenal Any enal having a polyprenyl chain. kegg.compound:C15604 Graph polyprenal|polyprenals polyprenal|polyprenals http://purl.obolibrary.org/obo/CHEBI_137934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137935 biolink:ChemicalEntity S-polyprenyl-L-cysteine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of S-polyprenyl-L-cysteine; major species at pH 7.3. Graph an S-prenyl-L-cysteine an S-prenyl-L-cysteine http://purl.obolibrary.org/obo/CHEBI_137935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137941 biolink:ChemicalEntity beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminide Any glycoside derived from β-D-galactosyl-(1→4)-[α-L-fucosyl-(1→3)]-N-acetyl-β-D-glucosamine kegg.compound:C01311 Graph a beta-D-galactosyl-(1->4)-(alpha-L-fucosyl-(1->3))-N-acetyl-beta-D-glucosaminyl derivative a beta-D-galactosyl-(1->4)-(alpha-L-fucosyl-(1->3))-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_137941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137952 biolink:ChemicalEntity UDP-2,3-diacyl-alpha-D-glucosamine A UDP-amino sugar in which the amino sugar component can be any 2,3-diacyl-α-D-glucosamine. pubmed:27006461 Graph UDP-2,3-diacyl-alpha-D-glucosamines UDP-2,3-diacyl-alpha-D-glucosamines http://purl.obolibrary.org/obo/CHEBI_137952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137954 biolink:ChemicalEntity N(6)-[(E)-but-2-enoyl]-L-lysine residue An N6-acyl-L-lysine residue derived from N6-[(E)-but-2-enoyl]-L-lysine. pubmed:25818647 Graph N(6)-(E)-but-2-enoyl-L-lysine residue|N(6)-crotonyl-L-lysine residue N(6)-(E)-but-2-enoyl-L-lysine residue|N(6)-crotonyl-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_137954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137955 biolink:ChemicalEntity N(6)-butyryl-L-lysine residue An N6-acyl-L-lysine residue derived from N6-butyryl-L-lysine. pubmed:27105113 Graph N(6)-butanoyl-L-lysine residue N(6)-butanoyl-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_137955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13796 biolink:ChemicalEntity S-polyprenyl-L-cysteine An S-hydrocarbyl-L-cysteine in which the hydrocarbyl component can be any polyprenyl group. Graph S-polyprenyl-L-cysteines S-polyprenyl-L-cysteines http://purl.obolibrary.org/obo/CHEBI_13796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137967 biolink:ChemicalEntity N(6)-acyl-L-lysine residue An L-α-amino acid residue derived from any N6-acyl-L-lysine. Graph N(6)-acyl-L-lysine residue N(6)-acyl-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_137967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137976 biolink:ChemicalEntity S-acetyl-O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine(3-) residue An organic anionic group obtained by deprotonation of the phosphate and diphosphate OH groups of S-acetyl O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine residue. Graph S-acetyl-O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine(3-) residue S-acetyl-O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine(3-) residue http://purl.obolibrary.org/obo/CHEBI_137976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137979 biolink:ChemicalEntity D-galactosylglycerol Any galactosylglycerol resulting from the formal condensation of one of the hydroxy groups of glycerol with anomeric hydroxy group of D-galactose. Graph http://purl.obolibrary.org/obo/CHEBI_137979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137980 biolink:ChemicalEntity metalloid atom An atom of an element that exhibits properties that are between those of metals and nonmetals, or that has a mixture of them. The term generally includes boron, silicon, germanium, arsenic, antimony, and tellurium, while carbon, aluminium, selenium, polonium, and astatine are less commonly included. wikipedia.en:Metalloid Graph metalloid|metalloids metalloid|metalloids http://purl.obolibrary.org/obo/CHEBI_137980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137981 biolink:ChemicalEntity 5-amino-1-(5-phosphonato-beta-D-ribosyl)imidazol-3-ium An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups as well as protonation of the endocyclic nitrogen at position 3 in the imidazole ring of 5-amino-1-(5-phospho-β-D-ribosyl)imidazole. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). metacyc.compound:5-PHOSPHORIBOSYL-5-AMINOIMIDAZOLE|pubmed:2684279|pubmed:3530323 Graph 5-amino-1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-imidazol-3-ium|5-amino-1-(5-phospho-beta-D-ribosyl)imidazole 5-amino-1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-imidazol-3-ium 5-amino-1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-imidazol-3-ium|5-amino-1-(5-phospho-beta-D-ribosyl)imidazole http://purl.obolibrary.org/obo/CHEBI_137981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137982 biolink:ChemicalEntity tertiary ammonium ion An organic cation obtained by protonation of the amino group of any tertiary amino compound. Graph a tertiary amine|tertiary amine(1+)|tertiary ammonium ions a tertiary amine|tertiary amine(1+)|tertiary ammonium ions http://purl.obolibrary.org/obo/CHEBI_137982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137983 biolink:ChemicalEntity methylated tertiary amine A quaternary ammonium ion obtained by methylation of any tertiary amine Graph a methylated tertiary amine a methylated tertiary amine http://purl.obolibrary.org/obo/CHEBI_137983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137986 biolink:ChemicalEntity (beta-Asp-Arg)n zwitterion A zwitterion derived from (β-Asp-Arg)n. Major microspecies at pH 7.3. Graph (L-4-(L-arginin-2-N-yl)aspartate)(n)|(beta-L-Asp-L-Arg)n zwitterion (L-4-(L-arginin-2-N-yl)aspartate)(n)|(beta-L-Asp-L-Arg)n zwitterion http://purl.obolibrary.org/obo/CHEBI_137986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:137990 biolink:ChemicalEntity (beta-Asp-Arg)n-Asp(1-) A peptide anion that is the conjugate base of (β-Asp-Arg)n-Asp; major species at pH 7.3. Graph [L-4-(L-arginin-2-N-yl)aspartate]n-L-aspartate [L-4-(L-arginin-2-N-yl)aspartate]n-L-aspartate http://purl.obolibrary.org/obo/CHEBI_137990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138000 biolink:ChemicalEntity 3-(1-methylpyrrolidin-2-yl)pyridine An N-alkylpyrrolidine that consists of N-methylpyrrolidine bearing a pyridin-3-yl substituent at position 2. Graph 3-(1-methylpyrrolidin-2-yl)pyridine 3-(1-methylpyrrolidin-2-yl)pyridine 3-(1-methylpyrrolidin-2-yl)pyridine http://purl.obolibrary.org/obo/CHEBI_138000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138011 biolink:ChemicalEntity 6-(alpha-D-glucose-1-phospho)-alpha-D-mannoside(1-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH group of any 6-(α-D-glucose-1-phospho)-α-D-mannoside; major species at pH 7.3. Graph 6-(alpha-D-glucose-1-phospho)-alpha-D-mannosyl derivative 6-(alpha-D-glucose-1-phospho)-alpha-D-mannosyl derivative http://purl.obolibrary.org/obo/CHEBI_138011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138013 biolink:ChemicalEntity Z-DEVD-FMK A tetrapeptide consisting of Fmoc-L-aspartic acid 4-methyl ester, methyl L-α-glutamic acid 5-methyl ester, L-valine and the fluoromethyl ketone derived from the 1-carboxy group of L-aspartic acid 4-methyl ester coupled in sequence. It is a specific, irreversible caspase-3 inhibitor that also shows potent inhibition of caspase-6, caspase-7, caspase-8, and caspase-10. pubmed:15529012|pubmed:16099247|pubmed:16756133|pubmed:18040669|pubmed:21211221|pubmed:24101734|pubmed:24724067|pubmed:25492116|pubmed:25588462|pubmed:26170924|pubmed:27058316|pubmed:28278848|reaxys:9977166 Graph N-[(phenylmethoxy)carbonyl]-L-alpha-aspartyl-L-alpha-glutamyl-N-[(1S)-3-fluoro-1-(2-methoxy-2-oxoethyl)-2-oxopropyl]-L-valinamide, 1,2-dimethyl ester|Z-Asp(OMe)-Glu(OMe)-Val-Asp(OMe)-fluoromethylketone|Z-DEVD-fluoromethylketone|benzyloxycarbonyl-Asp(OMe)-Glu(OMe)-Val-Asp(OMe)-fluoromethylketone|benzyloxycarbonyl-Asp-Glu-Val-Asp-fluoromethylketone|methyl (4S)-5-{[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]amino}-4-{[(2S)-2-{[(benzyloxy)carbonyl]amino}-4-methoxy-4-oxobutanoyl]amino}-5-oxopentanoate|methyl (5S,8S,11S,14S)-14-(fluoroacetyl)-11-isopropyl-5-(2-methoxy-2-oxoethyl)-8-(3-methoxy-3-oxopropyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazahexadecan-16-oate|specific inhibitor of caspase-3 N-[(phenylmethoxy)carbonyl]-L-alpha-aspartyl-L-alpha-glutamyl-N-[(1S)-3-fluoro-1-(2-methoxy-2-oxoethyl)-2-oxopropyl]-L-valinamide, 1,2-dimethyl ester|Z-Asp(OMe)-Glu(OMe)-Val-Asp(OMe)-fluoromethylketone|Z-DEVD-fluoromethylketone|benzyloxycarbonyl-Asp(OMe)-Glu(OMe)-Val-Asp(OMe)-fluoromethylketone|benzyloxycarbonyl-Asp-Glu-Val-Asp-fluoromethylketone|methyl (4S)-5-{[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]amino}-4-{[(2S)-2-{[(benzyloxy)carbonyl]amino}-4-methoxy-4-oxobutanoyl]amino}-5-oxopentanoate|methyl (5S,8S,11S,14S)-14-(fluoroacetyl)-11-isopropyl-5-(2-methoxy-2-oxoethyl)-8-(3-methoxy-3-oxopropyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazahexadecan-16-oate|specific inhibitor of caspase-3 http://purl.obolibrary.org/obo/CHEBI_138013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138014 biolink:ChemicalEntity EC 3.4.22.56 (caspase-3) inhibitor An EC 3.4.22.* (cysteine endopeptidase) inhibitor that interferes with the action of caspase-3 (EC 3.4.22.56). wikipedia.en:Caspase_3 Graph CASP-3 inhibitor|CASP-3 inhibitors|CPP32 inhibitor|CPP32 inhibitors|EC 3.4.22.56 (caspase-3) inhibitors|EC 3.4.22.56 inhibitor|EC 3.4.22.56 inhibitors|apopain inhibitor|apopain inhibitors|caspase-3 (EC 3.4.22.56) inhibitor|caspase-3 (EC 3.4.22.56) inhibitors|caspase-3 inhibitor|caspase-3 inhibitors|yama protein inhibitor|yama protein inhibitors CASP-3 inhibitor|CASP-3 inhibitors|CPP32 inhibitor|CPP32 inhibitors|EC 3.4.22.56 (caspase-3) inhibitors|EC 3.4.22.56 inhibitor|EC 3.4.22.56 inhibitors|apopain inhibitor|apopain inhibitors|caspase-3 (EC 3.4.22.56) inhibitor|caspase-3 (EC 3.4.22.56) inhibitors|caspase-3 inhibitor|caspase-3 inhibitors|yama protein inhibitor|yama protein inhibitors http://purl.obolibrary.org/obo/CHEBI_138014 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138015 biolink:ChemicalEntity endocrine disruptor Any compound that can disrupt the functions of the endocrine (hormone) system pubmed:27929035|pubmed:28356401|pubmed:28526231|wikipedia.en:Endocrine_disruptor Graph endocrine disrupting chemical|endocrine disrupting chemicals|endocrine disrupting compound|endocrine disrupting compounds|endocrine disruptors|endocrine-disrupting chemical|endocrine-disrupting chemicals|hormonally active agent|hormonally active agents endocrine disrupting chemical|endocrine disrupting chemicals|endocrine disrupting compound|endocrine disrupting compounds|endocrine disruptors|endocrine-disrupting chemical|endocrine-disrupting chemicals|hormonally active agent|hormonally active agents http://purl.obolibrary.org/obo/CHEBI_138015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138019 biolink:ChemicalEntity N(6)-propanoyl-L-lysine residue An N6-acyl-L-lysine residue derived from N6-propanoyl-L-lysine. pubmed:17267393 Graph N(6)-propanoyl-L-lysine residue|N(6)-propanoyllysine residue|N(6)-propionyllysine residue N(6)-propanoyl-L-lysine residue|N(6)-propanoyllysine residue|N(6)-propionyllysine residue http://purl.obolibrary.org/obo/CHEBI_138019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138021 biolink:ChemicalEntity (3S)-3-hydroxy-L-histidine residue An L-α-amino acid residue derived from (3S)-3-hydroxy-L-histidine. pubmed:23103944 Graph (3S)-3-hydroxy-L-histidine residue (3S)-3-hydroxy-L-histidine residue http://purl.obolibrary.org/obo/CHEBI_138021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138024 biolink:ChemicalEntity alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide Any glycoside derived from α-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine Graph an alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative an alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_138024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138025 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminyl-(1->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide Any glycoside derived from N-acetyl-β-D-glucosaminyl-(1→6)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosamine. Graph an N-acetyl-beta-D-glucosaminyl-(1->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative an N-acetyl-beta-D-glucosaminyl-(1->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_138025 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138027 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-N-acetyl-beta-D-glucosaminide Any glycoside derived from N-acetyl-β-D-galactosaminyl-(1→4)-N-acetyl-β-D-glucosamine. Graph an N-acetyl-beta-D-galactosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative an N-acetyl-beta-D-galactosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_138027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138029 biolink:ChemicalEntity 14alpha-methyl steroid Any steroid carrying a 14α-methyl substituent. metacyc.compound:14-alpha-methylsteroids Graph a 14alpha-methyl steroid a 14alpha-methyl steroid http://purl.obolibrary.org/obo/CHEBI_138029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138031 biolink:ChemicalEntity Delta(14) steroid Any steroid that contains a double bond between positions 14 and 15. metacyc.compound:Delta-14-steroids Graph a Delta(14) steroid a Delta(14) steroid http://purl.obolibrary.org/obo/CHEBI_138031 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138053 biolink:ChemicalEntity 5-methoxycarbonylmethoxyuridine(1-) residue A ribonucleotide residue(1−) obtained by deprotonation of the phosphate OH group of 5-(methoxycarbonylmethoxy)uridine 5'-phosphate residue. Major microspecies at pH 7.4. Graph 5-methoxycarbonylmethoxyuridine residue 5-methoxycarbonylmethoxyuridine residue http://purl.obolibrary.org/obo/CHEBI_138053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138068 biolink:ChemicalEntity ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of any ribonucleoside 5'-diphosphate-α-D-glucose. Major microspecies at pH 7.3 Graph a ribonucleoside 5'-diphosphate-alpha-D-glucose a ribonucleoside 5'-diphosphate-alpha-D-glucose http://purl.obolibrary.org/obo/CHEBI_138068 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138075 biolink:ChemicalEntity 5-formyl CMP(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of 5-formyl CMP residue; major species at pH 7.3. pubmed:27497299 Graph 5-formyl CMP residue 5-formyl CMP residue http://purl.obolibrary.org/obo/CHEBI_138075 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138087 biolink:ChemicalEntity O-acyl-ADP-D-ribose(2-) A nucleotide-sugar oxoanion obtained by deprotonation of the phosphate OH groups of any O-acyl-ADP-D-ribose; major species at pH 7.3. Graph 2''-O-acyl-ADP-D-ribose 2''-O-acyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_138087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138088 biolink:ChemicalEntity long chain primary alcohol A primary alcohol with a chain length ranging from 13-22 carbons which is usually but not always a fatty alcohol. Graph http://purl.obolibrary.org/obo/CHEBI_138088 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138102 biolink:ChemicalEntity 4-(ADP-D-ribosyl)-L-aspartyl(2-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of 4-(ADP-D-ribosyl)-L-aspartyl residue. Major microspecies at pH 7.3 Graph 4-O-(ADP-D-ribosyl)-L-aspartyl residue 4-O-(ADP-D-ribosyl)-L-aspartyl residue http://purl.obolibrary.org/obo/CHEBI_138102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138103 biolink:ChemicalEntity inorganic acid A Brønsted acid derived from one or more inorganic compounds. Inorganic acids (also known as mineral acids) form hydrons and conjugate base ions when dissolved in water. wikipedia.en:Mineral_acid Graph inorganic acids|mineral acid|mineral acids inorganic acids|mineral acid|mineral acids http://purl.obolibrary.org/obo/CHEBI_138103 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138107 biolink:ChemicalEntity (3S)-3-hydroxy-L-asparagine residue An L-α-amino acid residue derived from (3S)-3-hydroxy-L-asparagine. Graph (3S)-3-hydroxy-L-asparagine residue (3S)-3-hydroxy-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_138107 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138108 biolink:ChemicalEntity 2-palmitoleoyl-sn-glycero-3-phospho-D-myo-inositol A 2-acyl-sn-glycero-3-phospho-D-myo-inositol that has palmitoleoyl as the acyl group. pubmed:28667014 Graph (2R)-1-hydroxy-3-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]propan-2-yl (9Z)-hexadec-9-enoate|2-(9Z-hexadecenoyl)-glycero-3-phospho-(1'-myo-inositol)|2-(9Z-hexadecenoyl)-sn-glycero-3-phospho-D-myo-inositol (2R)-1-hydroxy-3-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]propan-2-yl (9Z)-hexadec-9-enoate (2R)-1-hydroxy-3-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]propan-2-yl (9Z)-hexadec-9-enoate|2-(9Z-hexadecenoyl)-glycero-3-phospho-(1'-myo-inositol)|2-(9Z-hexadecenoyl)-sn-glycero-3-phospho-D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_138108 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138130 biolink:ChemicalEntity Delta(7)-sterol Any sterol that contains a double bond between positions 7 and 8. metacyc.compound:Delta7-Steroids Graph a Delta(7)-sterol a Delta(7)-sterol http://purl.obolibrary.org/obo/CHEBI_138130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138131 biolink:ChemicalEntity Delta(5),Delta(7)-sterol Any sterol containing two double bonds between positions 5-6 and 7-8. metacyc.compound:Delta5-Delta7-Steroids Graph a Delta(5),Delta(7)-sterol a Delta(5),Delta(7)-sterol http://purl.obolibrary.org/obo/CHEBI_138131 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138138 biolink:ChemicalEntity epoxy(hydroxy)icosatrienoic acid A nonclassic icosanoid that consists of any icosatrienoic acid carrying epoxy and hydroxy substituents. Graph HEETA|epoxy(hydroxy)eicosatrienoic acid|epoxy(hydroxy)eicosatrienoic acids|epoxy(hydroxy)icosatrienoic acids HEETA|epoxy(hydroxy)eicosatrienoic acid|epoxy(hydroxy)eicosatrienoic acids|epoxy(hydroxy)icosatrienoic acids http://purl.obolibrary.org/obo/CHEBI_138138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138140 biolink:ChemicalEntity 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid anion An anionic phospholipid obtained by deprotonation of the phosphate OH group of any 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid; major species at pH 7.3. Graph a 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid a 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid http://purl.obolibrary.org/obo/CHEBI_138140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138141 biolink:ChemicalEntity 17alpha-hydroxy-C21-steroid Any C21-steroid carrying a hydroxy substituent at the 17α-position. Note that individual examples may have ring substituents at other positions and/or contain double bonds, aromatic A-rings, expanded/contracted rings etc., so the formula and mass may vary from that given for the generic structure. metacyc.compound:17a-hydroxy-C21-steroids Graph a 17alpha-hydroxy-C21-steroid a 17alpha-hydroxy-C21-steroid http://purl.obolibrary.org/obo/CHEBI_138141 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138142 biolink:ChemicalEntity 21-hydroxy-C21-steroid Any C21-steroid carrying a hydroxy substituent at position 21. Graph a 21-hydroxy-C21-steroid a 21-hydroxy-C21-steroid http://purl.obolibrary.org/obo/CHEBI_138142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138147 biolink:ChemicalEntity 3'-end deoxyribonucleotide 3'-phosphate(3-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of any 3'-end deoxyribonucleotide 3'-phosphate residue. Graph 3'-end deoxyribonucleotide 3'-phosphate residue 3'-end deoxyribonucleotide 3'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_138147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138148 biolink:ChemicalEntity 3'-end deoxyribonucleotide(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of any 3'-end deoxyribonucleotide residue. Graph 3'-end deoxyribonucleotide residue 3'-end deoxyribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_138148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138152 biolink:ChemicalEntity serum amyloid A wikipedia.en:Serum_amyloid_A Graph http://purl.obolibrary.org/obo/CHEBI_138152 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138170 biolink:ChemicalEntity sulfanegen A member of the class of dithianes that is 1,4-dithiane-2,5-dicarboxylic acid in which the hydrogens at positions 2 and 5 have been replaced by hydroxy groups. Sulfanegen is a prodrug for 3-mercaptopyruvic acid and is an experimental antidote for cyanide poisoning. cas:80003-64-1|patent:US2016354341|patent:WO2011133893|pubchem.compound:24830990|pubmed:20705081|pubmed:21740135|pubmed:22392971|pubmed:23301495|pubmed:27308865|pubmed:28412453|pubmed:7054184|reaxys:21914042 Graph 2,5-dihydroxy-1,4-dithiane-2,5-dicarboxylic acid 2,5-dihydroxy-1,4-dithiane-2,5-dicarboxylic acid 2,5-dihydroxy-1,4-dithiane-2,5-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_138170 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138171 biolink:ChemicalEntity pApA(3-) An organophosphate oxoanion obtained by deprotonation of the phospohate OH groups of pApA. Major microspecies at pH 7.3. Graph 5'-O-phosphonoadenylyl-(3'->5')-adenosine 5'-O-phosphonoadenylyl-(3'->5')-adenosine http://purl.obolibrary.org/obo/CHEBI_138171 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138176 biolink:ChemicalEntity (2R,3S,4S)-leucoanthocyanidin Any leucoanthocyanidin that has 2R,3S,4S-configuration. Graph (2R,3S,4S)-leucoanthocyanidins|a (2R,3S,4S)-leucoanthocyanidin (2R,3S,4S)-leucoanthocyanidins|a (2R,3S,4S)-leucoanthocyanidin http://purl.obolibrary.org/obo/CHEBI_138176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138177 biolink:ChemicalEntity 4-unsubstituted 3-hydroxyanthocyanidin betaine Any 3-hydroxyanthocyanidin betaine that lacks a substituent at position 4. Graph a 4-H-anthocyanidin with a 3-hydroxy group a 4-H-anthocyanidin with a 3-hydroxy group http://purl.obolibrary.org/obo/CHEBI_138177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138179 biolink:ChemicalEntity aspirin-triggered resolvin D1 A member of the class of resolvins that consists of docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid carrying three hydroxy substituents at positions 7, 8, and 17 (the 7S,8R,17S-stereoisomer). lipidmaps:LMFA04030005|pubmed:17244615|pubmed:21418187|pubmed:22785226|pubmed:22802419|pubmed:23462912|pubmed:23709617|pubmed:24086560|pubmed:24709673|pubmed:25123641|pubmed:25647402|pubmed:26317859|pubmed:26647716|pubmed:26660549|pubmed:26843331|pubmed:26869523|pubmed:26927755|pubmed:27110599|pubmed:27573422|pubmed:27589850|pubmed:27694530|pubmed:28213094|pubmed:28322829|pubmed:28361884|pubmed:28362840|pubmed:28584076|pubmed:28779028|reaxys:24477830 Graph (4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid|(4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosahexaenoic acid|17(R)-RvD1|17(R)-resolvin D1|17-epi-resolvin D1|7S,8R,17R-trihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|AT-Resolvin D1|AT-RvD1 (4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid (4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid|(4Z,7S,8R,9E,11E,13Z,15E,17R,19Z)-7,8,17-trihydroxydocosahexaenoic acid|17(R)-RvD1|17(R)-resolvin D1|17-epi-resolvin D1|7S,8R,17R-trihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|AT-Resolvin D1|AT-RvD1 http://purl.obolibrary.org/obo/CHEBI_138179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138188 biolink:ChemicalEntity (2R,3R)-dihydroflavonol Any dihydroflavonol that has 2R,3R-configuration. kegg.compound:C21417|metacyc.compound:2R-3R-Dihydroflavonols Graph (2R,3R)-dihydroflavonols|a (2R,3R)-dihydroflavonol (2R,3R)-dihydroflavonols|a (2R,3R)-dihydroflavonol http://purl.obolibrary.org/obo/CHEBI_138188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138191 biolink:ChemicalEntity 3'-end 3'-(N-acyl-L-alpha-aminoacyl)adenylyl(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of any 3'-end 3'-(N-acyl-L-α-aminoacyl)adenylyl residue; major species at pH 7.3. Graph 3'-(N-acyl-L-alpha-aminoacyl)adenylyl 3'-end residue 3'-(N-acyl-L-alpha-aminoacyl)adenylyl 3'-end residue http://purl.obolibrary.org/obo/CHEBI_138191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138202 biolink:ChemicalEntity (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid A docosanoid that is (14S )-hydroxy-(4Z,7Z,9E,11E,16 Z,19Z )-docosahexaenoic acid in which a glutathionyl group is attached at position 13R via a sulfide linkage. pubmed:26881986|pubmed:27791009|reaxys:28337237 Graph L-gamma-glutamyl-S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine|MCTR1 L-gamma-glutamyl-S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine L-gamma-glutamyl-S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine|MCTR1 http://purl.obolibrary.org/obo/CHEBI_138202 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138206 biolink:ChemicalEntity (13R)-S-cysteinylglycinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid A docosanoid that is (14S )-hydroxy-(4Z,7Z,9E,11E,16 Z,19Z )-docosahexaenoic acid in which a cysteinylglycinyl group is attached at position 13R via a sulfide linkage. pubmed:26881986|pubmed:27791009|reaxys:28337234 Graph MCTR2|S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine MCTR2|S-[(3Z,6Z,9S,10R,11E,13E,15Z,18Z)-21-carboxy-9-hydroxyhenicosa-3,6,11,13,15,18-hexaen-10-yl]-L-cysteinylglycine http://purl.obolibrary.org/obo/CHEBI_138206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138208 biolink:ChemicalEntity carotenoid biosynthesis inhibitor Any pathway inhibitor that acts on the carotenoid biosynthesis pathway. Graph carotenogenesis inhibitor|carotenogenesis inhibitors|carotenoid biosynthesis inhibitors|carotenoid-biosynthesis inhibitor|carotenoid-biosynthesis inhibitors carotenogenesis inhibitor|carotenogenesis inhibitors|carotenoid biosynthesis inhibitors|carotenoid-biosynthesis inhibitor|carotenoid-biosynthesis inhibitors http://purl.obolibrary.org/obo/CHEBI_138208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138209 biolink:ChemicalEntity (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid A docosanoid that is (14S )-hydroxy-(4Z,7Z,9E,11E,16 Z,19Z )-docosahexaenoic acid in which a cysteinyl group is attached at position 13R via a sulfide linkage. pubmed:26881986|pubmed:27791009|reaxys:28337235 Graph (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoic acid|MCTR3 (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoic acid (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoic acid|MCTR3 http://purl.obolibrary.org/obo/CHEBI_138209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138232 biolink:ChemicalEntity peregrinol diphosphate(3-) An organophosphate oxoanion obtained by deprotonation of the diphosphate OH groups of peregrinol diphosphate; major species at pH 7.3. metacyc.compound:CPD-20436|pubmed:24990389 Graph (13E)-9-hydroxy-8alpha-labda-13-en-15-yl diphosphate|(2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl diphosphate|peregrinol diphosphate (2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl diphosphate (13E)-9-hydroxy-8alpha-labda-13-en-15-yl diphosphate|(2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl diphosphate|peregrinol diphosphate http://purl.obolibrary.org/obo/CHEBI_138232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138233 biolink:ChemicalEntity 9,13(R)-epoxylabd-14-ene A tricyclic diterpenoid that is an intermediate in the biosynthesis of marrubiin by the medicinal plant Marrubium vulgare. metacyc.compound:CPD-20437|pubmed:24990389|pubmed:29315936 Graph (13R)-9,13-epoxylabd-14-ene|(1R,2R,4aS,5'R,8aS)-5'-ethenyl-2,5,5,5',8a-pentamethyloctahydro-2H-spiro[naphthalene-1,2'-oxolane] (1R,2R,4aS,5'R,8aS)-5'-ethenyl-2,5,5,5',8a-pentamethyloctahydro-2H-spiro[naphthalene-1,2'-oxolane] (13R)-9,13-epoxylabd-14-ene|(1R,2R,4aS,5'R,8aS)-5'-ethenyl-2,5,5,5',8a-pentamethyloctahydro-2H-spiro[naphthalene-1,2'-oxolane] http://purl.obolibrary.org/obo/CHEBI_138233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138234 biolink:ChemicalEntity (13R)-manoyl oxide A tricyclic labdane diterpenoid that is an intermediate in the biosynthesis of forskolin by Coleus forskohlii. pubmed:25239892|pubmed:26133196|pubmed:28290983|pubmed:28806958 Graph (13R)-manoyl oxide|(3R,4aR,6aS,10aS,10bS)-3-ethenyl-3,4a,7,7,10a-pentamethyldodecahydro-1H-naphtho[2,1-b]pyran (3R,4aR,6aS,10aS,10bS)-3-ethenyl-3,4a,7,7,10a-pentamethyldodecahydro-1H-naphtho[2,1-b]pyran (13R)-manoyl oxide|(3R,4aR,6aS,10aS,10bS)-3-ethenyl-3,4a,7,7,10a-pentamethyldodecahydro-1H-naphtho[2,1-b]pyran http://purl.obolibrary.org/obo/CHEBI_138234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138236 biolink:ChemicalEntity oridonin An organic heteropentacyclic compound and ent-kaurane diterpenoid with formula C20H28O6 isolated from the leaves of the medicinal herb Rabdosia rubescens. cas:28957-04-2|knapsack:C00033270|pubmed:27431862|pubmed:27563888|pubmed:28128329|pubmed:28230866|pubmed:28259901|pubmed:28376864|pubmed:28381502|pubmed:28425866|pubmed:28454475|pubmed:28579904|pubmed:28618955|pubmed:28654903|pubmed:28747574|pubmed:28768083|pubmed:28781688|reaxys:1691227 Graph (1alpha,5beta,6beta,7alpha,8alpha,9beta,10alpha,13alpha,14R)-1,6,7,14-tetrahydroxy-7,20-epoxykaur-16-en-15-one|(1alpha,6beta,7alpha,14R)-7,20-epoxy-1,6,7,14-tetrahydroxykaur-16-en-15-one|isodonol|oridonine (1alpha,5beta,6beta,7alpha,8alpha,9beta,10alpha,13alpha,14R)-1,6,7,14-tetrahydroxy-7,20-epoxykaur-16-en-15-one (1alpha,5beta,6beta,7alpha,8alpha,9beta,10alpha,13alpha,14R)-1,6,7,14-tetrahydroxy-7,20-epoxykaur-16-en-15-one|(1alpha,6beta,7alpha,14R)-7,20-epoxy-1,6,7,14-tetrahydroxykaur-16-en-15-one|isodonol|oridonine http://purl.obolibrary.org/obo/CHEBI_138236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138238 biolink:ChemicalEntity pyrimidine ribonucleoside 5'-monophosphate(2-) A nucleoside 5'-monophosphate(2−) obtained by deprotonation of the phospohate OH groups of any pyrimidine ribonucleoside 5'-monophosphate; major species at pH 7.3. Graph a pyrimidine ribonucleoside 5'-phosphate a pyrimidine ribonucleoside 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_138238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138248 biolink:ChemicalEntity (13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,9E,11E,16Z,19Z )-docosahexaenoic acid in which the two hydroxy substituents are located at the 13R- and 14S-positions. pubmed:25036362|pubmed:28237084|reaxys:27750204 Graph (13R,14S)-diHDHA|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoic acid|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosahexaenoic acid|MaR2|maresin 2 (4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoic acid (13R,14S)-diHDHA|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosa-4,7,9,11,16,19-hexaenoic acid|(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13,14-dihydroxydocosahexaenoic acid|MaR2|maresin 2 http://purl.obolibrary.org/obo/CHEBI_138248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138249 biolink:ChemicalEntity (7R,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 7R- and 14S-positions. pubmed:19103881|pubmed:23504711|pubmed:23663457|pubmed:25036362|pubmed:25369934|pubmed:25409514|pubmed:25539814|pubmed:25655838|pubmed:25777995|pubmed:26196843|pubmed:26196844|pubmed:26617436|pubmed:26667839|pubmed:26878867|pubmed:26881046|pubmed:26915798|pubmed:27398158|pubmed:27531933|pubmed:27559094|pubmed:27613620|pubmed:27799313|pubmed:28042205|pubmed:28079976|pubmed:28182085|pubmed:28188173|pubmed:28218740|pubmed:28703289|pubmed:28751936|pubmed:28768719|reaxys:21813987|wikipedia.en:Maresin Graph (4Z,7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoic acid|MaR1|maresin 1 (4Z,7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid (4Z,7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoic acid|MaR1|maresin 1 http://purl.obolibrary.org/obo/CHEBI_138249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138256 biolink:ChemicalEntity N-(4-oxoglutaryl)-L-cysteinylglycine(2-) A peptide anion obtained by deprotonation of the carboxy groups of N-(4-oxoglutaryl)-L-cysteinylglycine; major species at pH 7.3. metacyc.compound:CPD-19971|pubmed:28373563 Graph 5-({(2R)-1-[(carboxylatomethyl)amino]-1-oxo-3-sulfanylpropan-2-yl}amino)-2,5-dioxopentanoate|N-(4-oxoglutaryl)-L-cysteinylglycine 5-({(2R)-1-[(carboxylatomethyl)amino]-1-oxo-3-sulfanylpropan-2-yl}amino)-2,5-dioxopentanoate 5-({(2R)-1-[(carboxylatomethyl)amino]-1-oxo-3-sulfanylpropan-2-yl}amino)-2,5-dioxopentanoate|N-(4-oxoglutaryl)-L-cysteinylglycine http://purl.obolibrary.org/obo/CHEBI_138256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138261 biolink:ChemicalEntity very long-chain fatty acyl-CoA(4-) A fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any very long-chain fatty acyl-CoA; major species at pH 7.3. Graph a very long-chain fatty acyl-CoA a very long-chain fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_138261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138264 biolink:ChemicalEntity D-sorbitol-(13)C6 A D-sorbitol in which the six carbon atoms have been replaced by the 13C isotope. Graph http://purl.obolibrary.org/obo/CHEBI_138264 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138275 biolink:ChemicalEntity oxidized Renilla luciferin(1-) An organic anion obtained by deprotonation of the amide group of oxidized Renilla luciferin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). pubmed:17007903 Graph 3-benzyl-5-(4-hydroxyphenyl)-N-(phenylacetyl)pyrazin-2-aminide|excited coelenteramide h monoanion|oxidized Renilla luciferin monoanion 3-benzyl-5-(4-hydroxyphenyl)-N-(phenylacetyl)pyrazin-2-aminide 3-benzyl-5-(4-hydroxyphenyl)-N-(phenylacetyl)pyrazin-2-aminide|excited coelenteramide h monoanion|oxidized Renilla luciferin monoanion http://purl.obolibrary.org/obo/CHEBI_138275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138276 biolink:ChemicalEntity 5'-end purine ribonucleoside 5'-diphosphate(3-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of any 5'-end purine ribonucleoside 5'-diphosphate residue; major species at pH 7.3. Graph a 5'-diphospho-(purine-ribonucleoside) residue a 5'-diphospho-(purine-ribonucleoside) residue http://purl.obolibrary.org/obo/CHEBI_138276 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138282 biolink:ChemicalEntity 5'-end ribonucleotide(2-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of any 5'-end ribonucleotide residue. Major microspecies at pH 7.3. Graph 5'-end ribonucleotide residue 5'-end ribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_138282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138284 biolink:ChemicalEntity 5'-end ribonucleoside residue A nucleoside residue derived from any ribonucleoside having the linkage point at position 3'. Graph 5'-end 5'-dephospho ribonucleotide residue 5'-end 5'-dephospho ribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_138284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138306 biolink:ChemicalEntity aromatic (S)-hydroxynitrile Any cyanohydrin that is derived from an aromatic aldehyde and has S-configuration. metacyc.compound:Aromatic-S-hydroxynitriles Graph an aromatic (S)-hydroxynitrile|aromatic (S)-hydroxynitriles|aryl (S)-hydroxynitriles an aromatic (S)-hydroxynitrile|aromatic (S)-hydroxynitriles|aryl (S)-hydroxynitriles http://purl.obolibrary.org/obo/CHEBI_138306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138310 biolink:ChemicalEntity (-)-kolavenyl diphosphate(3-) An organophosphate oxoanion obtained by deprotonation of diphosphate OH groups of (−)-kolavenyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-20259|pubmed:27801964|pubmed:28204567 Graph (-)-kolavenyl diphosphate (-)-kolavenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_138310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138311 biolink:ChemicalEntity (+)-kolavenyl diphosphate(3-) An organophosphate oxoanion obtained by deprotonation of diphosphate OH groups of (+)-kolavenyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-20430|pubmed:25694050 Graph (+)-kolavenyl diphosphate|(2E)-3-methyl-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl diphosphate (+)-kolavenyl diphosphate|(2E)-3-methyl-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl diphosphate http://purl.obolibrary.org/obo/CHEBI_138311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138319 biolink:ChemicalEntity monoalk-1-enyl-sn-glycero-3-phosphoethanolamine A glycerophosphoethanolamine that is sn-glycero-3-phosphoethanolamine bearing a single alk-1-enyl substituent at an unspecified position. Graph monoalk-1-enyl-sn-glycero-3-phosphoethanolamines monoalk-1-enyl-sn-glycero-3-phosphoethanolamines http://purl.obolibrary.org/obo/CHEBI_138319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138320 biolink:ChemicalEntity monoalkyl-sn-glycero-3-phosphoethanolamine Graph monoalkyl-sn-glycero-3-phosphoethanolamines monoalkyl-sn-glycero-3-phosphoethanolamines http://purl.obolibrary.org/obo/CHEBI_138320 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:138329 biolink:ChemicalEntity ent-Photinus luciferin(1-) A monocarboxylic acid anion that is the conjugate base of ent-Photinus luciferin, obtained by deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD-20206|pubmed:14695520|pubmed:28454735 Graph (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate|(R)-4,5-dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylate|L-Photinus luciferin(1-)|L-firefly luciferin(1-)|firefly L-luciferin (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylate|(R)-4,5-dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylate|L-Photinus luciferin(1-)|L-firefly luciferin(1-)|firefly L-luciferin http://purl.obolibrary.org/obo/CHEBI_138329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138360 biolink:ChemicalEntity ditetradecanoyl phosphatidylglycerol(1-) A 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1−) that is the conjugate base of dimyristoyl phosphatidylglycerol; major species at pH 7.3. Graph (2R)-2,3-bis(tetradecanoyloxy)propyl (2S)-2,3-dihydroxypropyl phosphate|1,2-ditetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)|dimyristoyl phosphatidylglycerol(1-) (2R)-2,3-bis(tetradecanoyloxy)propyl (2S)-2,3-dihydroxypropyl phosphate (2R)-2,3-bis(tetradecanoyloxy)propyl (2S)-2,3-dihydroxypropyl phosphate|1,2-ditetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)|dimyristoyl phosphatidylglycerol(1-) http://purl.obolibrary.org/obo/CHEBI_138360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138365 biolink:ChemicalEntity allo-bile acid Any member of the class of bile acids having 5α-configuration. Usually found in lower vertebrates. Graph 5alpha-bile acid|5alpha-bile acids|allo-bile acids 5alpha-bile acid|5alpha-bile acids|allo-bile acids http://purl.obolibrary.org/obo/CHEBI_138365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138366 biolink:ChemicalEntity bile acids Any member of a group of hydroxy steroids occuring in bile, where they are present as the sodium salts of their amides with glycine or taurine. In mammals bile acids almost invariably have 5β-configuration, while in lower vertebrates, some bile acids, known as allo-bile acids, have 5α-configuration. Graph http://purl.obolibrary.org/obo/CHEBI_138366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138370 biolink:ChemicalEntity N(6)-(gamma-glutamyl)lysine residue An L-α-amino acid residue that is a representative structure of a protein with an N6-(γ-glutamyl)lysine crosslink. Graph N(6)-(5-glutamyl)-lysine residues N(6)-(5-glutamyl)-lysine residues http://purl.obolibrary.org/obo/CHEBI_138370 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138387 biolink:ChemicalEntity (18S)-hydroperoxyicosapentaenoic acid A hydroperoxyicosapentaenoic acid that is an icosapentaenoic acid in which the pro-S hydrogen at position 18 has been replaced by a hydroperoxy group. Graph (18S)-hydroperoxyeicosapentaenoic acid|(18S)-hydroperoxyeicosapentaenoic acids|(18S)-hydroperoxyicosapentaenoic acids|18-HpEPE (18S)-hydroperoxyeicosapentaenoic acid|(18S)-hydroperoxyeicosapentaenoic acids|(18S)-hydroperoxyicosapentaenoic acids|18-HpEPE http://purl.obolibrary.org/obo/CHEBI_138387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138392 biolink:ChemicalEntity hydroperoxyicosapentaenoic acid A hydroperoxy polyunsaturated fatty acid that is any icosapentaenoic fatty acid carrying a single hydroperoxy substituent. Graph HpEPE|hydroperoxyicosapentaenoic acids HpEPE|hydroperoxyicosapentaenoic acids http://purl.obolibrary.org/obo/CHEBI_138392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138397 biolink:ChemicalEntity octahydronaphthalenes Any carbobycyclic compound that is an octahydronaphthalene or a compound obtained from an octahydronaphthalene by formal substitution of one or more hydrogens. Graph http://purl.obolibrary.org/obo/CHEBI_138397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138408 biolink:ChemicalEntity isoprostane Any icosanoid with a prostaglandin-like structure formed in vivo by non-enzymatic free radical-catalysed reactions involving peroxidation of essential fatty acids (mainly arachidonic acid but also other fatty acids with 3 or more double bonds). Isoprostanes are abundant in tissues and fluids and have immunomodulating activity. Their concentration is dependent on the amount of oxidative stress and may be upregulated in certain diseases such as cancer, cardiovascular and neurological disorders. pubmed:10385607|pubmed:12088281|pubmed:12751772|pubmed:15037155|pubmed:15037162|pubmed:15650410|pubmed:15780831|pubmed:16382569|pubmed:18030056|pubmed:18285331|pubmed:20951733|pubmed:21848345|wikipedia.en:Isoprostane Graph IsoPs|isoprostanes IsoPs|isoprostanes http://purl.obolibrary.org/obo/CHEBI_138408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138412 biolink:ChemicalEntity N,N'-diphenylthiourea Thiourea in which each nitrogen carries a phenyl substituent. cas:102-08-9|pubmed:11011923|pubmed:11722495|pubmed:13914406|pubmed:21073181|pubmed:2138962|pubmed:28295200|pubmed:2957161|pubmed:5871245|pubmed:9145274|pubmed:9197970|reaxys:644277 Graph 1,3-Diphenyl-2-thiourea|1,3-Diphenylthiourea|DPTU|N,N'-diphenylthiourea|Sulfocarbanilide|Thiocarbanilide|diphenylthiourea|s-diphenylthiourea|sym-diphenylthiourea N,N'-diphenylthiourea 1,3-Diphenyl-2-thiourea|1,3-Diphenylthiourea|DPTU|N,N'-diphenylthiourea|Sulfocarbanilide|Thiocarbanilide|diphenylthiourea|s-diphenylthiourea|sym-diphenylthiourea http://purl.obolibrary.org/obo/CHEBI_138412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138435 biolink:ChemicalEntity bis(7)-tacrine A secondary amino compound consisting of two molecules of tacrine that are linked together through their exocyclic amino groups by a heptane-1,7-diyl chain. Bis(7)-tacrine is an acetylcholinesterase (AChE)inhibitor (IC50 0.40 nM, >1,000 times more potent than tacrine). It has also been found to protect against H2O2 -induced apoptosis in rat pheochromocytoma cells. chemspider:7828118|pdb-ccd:AA7|pubmed:10208549|pubmed:10452094|pubmed:16543809|pubmed:17449090|pubmed:17530875|pubmed:19393253|pubmed:20043893|pubmed:20199668|pubmed:20486153|pubmed:21535411|pubmed:22330749|pubmed:22553626|pubmed:23832279|pubmed:26043757|pubmed:28294041|pubmed:28571743|reaxys:7608979 Graph B7T|N,N'-bis(1,2,3,4-tetrahydro-9-acridinyl)-1,7-heptanediamine|N,N'-di(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine|bis(7)-tetrahydroaminacrine|heptylene-bis(tacrine) N,N'-di(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine B7T|N,N'-bis(1,2,3,4-tetrahydro-9-acridinyl)-1,7-heptanediamine|N,N'-di(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine|bis(7)-tetrahydroaminacrine|heptylene-bis(tacrine) http://purl.obolibrary.org/obo/CHEBI_138435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138437 biolink:ChemicalEntity (S)-3-hydroxytetradecanoate A (3S)-3-hydroxy fatty acid anion resulting from the deprotonation of the carboxy group of (3S)-3-hydroxytetradecanoic acid. The major species at pH 7.3. pubmed:18576672 Graph (3S)-3-hydroxymyristate|(3S)-3-hydroxytetradecanoate|(3S)-hydroxytetradecanoate|(S)-3-hydroxymyristate|(S)-beta-hydroxymyristate|L-beta-hydroxymyristate (3S)-3-hydroxytetradecanoate (3S)-3-hydroxymyristate|(3S)-3-hydroxytetradecanoate|(3S)-hydroxytetradecanoate|(S)-3-hydroxymyristate|(S)-beta-hydroxymyristate|L-beta-hydroxymyristate http://purl.obolibrary.org/obo/CHEBI_138437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138477 biolink:ChemicalEntity resolvin E3 A member of the class of resolvins that is (5Z,8Z,11Z,13E,15E)-icosapentaenoic acid which is substituted at positions 17 and 18 by hydroxy groups (the 17,18S stereoisomer). pubmed:22275352|pubmed:23293324|pubmed:24177907|pubmed:28652532|pubmed:29173199 Graph (5Z,8Z,11Z,13E,15E,18S)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid|RvE3 (5Z,8Z,11Z,13E,15E,18S)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid (5Z,8Z,11Z,13E,15E,18S)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid|RvE3 http://purl.obolibrary.org/obo/CHEBI_138477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138482 biolink:ChemicalEntity N(2)-[(3R)-hydroxy-acyl]-L-ornithine zwitterion An amino acid zwitterion resulting from the transfer of a proton from the carboxy to the side-chain amino group of any N2-[(3R)-hydroxy-acyl]-L-ornithine; major species at pH 7.3. metacyc.compound:LYSO-ORNITHINE-LIPIDS|pubmed:15341653|pubmed:22958119 Graph a lyso-ornithine lipid a lyso-ornithine lipid http://purl.obolibrary.org/obo/CHEBI_138482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138487 biolink:ChemicalEntity paullone An indolobenzazepine that is 5,6,7,12-tetrahydroindolo[3,2-d][1]benzazepine carrying an oxo substituent at position 6. cas:142273-18-5|pubmed:20559856|pubmed:21513499|pubmed:27737502|pubmed:28197562|reaxys:5342884 Graph 7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one|8,18-diazatetracyclo[9.7.0.0;{2,7}.0;{12,17}]octadeca-1(11),2,4,6,12(17),13,15-heptaen-9-one 7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one 7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one|8,18-diazatetracyclo[9.7.0.0;{2,7}.0;{12,17}]octadeca-1(11),2,4,6,12(17),13,15-heptaen-9-one http://purl.obolibrary.org/obo/CHEBI_138487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138490 biolink:ChemicalEntity 5(S)6-epoxy-18(S)-HEPE An epoxy fatty acid that is (7E,9E,11Z,14Z,16E)-icosa-7,9,11,14,16-pentaenoic acid carrying an epoxy group at position 5S and a hydroxy group at position 18S. It is an intermediate in resolvin E1 biosynthesis. lipidmaps:LMFA03070040|pubmed:21206090 Graph 4-{(2S,3R)-3-[(1E,3E,5Z,8Z,10E,12S)-12-hydroxytetradeca-1,3,5,8,10-pentaen-1-yl]oxiran-2-yl}butanoic acid|5S,6-Ep-18S-HEPE|5S,6-epoxy,18S-hydroxy-7E,9E,11Z,14Z,16E-eicosapentaenoic acid 4-{(2S,3R)-3-[(1E,3E,5Z,8Z,10E,12S)-12-hydroxytetradeca-1,3,5,8,10-pentaen-1-yl]oxiran-2-yl}butanoic acid 4-{(2S,3R)-3-[(1E,3E,5Z,8Z,10E,12S)-12-hydroxytetradeca-1,3,5,8,10-pentaen-1-yl]oxiran-2-yl}butanoic acid|5S,6-Ep-18S-HEPE|5S,6-epoxy,18S-hydroxy-7E,9E,11Z,14Z,16E-eicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_138490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13850 biolink:ChemicalEntity apoprotein An apoprotein is a protein devoid of its characteristic prosthetic group or metal. kegg.compound:C16240 Graph apoprotein|apoproteins apoprotein apoprotein|apoproteins http://purl.obolibrary.org/obo/CHEBI_13850 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138518 biolink:ChemicalEntity dialkyl phosphate(1-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH group of any dialkyl phosphate; major species at pH 7.3. Graph a dialkyl phosphate a dialkyl phosphate http://purl.obolibrary.org/obo/CHEBI_138518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138542 biolink:ChemicalEntity (18R)-resolvin E3 A member of the class of resolvins that is (5Z,8Z,11Z,13E,15E)-icosapentaenoic acid which is substituted at positions 17 and 18 by hydroxy groups (the 17,18R) stereoisomer). pubmed:23293324 Graph (5Z,8Z,11Z,13E,15E,18R)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid|18(R)-RvE3 (5Z,8Z,11Z,13E,15E,18R)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid (5Z,8Z,11Z,13E,15E,18R)-17,18-dihydroxyicosa-5,8,11,13,15-pentaenoic acid|18(R)-RvE3 http://purl.obolibrary.org/obo/CHEBI_138542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138560 biolink:ChemicalEntity 5-amino-1-(5-phospho-beta-D-ribosyl)imidazole A 1-(phosphoribosyl)imidazole that is 5-aminoimidazole in which the proton at position 1 has been replaced by a 5-phospho-β-D-ribofuranosyl group. cas:25635-88-5|hmdb:HMDB0001235|kegg.compound:C03373|knapsack:C00019655|metacyc.compound:5-PHOSPHORIBOSYL-5-AMINOIMIDAZOLE|pdb-ccd:AIR|pubmed:21135073|pubmed:21548610|pubmed:24525042|pubmed:25372694|pubmed:26100042|pubmed:26237670|pubmed:26524231|pubmed:27264098|reaxys:40768|wikipedia.en:5-Aminoimidazole_ribotide Graph 1-(5'-phosphoribosyl)-5-aminoimidazole|1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine|1-(5-phospho-D-Ribosyl)-5-aminoimidazole|5'-phosphoribosyl-5-aminoimidazole|5-Amino-1-beta-D-ribofuranosyl-5'-(dihydrogen phosphate)-imidazole|5-Amino-1-ribofuranosylimidazole 5'-phosphate|5-aminoimidazole ribonucleotide|AIR|Aminoimidazole ribonucleotide|Aminoimidazole ribotide|phosphoribosylaminoimidazole 1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine 1-(5'-phosphoribosyl)-5-aminoimidazole|1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine|1-(5-phospho-D-Ribosyl)-5-aminoimidazole|5'-phosphoribosyl-5-aminoimidazole|5-Amino-1-beta-D-ribofuranosyl-5'-(dihydrogen phosphate)-imidazole|5-Amino-1-ribofuranosylimidazole 5'-phosphate|5-aminoimidazole ribonucleotide|AIR|Aminoimidazole ribonucleotide|Aminoimidazole ribotide|phosphoribosylaminoimidazole http://purl.obolibrary.org/obo/CHEBI_138560 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138563 biolink:ChemicalEntity 5S(6)-epoxy-18(R)-HEPE The 18(R) stereoisomer of the epoxy-HEPE intermediate in RvE1 biosynthesis Graph http://purl.obolibrary.org/obo/CHEBI_138563 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138565 biolink:ChemicalEntity (5Z,8Z,11Z,14Z,16E,18R)-18-hydroperoxyicosapentaenoic acid A hydroperoxyicosapentaenoic acid that is (5Z,8Z,11Z,14Z,16E)-icosapentaenoic acid in which the pro-R hydrogen at position 18 has been replaced by a hydroperoxy group. One of the two stereoisomers formed when acetylated COX2 oxidises the ω-3 fatty acid EPA. reaxys:14535261 Graph (18R)-HpEPE|(5Z,8Z,11Z,14Z,16E,18R)-18-hydroperoxyicosa-5,8,11,14,16-pentaenoic acid|18(R)-HpEPE (18R)-HpEPE|(5Z,8Z,11Z,14Z,16E,18R)-18-hydroperoxyicosa-5,8,11,14,16-pentaenoic acid|18(R)-HpEPE (18R)-HpEPE|(5Z,8Z,11Z,14Z,16E,18R)-18-hydroperoxyicosa-5,8,11,14,16-pentaenoic acid|18(R)-HpEPE http://purl.obolibrary.org/obo/CHEBI_138565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138566 biolink:ChemicalEntity phosphatidylinositol 38:5 Graph PI 38:5|PI(38:5)|phosphatidylinositol(38:5) PI 38:5|PI(38:5)|phosphatidylinositol(38:5) http://purl.obolibrary.org/obo/CHEBI_138566 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138567 biolink:ChemicalEntity phosphatidylinositol 38:6 Graph PI 38:6|PI(38:6)|phosphatidylinositol(38:6) PI 38:6|PI(38:6)|phosphatidylinositol(38:6) http://purl.obolibrary.org/obo/CHEBI_138567 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138568 biolink:ChemicalEntity phosphatidylinositol 40:6 Graph PI 40:6|PI(40:6)|phosphatidylinositol(40:6) PI 40:6|PI(40:6)|phosphatidylinositol(40:6) http://purl.obolibrary.org/obo/CHEBI_138568 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138574 biolink:ChemicalEntity N-(docosanoyl)-hexadecasphing-4-enine-1-phosphocholine lipidmaps:LMSP03010061 Graph SM(d16:1/22:0) SM(d16:1/22:0) http://purl.obolibrary.org/obo/CHEBI_138574 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138590 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroperoxydocosahexaenoic acid A docosanoid that is (4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying a hydroperoxy substituent at position 17R. reaxys:14339388 Graph (17R)-HpDHA|(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid|17(R)-Hp-DHA|17(R)-HpDHA (4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid (17R)-HpDHA|(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroperoxydocosa-4,7,10,13,15,19-hexaenoic acid|17(R)-Hp-DHA|17(R)-HpDHA http://purl.obolibrary.org/obo/CHEBI_138590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138601 biolink:ChemicalEntity 4(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid A hydroperoxy fatty acid that is (5E,7Z,10Z,13Z,15E,19Z)-docosa-5,7,10,13,15,19-hexaenoic acid carrying a hydroperoxy group at the 4S-position and a hydroxy group at the 17R-position. pubmed:22087354 Graph (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid|4(S)-Hp-17(R)-HDHA|4(S)-hydroperoxy-17(R)-HDHA|4S-hydroperoxy-17R-HDHA|4S-hydroperoxy-17R-hydroxy-DHA (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid|4(S)-Hp-17(R)-HDHA|4(S)-hydroperoxy-17(R)-HDHA|4S-hydroperoxy-17R-HDHA|4S-hydroperoxy-17R-hydroxy-DHA http://purl.obolibrary.org/obo/CHEBI_138601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138602 biolink:ChemicalEntity 7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid A hydroperoxy fatty acid that is (4Z,8E,10Z,13Z,15E,19Z)-docosa-4,8,10,13,15,19-hexaenoic acid carrying a hydroperoxy group at the 7S-position and a hydroxy group at the 17R-position. It is an intermediate involved in the resolvin D1 biosynthesis pathway. pubmed:17244615|pubmed:22087354 Graph (4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid|7(S)-Hp-17(R)-HDHA|7S-hydroperoxy-17R-HDHA|7S-hydroperoxy-17R-hydroxy-DHA|7S-hydroperoxy-17R-hydroxydocosahexaenoic acid (4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid (4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid|7(S)-Hp-17(R)-HDHA|7S-hydroperoxy-17R-HDHA|7S-hydroperoxy-17R-hydroxy-DHA|7S-hydroperoxy-17R-hydroxydocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_138602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138606 biolink:ChemicalEntity indolobenzazepine An organic heterotetracyclic compound that consists of an indole moiety ortho-fused to any benzazepine. Graph indolobenzazepines indolobenzazepines http://purl.obolibrary.org/obo/CHEBI_138606 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138609 biolink:ChemicalEntity short-chain (R)-3-hydroxy fatty acyl-CoA(4-) An (R)-3-hydroxyacyl-CoA arising from deprotonation of the phosphate and diphosphate OH groups of any short-chain (3R)-hydroxy fatty acyl-CoA; major species at pH 7.3. Graph a short-chain (3R)-hydroxy fatty acyl-CoA a short-chain (3R)-hydroxy fatty acyl-CoA http://purl.obolibrary.org/obo/CHEBI_138609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138612 biolink:ChemicalEntity 4S(5)-epoxy-17R-hydroxydocosahexaenoic acid An epoxy fatty acid that is (6E,8E,10Z,13Z,15E,19Z)-docosa-6,8,10,13,15,19-hexaenoic acid which is carrying an epoxy group at position 4S and a hydroxy group at position 17R. It is a metabolite of docosahexaenoic acid that can be converted to a D-resolvin. lipidmaps:LMFA04000078|pubmed:21766791 Graph 3-{(2S)-3-[(1E,3E,5Z,8Z,10E,12R,14Z)-12-hydroxyheptadeca-1,3,5,8,10,14-hexaen-1-yl]oxiran-2-yl}propanoic acid|4S(5)-epoxy-17(R)-HDHA|4S(5)-epoxy-17R-hydroxy-DHA 3-{(2S)-3-[(1E,3E,5Z,8Z,10E,12R,14Z)-12-hydroxyheptadeca-1,3,5,8,10,14-hexaen-1-yl]oxiran-2-yl}propanoic acid 3-{(2S)-3-[(1E,3E,5Z,8Z,10E,12R,14Z)-12-hydroxyheptadeca-1,3,5,8,10,14-hexaen-1-yl]oxiran-2-yl}propanoic acid|4S(5)-epoxy-17(R)-HDHA|4S(5)-epoxy-17R-hydroxy-DHA http://purl.obolibrary.org/obo/CHEBI_138612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138613 biolink:ChemicalEntity 7S,8S-epoxy-17R-hydroxydocosahexaenoic acid A hydroxydocosahexaenoic acid that is (4Z,9E,11E,13Z,15E,19Z)-docosa-4,9,11,13,15,19-hexaenoic acid carrying an epoxy group at position 7S and a hydroxy group at position 17R. It is a metabolite of docosahexaenoic acid, and serves as a precursor to D-resolvins. lipidmaps:LMFA04000073|pubmed:17244615|pubmed:21766791 Graph (4Z)-6-{(2S,3S)-3-[(1E,3E,5Z,7E,9R,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hex-4-enoic acid|(7S,8S)-epoxy-17(R)-HDHA|7S,8-epoxy-17R-HDHA|7S,8S-epoxy-17R-HDHA|7S,8S-epoxy-17R-hydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|7S,8S-epoxy-17R-hydroxy-DHA|7S,8S-epoxy-17R-hydroxydocosahexaenoic acid (4Z)-6-{(2S,3S)-3-[(1E,3E,5Z,7E,9R,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hex-4-enoic acid (4Z)-6-{(2S,3S)-3-[(1E,3E,5Z,7E,9R,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hex-4-enoic acid|(7S,8S)-epoxy-17(R)-HDHA|7S,8-epoxy-17R-HDHA|7S,8S-epoxy-17R-HDHA|7S,8S-epoxy-17R-hydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid|7S,8S-epoxy-17R-hydroxy-DHA|7S,8S-epoxy-17R-hydroxydocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_138613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138614 biolink:ChemicalEntity aspirin-triggered resolvin D2 A member of the class of resolvins that is (4Z,8E,10Z,12E,14E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 7, 16 and 17 (the 7S,16R,17R-stereoisomer). lipidmaps:LMFA04030006|metacyc.compound:CPD66-61|pubmed:21071715|pubmed:24396341|pubmed:39565847 Graph (17R)-resolvin D2|(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid|(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosahexaenoic acid|17-epi-RvD2|17-epi-resolvin D2|17R-RvD2|17R-resolvin D2|7S,16R,17R-trihydroxy-4Z,8E,10Z,12E,14E,19Z-docosahexaenoic acid|AT-RvD2|AT-resolvin D2|aspirin triggered resolvin D2|aspirin-triggered RvD2|aspirin-triggered resolvin D2 (4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid (17R)-resolvin D2|(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid|(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosahexaenoic acid|17-epi-RvD2|17-epi-resolvin D2|17R-RvD2|17R-resolvin D2|7S,16R,17R-trihydroxy-4Z,8E,10Z,12E,14E,19Z-docosahexaenoic acid|AT-RvD2|AT-resolvin D2|aspirin triggered resolvin D2|aspirin-triggered RvD2|aspirin-triggered resolvin D2 http://purl.obolibrary.org/obo/CHEBI_138614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138615 biolink:ChemicalEntity aspirin-triggered resolvin D3 A member of the class of resolvins that is (5Z,7E,9E,13Z,15E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 4, 11 and 17 (the 4S,11R,17R-stereoisomer) metacyc.compound:CPD66-62|pubmed:23438740|pubmed:23438748|pubmed:23510485|pubmed:26462421|pubmed:27121596|pubmed:27171898|reaxys:23608063 Graph (4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid|(4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosahexaenoic acid|17-epi-RvD3|17-epi-resolvin D3|AT-RvD3|AT-resolvin D3|aspirin-triggered RvD3 (4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid (4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid|(4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosahexaenoic acid|17-epi-RvD3|17-epi-resolvin D3|AT-RvD3|AT-resolvin D3|aspirin-triggered RvD3 http://purl.obolibrary.org/obo/CHEBI_138615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138616 biolink:ChemicalEntity aspirin-triggered resolvin D4 A member of the class of resolvins that is (6E,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 4, 5 and 17 (the 4S,5R,17R-stereoisomer). pubmed:23293638|reaxys:14535292 Graph (4S,5R,6E,8E,10Z,13Z,15E,17R,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid|(4S,5R,6E,8E,10Z,13Z,15E,17R,19Z)-4,5,17-trihydroxydocosahexaenoic acid|17-epi-RvD4|17-epi-resolvin D4|AT-RvD4|AT-resolvin D4|aspirin-triggered RvD4 (4S,5R,6E,8E,10Z,13Z,15E,17R,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid (4S,5R,6E,8E,10Z,13Z,15E,17R,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid|(4S,5R,6E,8E,10Z,13Z,15E,17R,19Z)-4,5,17-trihydroxydocosahexaenoic acid|17-epi-RvD4|17-epi-resolvin D4|AT-RvD4|AT-resolvin D4|aspirin-triggered RvD4 http://purl.obolibrary.org/obo/CHEBI_138616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138617 biolink:ChemicalEntity aspirin-triggered resolvin D5 A member of the class of resolvins that is (5Z,8E,10Z,13Z,15Z,19Z)-docosahexaenoic acid carrying two hydroxy substituents at positions 7 and 17 (the 7S,17R-stereoisomer). Graph (5Z,7S,8E,10Z,13Z,15Z,17R,19Z)-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenoic acid|(5Z,7S,8E,10Z,13Z,15Z,17R,19Z)-7,17-dihydroxydocosahexaenoic acid|17-epi-RvD2|17-epi-resolvin D5|AT-RvD5|aspirin-triggered RvD5 (5Z,7S,8E,10Z,13Z,15Z,17R,19Z)-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenoic acid (5Z,7S,8E,10Z,13Z,15Z,17R,19Z)-7,17-dihydroxydocosa-5,8,10,13,15,19-hexaenoic acid|(5Z,7S,8E,10Z,13Z,15Z,17R,19Z)-7,17-dihydroxydocosahexaenoic acid|17-epi-RvD2|17-epi-resolvin D5|AT-RvD5|aspirin-triggered RvD5 http://purl.obolibrary.org/obo/CHEBI_138617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138618 biolink:ChemicalEntity aspirin-triggered resolvin D6 A member of the class of resolvins that is (5E,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying two hydroxy substituents at positions 4 and 17 (the 4S,17R-stereoisomer). reaxys:14339391 Graph (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid|(4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4,17-dihydroxydocosahexaenoic acid|17-epi-RvD6|17-epi-resolvin D6|aspirin-triggered RvD6 (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid (4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid|(4S,5E,7Z,10Z,13Z,15E,17R,19Z)-4,17-dihydroxydocosahexaenoic acid|17-epi-RvD6|17-epi-resolvin D6|aspirin-triggered RvD6 http://purl.obolibrary.org/obo/CHEBI_138618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13862 biolink:ChemicalEntity asparagusate beilstein:4800403 Graph 1,2-dithiolane-4-carboxylate|asparagusate 1,2-dithiolane-4-carboxylate 1,2-dithiolane-4-carboxylate|asparagusate http://purl.obolibrary.org/obo/CHEBI_13862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138625 biolink:ChemicalEntity (+)-jasmonic acid anion A jasmonate anion resulting from the removal of a proton from the carboxy group of (+)-jasmonic acid; major species at pH 7.3. pubmed:11287667 Graph (1S,2S)-jasmonic acid anion|(3S,7S)-jasmonate|{(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetate {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetate (1S,2S)-jasmonic acid anion|(3S,7S)-jasmonate|{(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetate http://purl.obolibrary.org/obo/CHEBI_138625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138626 biolink:ChemicalEntity N-[(3R)-12-hydroxyjasmonyl]-L-isoleucinate An N-jasmonyl-L-α-amino acid anion obtained by deprotonation of the carboxy group of N-(12-hydroxyjasmonyl)-L-isoleucine; major species at pH 7.3. pubmed:21576464 Graph (2S,3S)-2-(2-{(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate|L-isoleucine-12-hydroxyjasmonate (2S,3S)-2-(2-{(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate (2S,3S)-2-(2-{(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate|L-isoleucine-12-hydroxyjasmonate http://purl.obolibrary.org/obo/CHEBI_138626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138627 biolink:ChemicalEntity N-[(3R)-jasmonyl]-L-isoleucinate An N-jasmonyl-L-α-amino acid anion obtained by deprotonation of the carboxy group of N-[(3R)-jasmonyl]-L-isoleucine; major species at pH 7.3. pubmed:21576464 Graph (2S,3S)-3-methyl-2-(2-{(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate|(3R)-jasmonoyl-L-isoleucinate|a jasmonyl-L-isoleucinate (2S,3S)-3-methyl-2-(2-{(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate (2S,3S)-3-methyl-2-(2-{(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetamido)pentanoate|(3R)-jasmonoyl-L-isoleucinate|a jasmonyl-L-isoleucinate http://purl.obolibrary.org/obo/CHEBI_138627 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138640 biolink:ChemicalEntity 17(S)-HDoHE A polyunsaturated fatty acid that is (4Z,7Z,10Z,13Z,15E,19Z)-docosa-4,7,10,13,15,19-hexaenoic acid carrying a hydroxy substituent at the 17S-position. It is a metabolite of docosahexaenoic acid in human blood and mouse brain, and serves as a precursor to 17(S)-resolvins. cas:92693-03-3|lipidmaps:LMFA04000012|metacyc.compound:CPD-17450|pubmed:12590139|pubmed:19679107|pubmed:21156816|pubmed:22912397|pubmed:28404641|pubmed:29597117 Graph (17S)-hydroxydocosahexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoic acid|17S-HDHA|17S-hydroxy DHA|17S-hydroxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoic acid (17S)-hydroxydocosahexaenoic acid|(4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoic acid|17S-HDHA|17S-hydroxy DHA|17S-hydroxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_138640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138641 biolink:ChemicalEntity 4(S)-hydroperoxy-17(S)-hydroxydocosahexaenoic acid A hydroperoxy fatty acid that is (5E,7Z,10Z,13Z,15E,19Z)-docosa-5,7,10,13,15,19-hexaenoic acid carrying a hydroperoxy group at the 4S-position and a hydroxy group at the 17S-position. lipidmaps:LMFA04000068|pubmed:21766791 Graph (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid|4(S)-Hp-17(S)-HDHA|4(S)-hydroperoxy-17(S)-HDHA|4S-hydroperoxy-17S-HDHA|4S-hydroperoxy-17S-hydroxy-5E,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid|4S-hydroperoxy-17S-hydroxy-DHA (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4-hydroperoxy-17-hydroxydocosa-5,7,10,13,15,19-hexaenoic acid|4(S)-Hp-17(S)-HDHA|4(S)-hydroperoxy-17(S)-HDHA|4S-hydroperoxy-17S-HDHA|4S-hydroperoxy-17S-hydroxy-5E,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid|4S-hydroperoxy-17S-hydroxy-DHA http://purl.obolibrary.org/obo/CHEBI_138641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138642 biolink:ChemicalEntity 7(S)-hydroperoxy-17(S)-hydroxydocosahexaenoic acid A polyunsaturated fatty acid that is docosahexaenoic acid carrying a hydroperoxy substituent at 7S-position and a hydroxy substituent at the 17S-position Graph 7(S)-Hp-17(S)-HDHA 7(S)-Hp-17(S)-HDHA http://purl.obolibrary.org/obo/CHEBI_138642 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138643 biolink:ChemicalEntity resolvin D6 A member of the class of resolvins that is (5E,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying two hydroxy substituents at positions 4 and 17 (the 4S,17S-stereoisomer). lipidmaps:LMFA04030004|patent:US2010159540|pubmed:23991833|pubmed:25139562|pubmed:26019184|pubmed:27121596|pubmed:28765512|reaxys:14535278 Graph (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid|(4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4,17-dihydroxydocosahexaenoic acid|4S,17S-dihydroxy-5E,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid|RvD6 (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid (4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4,17-dihydroxydocosa-5,7,10,13,15,19-hexaenoic acid|(4S,5E,7Z,10Z,13Z,15E,17S,19Z)-4,17-dihydroxydocosahexaenoic acid|4S,17S-dihydroxy-5E,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid|RvD6 http://purl.obolibrary.org/obo/CHEBI_138643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138645 biolink:ChemicalEntity resolvin D5 A member of the class of resolvins that is (4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying two hydroxy substituents at positions 7 and 17 (the 7S,17S-stereoisomer). cas:578008-43-2|chemspider:45743318|foodb.food:FDB023286|hmdb:HMDB0004038|lipidmaps:LMFA04030003|pmc:PMC7257705|pubmed:16303609|pubmed:22538616|pubmed:22841830|pubmed:27320930|pubmed:27632672|pubmed:28098462|pubmed:28694292|pubmed:29358332|pubmed:31333464|pubmed:31693828|pubmed:32404334|pubmed:33047359 Graph (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoic acid|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosahexaenoic acid|7(S),17(S)-diHDHA|7(S),17(S)-resolvin D5|7S,17S-diHDHA|7S,17S-dihydroxy-4Z,8E,10Z,13Z,15E,19Z-docosahexaenoic acid|RvD5|resolvin-D5 (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoic acid (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoic acid|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosahexaenoic acid|7(S),17(S)-diHDHA|7(S),17(S)-resolvin D5|7S,17S-diHDHA|7S,17S-dihydroxy-4Z,8E,10Z,13Z,15E,19Z-docosahexaenoic acid|RvD5|resolvin-D5 http://purl.obolibrary.org/obo/CHEBI_138645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138646 biolink:ChemicalEntity 7S(8)-epoxy-17(S)-hydroxydocosahexaenoic acid A metabolite of docosahexaenoic acid that can be converted to 17(S)-RvD1 or 17(S)-RvD2 Graph 7S(8)-epoxy-17(S)-HDHA 7S(8)-epoxy-17(S)-HDHA http://purl.obolibrary.org/obo/CHEBI_138646 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138647 biolink:ChemicalEntity 4S(5)-epoxy-17(S)-hydroxydocosahexaenoic acid A metabolite of docosahexaenoic acid that can be converted to 17(S)-RvD3 or 17(S)-RvD4 Graph 4S(5)-epoxy-17(S)-HDHA 4S(5)-epoxy-17(S)-HDHA http://purl.obolibrary.org/obo/CHEBI_138647 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138648 biolink:ChemicalEntity resolvin D3 A member of the class of resolvins that is (5Z,7E,9E,13Z,15E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 4, 11 and 17 (the 4S,11R,17S-stereoisomer). metacyc.compound:CPD66-81|pubmed:23438740|pubmed:23438748|pubmed:23510485|pubmed:26462421|pubmed:26858146|pubmed:27121596|pubmed:27171898|pubmed:27534559|pubmed:27859331|pubmed:27994074|pubmed:28765512|pubmed:29238967|reaxys:23608061 Graph (4S,5Z,7E,9E,11R,13Z,15E,17S,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid|(4S,5Z,7E,9E,11R,13Z,15E,17S,19Z)-4,11,17-trihydroxydocosahexaenoic acid|RvD3 (4S,5Z,7E,9E,11R,13Z,15E,17S,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid (4S,5Z,7E,9E,11R,13Z,15E,17S,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid|(4S,5Z,7E,9E,11R,13Z,15E,17S,19Z)-4,11,17-trihydroxydocosahexaenoic acid|RvD3 http://purl.obolibrary.org/obo/CHEBI_138648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138649 biolink:ChemicalEntity resolvin D4 A member of the class of resolvins that is (6E,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 4, 5 and 17 (the 4S,5R,17S-stereoisomer). pubmed:15726828|pubmed:16799203|pubmed:21418190|pubmed:26462421|pubmed:26743932|pubmed:27534559|pubmed:27734186|pubmed:28765512 Graph (4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid|(4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosahexaenoic acid|RvD4 (4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid (4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosa-6,8,10,13,15,19-hexaenoic acid|(4S,5R,6E,8E,10Z,13Z,15E,17S,19Z)-4,5,17-trihydroxydocosahexaenoic acid|RvD4 http://purl.obolibrary.org/obo/CHEBI_138649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138651 biolink:ChemicalEntity O-(S-fatty acylpantetheine-4'-phosphoryl)-L-serine(1-) residue An O-(S-acylpantetheine-4'-phosphoryl)serine(1−) residue obtained by deprotonation of the phosphate OH group of any O-(S-fatty acylpantetheine-4'-phosphoryl)-L-serine residue. Graph O-(S-fatty acylpantetheine-4'-phosphoryl)-L-serine residue O-(S-fatty acylpantetheine-4'-phosphoryl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_138651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138653 biolink:ChemicalEntity (4Z,7Z,10S,11E,13Z,15E,17S,19Z)-10,17-dihydroxydocosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,7Z,11E,13Z,15E,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at positions 10 and 17 (the 10S,17S-stereoisomer). A natural isomer of protectin D1, one of the specialised proresolving mediators. pubmed:24262603|reaxys:19424117 Graph (4Z,7Z,10S,11E,13Z,15E,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|10(S),17(S)-dihydroxydocosa-4Z,7Z,11E,13Z,15E,19Z-hexaenoic acid|PDX (4Z,7Z,10S,11E,13Z,15E,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid (4Z,7Z,10S,11E,13Z,15E,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|10(S),17(S)-dihydroxydocosa-4Z,7Z,11E,13Z,15E,19Z-hexaenoic acid|PDX http://purl.obolibrary.org/obo/CHEBI_138653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138655 biolink:ChemicalEntity protectin D1 A dihydroxydocosahexaenoic acid that is (4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at positions 10 and 17 (the 10R,17S-stereoisomer). Protectin D1 is one of the specialised proresolving mediators. When produced in neural tissues, it is called neuroprotectin D1 hmdb:HMDB0003689|pubmed:22690022|pubmed:23686636|pubmed:23799606|pubmed:24107502|pubmed:24262603|pubmed:24520010|pubmed:25139562|pubmed:25617763|pubmed:26047923|pubmed:26427436|pubmed:26580578|pubmed:26955849|pubmed:27632672|pubmed:27866493|pubmed:27988338|pubmed:28109294|pubmed:28429196|pubmed:28430183|pubmed:28615451|pubmed:29177613|reaxys:18351330|wikipedia.en:Protectin_D1 Graph (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosahexaenoic acid|(N)PD1|(neuro)protectin D1|10(R),17(S)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|NPD1|PD1|neuroprotectin D1 (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosahexaenoic acid|(N)PD1|(neuro)protectin D1|10(R),17(S)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|NPD1|PD1|neuroprotectin D1 http://purl.obolibrary.org/obo/CHEBI_138655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138657 biolink:ChemicalEntity 6-(alpha-D-glucose-1-phospho)-alpha-D-mannoside Any α-D-mannoside derived from 6-(α-D-glucose-1-phospho)-α-D-mannose. Graph http://purl.obolibrary.org/obo/CHEBI_138657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138658 biolink:ChemicalEntity dilinoleoylglycerol A diglyceride that is glycerol in which any two of the hydroxy groups have undergone formal esterification by condensation with linoleic acid ((Z,Z)-octadeca-9,12-dienoic acid). Formula C39H68O5. For the structure shown, either R1 = H and R2 = linoleoyl or R1 = linoleoyl and R2 = H. Graph di-(9Z,12Z)-octadecadienoylglycerol di-(9Z,12Z)-octadecadienoylglycerol http://purl.obolibrary.org/obo/CHEBI_138658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138664 biolink:ChemicalEntity N-(omega-hydroxytriacontanoyl)sphingosine An N-acylsphingosine that has ω-hydroxytriacontanoyl as the acyl group. A bioactive sphingolipid found in the stratum corneum layer of mammalian epidermis. pubmed:20035755|pubmed:28248318 Graph N-(30-hydroxytriacontanoyl)-sphing-4-enine|N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]-30-hydroxytriacontanamide|N-omega-hydroxy C30:0 D-erythro-sphingosine|N-omega-hydroxytriacontanoyl D-erythro-sphingosine|N-omega-hydroxytriacontanoyl octadecasphin-4E-enine|N-omega-hydroxytriacontanoyl-D-erythro-sphingosine|N-omega-hydroxytriacontanoylsphingosine N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]-30-hydroxytriacontanamide N-(30-hydroxytriacontanoyl)-sphing-4-enine|N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]-30-hydroxytriacontanamide|N-omega-hydroxy C30:0 D-erythro-sphingosine|N-omega-hydroxytriacontanoyl D-erythro-sphingosine|N-omega-hydroxytriacontanoyl octadecasphin-4E-enine|N-omega-hydroxytriacontanoyl-D-erythro-sphingosine|N-omega-hydroxytriacontanoylsphingosine http://purl.obolibrary.org/obo/CHEBI_138664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138673 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,17S)-17-hydroxydocosapentaenoic acid A hydroxydocosapentaenoic acid that is (4Z,7Z,10Z,13Z,15E)-docosapentaenoic acid in which the hydroxy group is located at the 17S-position. The 17S-oxygenated product of ω-6-DPA which possesses anti-inflammatory activity. pubmed:22618200 Graph (17S)-HDPA(n-6)|(17S)-HDoPE(n-6)|(17S)-hydroxy-(4Z,7Z,10Z,13Z,15E)-docosapentaenoic acid|(4Z,7Z,10Z,13Z,15E,17S)-17-hydroxydocosa-4,7,10,13,15-pentaenoic acid|17(S)-HDPAn-6|17(S)-hydroxy-omega-6 docosapentaenoic acid (4Z,7Z,10Z,13Z,15E,17S)-17-hydroxydocosa-4,7,10,13,15-pentaenoic acid (17S)-HDPA(n-6)|(17S)-HDoPE(n-6)|(17S)-hydroxy-(4Z,7Z,10Z,13Z,15E)-docosapentaenoic acid|(4Z,7Z,10Z,13Z,15E,17S)-17-hydroxydocosa-4,7,10,13,15-pentaenoic acid|17(S)-HDPAn-6|17(S)-hydroxy-omega-6 docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_138673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138674 biolink:ChemicalEntity 10(S),17(S)-dihydroxy-omega 6-docosapentaenoic acid The 10(S),17(S)-dihydroxy product of omega 6-DPA which has anti-inflammatory activity pubmed:19324874|pubmed:21766791|pubmed:22618200|pubmed:23471029 Graph 10(S),17(S)-diHDPAn-6|10S,17S-dihydroxy-omega 6-docosapentaenoic acid 10(S),17(S)-diHDPAn-6|10S,17S-dihydroxy-omega 6-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_138674 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138675 biolink:ChemicalEntity gas molecular entity Any main group molecular entity that is gaseous at standard temperature and pressure (STP; 0°C and 100 kPa). wikipedia.en:https://en.wikipedia.org/wiki/Gas Graph gas molecular entities|gaseous molecular entities|gaseous molecular entity gas molecular entities|gaseous molecular entities|gaseous molecular entity http://purl.obolibrary.org/obo/CHEBI_138675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138726 biolink:ChemicalEntity 3'-unsubstituted flavone Any flavone lacking a substituent at position 3'. Graph 3'-unsubstituted flavones|a 3'-unsubstituted flavone 3'-unsubstituted flavones|a 3'-unsubstituted flavone http://purl.obolibrary.org/obo/CHEBI_138726 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138730 biolink:ChemicalEntity 3'-methoxyflavones Any methoxyflavone with a methoxy substituent at position 3'. metacyc.compound:3-O-methylflavonoids Graph 3'-methoxyflavone|3'-methoxyflavones|a 3'-methoxyflavone 3'-methoxyflavone|3'-methoxyflavones|a 3'-methoxyflavone http://purl.obolibrary.org/obo/CHEBI_138730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138731 biolink:ChemicalEntity 5'-hydroxy-3'-methoxyflavone Any hydroxyflavone with a hydroxy substituent at position 5' and a methoxy substituent at position 3'. Graph 5'-hydroxy-3'-methoxyflavones|a 5'-hydroxy-3'-methoxyflavone 5'-hydroxy-3'-methoxyflavones|a 5'-hydroxy-3'-methoxyflavone http://purl.obolibrary.org/obo/CHEBI_138731 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138732 biolink:ChemicalEntity 3',5'-dimethoxyflavone A dimethoxyflavone in which the hydroxy groups at positions 3' and 5' have been replaced by methoxy groups. metacyc.compound:35-di-O-methylflavonoids Graph 3',5'-dimethoxyflavones|a 3',5'-dimethoxyflavone 3',5'-dimethoxyflavones|a 3',5'-dimethoxyflavone http://purl.obolibrary.org/obo/CHEBI_138732 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138733 biolink:ChemicalEntity alpha-D-galactosyl ditrans,octacis-undecaprenyl diphosphate(2-) An organophosphate oxoanion obtained by deprotonation of the diphosphate OH groups of α-D-galactosyl ditrans,octacis-undecaprenyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-191 Graph 1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-galactopyranose|alpha-D-galactosyl-di-trans,octa-cis-undecaprenyl diphosphate 1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-galactopyranose 1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-galactopyranose|alpha-D-galactosyl-di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_138733 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138741 biolink:ChemicalEntity very long-chain primary fatty alcohol Any primary fatty alcohol with a chain length between C23 and C27. Graph a very long-chain primary fatty alcohol|very long-chain primary fatty alcohol|very long-chain primary fatty alcohols a very long-chain primary fatty alcohol|very long-chain primary fatty alcohol|very long-chain primary fatty alcohols http://purl.obolibrary.org/obo/CHEBI_138741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138742 biolink:ChemicalEntity cholesteryl hemisuccinate A dicarboxylic acid monoester resulting from the formal condensation of the hydroxy group of cholesterol with one of the carboxy groups of succinic acid. A detergent that is often used to replace cholesterol in protein crystallography, biochemical studies of proteins, and pharmacology. cas:1510-21-0|pdb-ccd:Y01|pubmed:18302031|pubmed:24526383|pubmed:25450348|pubmed:9067481|pubmed:9858729|reaxys:3181155 Graph 3beta-hydroxy-5-cholestene 3-hemisuccinate|4-[(3beta)-cholest-5-en-3-yloxy]-4-oxobutanoic acid|4-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid|cholest-5-en-3beta-yl hydrogen succinate|cholesteryl succinate 4-[(3beta)-cholest-5-en-3-yloxy]-4-oxobutanoic acid 3beta-hydroxy-5-cholestene 3-hemisuccinate|4-[(3beta)-cholest-5-en-3-yloxy]-4-oxobutanoic acid|4-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid|cholest-5-en-3beta-yl hydrogen succinate|cholesteryl succinate http://purl.obolibrary.org/obo/CHEBI_138742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138803 biolink:ChemicalEntity archaeosine 5'-phosphate zwitterionic residue A zwitterionic group derived from archaeosine, a 7-formamidino-7-deazaguanine; major microspecies at pH 7.3 pubmed:20129918|pubmed:22032275 Graph 7-deaza-7-carbamidoylguanosine 5'-monophosphate zwitterion residue|archaeosine residue 7-deaza-7-carbamidoylguanosine 5'-monophosphate zwitterion residue|archaeosine residue http://purl.obolibrary.org/obo/CHEBI_138803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138842 biolink:ChemicalEntity 3alpha-hydroxy bile acid CoA thioester(4-) A steroidal acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of any 3α-hydroxy bile acid; major species at pH 7.3. Graph a 3alpha-hydroxy bile acid CoA a 3alpha-hydroxy bile acid CoA http://purl.obolibrary.org/obo/CHEBI_138842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138843 biolink:ChemicalEntity 3-oxo bile acid CoA thioester(4-) A steroidal acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of any 3-oxo bile acid; major species at pH 7.3. Graph a 3-oxo bile acid CoA a 3-oxo bile acid CoA http://purl.obolibrary.org/obo/CHEBI_138843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138856 biolink:ChemicalEntity oxolinic acid A quinolinemonocarboxylic acid having the carboxy group at position 7 as well as oxo and ethyl groups at positions 4 and 1 respectively and a dioxolo ring fused at the 5- and 6-positions. A synthetic antibiotic, it is used in veterinary medicine for the treatment of bacterial infections in cattle, pigs and poultry. cas:14698-29-4|drugcentral:2024|gmelin:2609419|kegg.compound:C11342|kegg.drug:D02301|lincs.smallmolecule:LSM-5811|patent:US3287458|pdb-ccd:OXI|pubmed:1245092|pubmed:1650428|pubmed:19596082|pubmed:20151406|pubmed:22670590|pubmed:23353085|pubmed:23773949|pubmed:23816421|pubmed:26678217|pubmed:26920300|pubmed:29438107|pubmed:4616804|reaxys:620635|vsdb:1879|wikipedia.en:Oxolinic_acid Graph 1-Ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid|1-Ethyl-6,7-methylenedioxy-4-quinolone-3-carboxylic acid|5-Ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinoline-7-carboxylic acid|5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid|OA|acide oxolinique|acido oxolinico|acidum oxolinicum|oxolinic acid 5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid 1-Ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid|1-Ethyl-6,7-methylenedioxy-4-quinolone-3-carboxylic acid|5-Ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinoline-7-carboxylic acid|5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid|OA|acide oxolinique|acido oxolinico|acidum oxolinicum|oxolinic acid http://purl.obolibrary.org/obo/CHEBI_138856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138880 biolink:ChemicalEntity autophagy inducer Any compound that induces the process of autophagy (the self-digestion of one or more components of a cell through the action of enzymes originating within the same cell). Graph autophagocytosis inducer|autophagocytosis inducers|autophagy inducers autophagocytosis inducer|autophagocytosis inducers|autophagy inducers http://purl.obolibrary.org/obo/CHEBI_138880 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138881 biolink:ChemicalEntity beta-D-fructofuranose 1-phosphate(2-) a D-fructofuranose 1-phosphate(2−) obtained by deprotonation of the phosphate OH groups of β-D-fructofuranose 1-phosphate; major species at pH 7.3. metacyc.compound:FRU1P Graph 1-O-phosphonato-beta-D-fructofuranose|beta-D-fructofuranose 1-phosphate|beta-D-fructose 1-phosphate 1-O-phosphonato-beta-D-fructofuranose|beta-D-fructofuranose 1-phosphate 1-O-phosphonato-beta-D-fructofuranose|beta-D-fructofuranose 1-phosphate|beta-D-fructose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_138881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138890 biolink:ChemicalEntity peregrinol diphosphate A diterpenyl phosphate that is the 15-O-diphospho derivative of peregrinol. metacyc.compound:CPD-20436|pubmed:24990389 Graph (2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl trihydrogen diphosphate (2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl trihydrogen diphosphate (2E)-5-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_138890 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138897 biolink:ChemicalEntity 3',5'-unsubstituted flavanone A flavanone lacking any substituents at positions 3' and 5' Graph a 3',5'-unsubstituted flavanone a 3',5'-unsubstituted flavanone http://purl.obolibrary.org/obo/CHEBI_138897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138905 biolink:ChemicalEntity phosphatidic acid 36:4 Graph PA(36:4) PA(36:4) http://purl.obolibrary.org/obo/CHEBI_138905 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:138931 biolink:ChemicalEntity glutamine antagonist An antagonist that acts on glutamine receptors. pubmed:4400179 Graph glutamine antagonists glutamine antagonists http://purl.obolibrary.org/obo/CHEBI_138931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138934 biolink:ChemicalEntity N-(4-oxoglutaryl)-L-cysteinylglycine A dipeptide that is glutathione in which the amino group on the glutamyl residue has been replaced by an oxo group. metacyc.compound:CPD-19971|pubmed:28373563|reaxys:31104039 Graph N-(4-carboxy-4-oxobutanoyl)-L-cysteinylglycine|deaminated glutathione|gamma-(4-oxoglutaryl)-L-cysteinylglycine N-(4-carboxy-4-oxobutanoyl)-L-cysteinylglycine N-(4-carboxy-4-oxobutanoyl)-L-cysteinylglycine|deaminated glutathione|gamma-(4-oxoglutaryl)-L-cysteinylglycine http://purl.obolibrary.org/obo/CHEBI_138934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138935 biolink:ChemicalEntity S-nitroso-L-cysteine An L-cysteine derivative in which the sulfur atom carries a nitroso substituent. A cell-permeable low-molecular-weight nitrosothiol and nitric oxide donor. cas:51209-75-7|pdb-ccd:SNC|pubmed:22304688|pubmed:26444682|pubmed:26686469|pubmed:27064847|pubmed:27126574|pubmed:28081246|pubmed:28381519|pubmed:28440386|pubmed:28600633|pubmed:28764371|reaxys:3538115 Graph CysNO|L-CysSNO|NO-L-cysteine|NO-cysteine|Nitrosocysteine|S-Nitrosocysteine|S-nitroso-L-cysteine CysNO|L-CysSNO|NO-L-cysteine|NO-cysteine|Nitrosocysteine|S-Nitrosocysteine|S-nitroso-L-cysteine http://purl.obolibrary.org/obo/CHEBI_138935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138936 biolink:ChemicalEntity N(6)-hexadecanoyl-L-lysine residue An N6-acyl-L-lysine residue derived from N6-hexadecanoyl-L-lysine. Graph N(6)-hexadecanoyl-L-lysine residue|N(6)-palmitoyl-L-lysine residue|N(epsilon)-hexadecanoyl-L-lysine residue|N(epsilon)-palmitoyl-L-lysine residue N(6)-hexadecanoyl-L-lysine residue|N(6)-palmitoyl-L-lysine residue|N(epsilon)-hexadecanoyl-L-lysine residue|N(epsilon)-palmitoyl-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_138936 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138943 biolink:ChemicalEntity carnosate A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of carnosic acid. The major species at pH 7.3. metacyc.compound:CPD-18103|pubmed:26976595|pubmed:27703160 Graph 11,12-dihydroxy-13-isopropylpodocarpa-8,11,13-trien-17-oate|11,12-dihydroxyabieta-8,11,13-trien-20-oate|carnosate 11,12-dihydroxyabieta-8,11,13-trien-20-oate 11,12-dihydroxy-13-isopropylpodocarpa-8,11,13-trien-17-oate|11,12-dihydroxyabieta-8,11,13-trien-20-oate|carnosate http://purl.obolibrary.org/obo/CHEBI_138943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138977 biolink:ChemicalEntity quorum sensing inhibitor Any compound that interferes with bacterial communication (quorum sensing, QS). pubmed:16549654|pubmed:22286987|pubmed:24126008|pubmed:25189863|pubmed:25430794|pubmed:27977197|pubmed:28094526|pubmed:28241461|pubmed:28350449|pubmed:28421612|pubmed:28554093|pubmed:28789564|pubmed:28826080|pubmed:28851971|pubmed:29026943|pubmed:29085409 Graph QS inhibitor|QS inhibitors|QSI|QSIs|quorum sensing inhibitors QS inhibitor|QS inhibitors|QSI|QSIs|quorum sensing inhibitors http://purl.obolibrary.org/obo/CHEBI_138977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:138979 biolink:ChemicalEntity hemisuccinate A succinate ester in which only one of the carboxy groups of succinic acid has been esterified. Graph hemisuccinates hemisuccinates http://purl.obolibrary.org/obo/CHEBI_138979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139020 biolink:ChemicalEntity taurino group An organyl group that is the functional group of taurine attaching at the nitrogen Graph taurino taurino http://purl.obolibrary.org/obo/CHEBI_139020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139030 biolink:ChemicalEntity hydroxysafflor yellow A A C-glycosyl compound that is 3,4,5-trihydroxycyclohexa-2,5-dien-1-one which is substituted by β-D-glucosyl groups at positions 2 and 4, and by a p-hydroxycinnamoyl group at position 6. It is the main bioactive compound of a traditional Chinese medicine obtained from safflower (Carthamus tinctorius). cas:78281-02-4|foodb.food:FDB020474|hmdb:HMDB0040677|pubmed:25626885|pubmed:26607471|pubmed:26754542|pubmed:26777519|pubmed:27063983|pubmed:27086971|pubmed:27176815|pubmed:27457091|pubmed:27599591|pubmed:27713966|pubmed:27731393|pubmed:27894114|pubmed:27909717|pubmed:28068632|pubmed:28074914|pubmed:28097465|pubmed:28122306|pubmed:28154251|pubmed:28191279|pubmed:28264629|pubmed:28468657|pubmed:28553231|pubmed:28840700|pubmed:28932195|pubmed:28966242|pubmed:29076598|pubmed:29107614|pubmed:29107696|reaxys:8669627 Graph 2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-[(2E)-3-(4-hydroxyphenyl-1-oxo-2-propen-1-yl)]-2,5-cyclohexadien-1-one|2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-[(2E)-3-(4-hydroxyphenyl-1-oxo-prop-2-en-1-yl)]cyclohexa-2,5-dien-1-one|HSYA|safflomin A 2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-[(2E)-3-(4-hydroxyphenyl-1-oxo-2-propen-1-yl)]-2,5-cyclohexadien-1-one|2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-[(2E)-3-(4-hydroxyphenyl-1-oxo-prop-2-en-1-yl)]cyclohexa-2,5-dien-1-one|HSYA|safflomin A http://purl.obolibrary.org/obo/CHEBI_139030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139033 biolink:ChemicalEntity (-)-kolavenyl diphosphate A diterpenyl phosphate that is the O-diphospho derivative of (−)-kolavenol metacyc.compound:CPD-20259|pubmed:26603275|pubmed:27801964|pubmed:28204567 Graph (-)-kolavenyl pyrophosphate|(2E)-3-methyl-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate (2E)-3-methyl-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate (-)-kolavenyl pyrophosphate|(2E)-3-methyl-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_139033 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139034 biolink:ChemicalEntity (+)-kolavenyl diphosphate A diterpenyl phosphate that is the O-diphospho derivative of (+)-kolavenol metacyc.compound:CPD-20430 Graph (+)-kolavenyl pyrophosphate|(2E)-3-methyl-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate (2E)-3-methyl-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate (+)-kolavenyl pyrophosphate|(2E)-3-methyl-5-[(1R,2S,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_139034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139036 biolink:ChemicalEntity ent-Photinus luciferin metacyc.compound:CPD-20206|patent:WO2006070775|pubmed:24391868|reaxys:4196732 Graph (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid|L-Photinus luciferin|L-firefly luciferin|ent-firefly luciferin (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (4R)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid|L-Photinus luciferin|L-firefly luciferin|ent-firefly luciferin http://purl.obolibrary.org/obo/CHEBI_139036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139048 biolink:ChemicalEntity dihydroceramide An N-acylsphingoid obtained by formal condensation of the carboxy group of any fatty acid with the amino group of any dihydrosphingoid base. Graph N-acyldihydrosphingoid|N-acyldihydrosphingoids|a dihydroceramide|dihydroceramides N-acyldihydrosphingoid|N-acyldihydrosphingoids|a dihydroceramide|dihydroceramides http://purl.obolibrary.org/obo/CHEBI_139048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139051 biolink:ChemicalEntity phytoceramide A class of phytoceramides obtained by formal condensation of the carboxy group of any fatty acid with the amino group of any phytosphingoid base. Graph N-acylphytosphingosine|N-acylphytosphingosines|a phytoceramide|phytoceramides N-acylphytosphingosine|N-acylphytosphingosines|a phytoceramide|phytoceramides http://purl.obolibrary.org/obo/CHEBI_139051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139053 biolink:ChemicalEntity inositol-1-phosphophytoceramide(1-) An inositol phosphoceramide(1−) obtained by deprotonation of the free phosphate OH group of any inositol-1-phosphophytoceramide; major species at pH 7.3. Graph N-acylphytosphingosine-1-phospho-(1D-myo-inositol)(1-)|an inositol-1-phosphophytoceramide|inositol-1-phospho-N-acyl-4R-hydroxysphingoid(1-)|inositol-1-phospho-N-acylphytosphingoid(1-) N-acylphytosphingosine-1-phospho-(1D-myo-inositol)(1-)|an inositol-1-phosphophytoceramide|inositol-1-phospho-N-acyl-4R-hydroxysphingoid(1-)|inositol-1-phospho-N-acylphytosphingoid(1-) http://purl.obolibrary.org/obo/CHEBI_139053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139066 biolink:ChemicalEntity mannosylinositol-1-phosphophytoceramide(1-) An mannosylinositol phosphophytoceramide(1−) obtained by deprotonation of the free phosphate OH group of any mannosylinositol-1-phosphophytoceramide; major species at pH 7.3. Graph a mannosylinositol-1-phosphophytoceramide|mannosylinositol-1-phospho-N-acyl-4R-hydroxysphingoid(1-)|mannosylinositol-1-phospho-N-acylphytosphingoid(1-) a mannosylinositol-1-phosphophytoceramide|mannosylinositol-1-phospho-N-acyl-4R-hydroxysphingoid(1-)|mannosylinositol-1-phospho-N-acylphytosphingoid(1-) http://purl.obolibrary.org/obo/CHEBI_139066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139069 biolink:ChemicalEntity 4-hydroxytryptamine(1+) An organic cation resulting from the protonation of the primary amino group of 4-hydroxytryptamine. The major species at pH 7.3. metacyc.compound:CPD-20575|pubmed:28763571|reaxys:25990087 Graph 2-(4-hydroxy-1H-indol-3-yl)ethanaminium|4-hydroxytryptamine 2-(4-hydroxy-1H-indol-3-yl)ethanaminium 2-(4-hydroxy-1H-indol-3-yl)ethanaminium|4-hydroxytryptamine http://purl.obolibrary.org/obo/CHEBI_139069 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139070 biolink:ChemicalEntity norbaeocystin(1-) An organophosphate oxoanion obtained by deprotonation of the phosphate and protonation of the amino group of norbaeocystin; major species at pH 7.3. metacyc.compound:CPD-20577|pubmed:28763571 Graph 3-(2-azaniumylethyl)-1H-indol-4-yl phosphate|4-hydoxytryptamine phosphate(1-)|norbaeocystin 3-(2-azaniumylethyl)-1H-indol-4-yl phosphate 3-(2-azaniumylethyl)-1H-indol-4-yl phosphate|4-hydoxytryptamine phosphate(1-)|norbaeocystin http://purl.obolibrary.org/obo/CHEBI_139070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139072 biolink:ChemicalEntity psilocybin(1-) An organophosphate oxoanion resulting from the protons from the phosphate group and the protonation of the tertiary amino group of psilocybin. The major species at pH 7.3 metacyc.compound:CPD-20576 Graph 3-[2-(dimethylazaniumyl)ethyl]-1H-indol-4-yl phosphate|psilocybin 3-[2-(dimethylazaniumyl)ethyl]-1H-indol-4-yl phosphate 3-[2-(dimethylazaniumyl)ethyl]-1H-indol-4-yl phosphate|psilocybin http://purl.obolibrary.org/obo/CHEBI_139072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139089 biolink:ChemicalEntity N(6)-methyl-2'-deoxyadenosine 5'-monophosphate residue A purine deoxyribonucleotide residue derived from N6-methyl-2'-deoxyadenosine 5'-monophosphate Graph N(6)-methyl-dAMP residue N(6)-methyl-dAMP residue http://purl.obolibrary.org/obo/CHEBI_139089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139094 biolink:ChemicalEntity 2'-deoxyribose 5'-monophosphate residue A deoxyribonucleotide residue that has lost its base either spontaneously or through the action of glycosylases. pubmed:22048164 Graph AP site|abasic site in DNA|apurinic/apyrimidinic site AP site|abasic site in DNA|apurinic/apyrimidinic site http://purl.obolibrary.org/obo/CHEBI_139094 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:139095 biolink:ChemicalEntity 2'-deoxyribose 5'-monophosphate(1-) residue An organic anionic group that is the conjugate base of 2'-deoxyribose 5'-monophosphate residue obtained by deprotonation of the phosphate OH group; major species at pH 7.3. Graph a 2'-deoxyribose 5'-monophosphate residue a 2'-deoxyribose 5'-monophosphate residue http://purl.obolibrary.org/obo/CHEBI_139095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139098 biolink:ChemicalEntity alpha-D-galactosyl-(1->4)-beta-D-galactosyl group A β-D-galactosyl disaccharide group formed by removing the hydroxy group from the hemiacetal function of α-D-galactosyl-(1→4)-β-D-galactose. Implied reactive epitope within lactosylceramide. pubmed:29069089|pubmed:7534889 Graph Galalpha(1,4)Galbeta-|Galalpha1,4Galbeta-yl|alpha-D-Gal-(1->4)-beta-D-Gal-yl|alpha-D-Galp-(1->4)-beta-D-Galp-yl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl group alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl Galalpha(1,4)Galbeta-|Galalpha1,4Galbeta-yl|alpha-D-Gal-(1->4)-beta-D-Gal-yl|alpha-D-Galp-(1->4)-beta-D-Galp-yl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl group http://purl.obolibrary.org/obo/CHEBI_139098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1391 biolink:ChemicalEntity 3,4-methylenedioxymethamphetamine A member of the class of benzodioxoles that is 1,3-benzodioxole substituted by a 2-(methylamino)propyl group at position 5. cas:42542-10-9|drugbank:DB01454|hmdb:HMDB0041931|kegg.compound:C07577|pubmed:15062945|pubmed:18570171|reaxys:158675|wikipedia.en:MDMA Graph (RS)-3,4-(methylenedioxy)methamphetamine|1-(1,3-Benzodioxol-5-yl)-N-methyl-2-propanamine|1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine|3,4-Methylenedioxymethamphetamine|DL-(3,4-Methylenedioxy)methamphetamine|MDMA|N,alpha-dimethyl-1,3-benzodioxole-5-ethanamine|N-Methyl-3,4-methylenedioxyamphetamine|ecstasy 1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine (RS)-3,4-(methylenedioxy)methamphetamine|1-(1,3-Benzodioxol-5-yl)-N-methyl-2-propanamine|1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine|3,4-Methylenedioxymethamphetamine|DL-(3,4-Methylenedioxy)methamphetamine|MDMA|N,alpha-dimethyl-1,3-benzodioxole-5-ethanamine|N-Methyl-3,4-methylenedioxyamphetamine|ecstasy http://purl.obolibrary.org/obo/CHEBI_1391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139114 biolink:ChemicalEntity carotenoid psi-end derivative Any carotenoid derivative with a ψ-end group. metacyc.compound:Carotenoid-psi-end-group Graph a carotenoid psi-end derivative a carotenoid psi-end derivative http://purl.obolibrary.org/obo/CHEBI_139114 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:139115 biolink:ChemicalEntity carotenoid epsilon-end derivative Any carotenoid derivative with an ε-end group. metacyc.compound:Carotenoid-epsilon-end-group Graph a carotenoid epsilon-end derivative a carotenoid epsilon-end derivative http://purl.obolibrary.org/obo/CHEBI_139115 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:139120 biolink:ChemicalEntity carotenoid beta-end derivative Any carotenoid derivative with an β-end group metacyc.compound:Carotenoid-beta-end-group Graph a carotenoid beta-end derivative a carotenoid beta-end derivative http://purl.obolibrary.org/obo/CHEBI_139120 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:139145 biolink:ChemicalEntity 4-O-({poly[2-N-acetyl-alpha-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate groups of 4-O-({poly[2-N-acetyl-α-D-glucosaminyl-1-D-ribitylphosphonato]}-di{[2R]-1-glycerylphosphonato})-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate; major species at pH 7.3. pubmed:20185825|pubmed:25624472|pubmed:25697358 Graph 4-O-((2-N-acetyl-alpha-D-glucosaminyl-1-D-ribitylphospho)(n)-di((2R)-1-glycerylphospho))-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate 4-O-((2-N-acetyl-alpha-D-glucosaminyl-1-D-ribitylphospho)(n)-di((2R)-1-glycerylphospho))-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_139145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139149 biolink:ChemicalEntity 4-O-[poly(2-beta-D-glucosyl-1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion A polyanionic polymer obtained by deprotonation of the phosphate and diphosphate groups of 4-O-[poly(2-β-D-glucosyl-1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-α-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate; major species at pH 7.3. pubmed:23027967 Graph 4-O-((2-beta-D-glucosyl-1-D-ribitylphospho)(n)-1-D-ribitylphospho-(2R)-1-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion 4-O-((2-beta-D-glucosyl-1-D-ribitylphospho)(n)-1-D-ribitylphospho-(2R)-1-glycerylphospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion http://purl.obolibrary.org/obo/CHEBI_139149 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139150 biolink:ChemicalEntity (S,S)-bis-(3-oleoylglycero)-1-phosphate(1-) A 3,3'-lysobisphosphatidate obtained by deprotonation of the phosphate OH group of (S,S)-bis-(3-oleoylglycero)-1-phosphate; major species at pH 7.3. pubmed:21788486 Graph (S,S) 18:1(9Z) BMP(1-)|(S,S)-bis-(3-oleoyl-sn-glycero)-1-phosphate(1-)|(S,S)-bis-[3-(9Z-octadecenoyl)-2-lyso-sn-glycero]-1-phosphate(1-)|(S,S)-bis-[3-(9Z-octadecenoyl)]-1-phosphate(1-)|3-(9Z-octadecenoyl)-sn-glycero-1-phospho-(3'-(9Z-octadecenoyl)-1'-sn-glycerol)|bis[(2S)-2-hydroxy-3-{[(9Z)-octadec-9-enoyl]oxy}propyl] phosphate bis[(2S)-2-hydroxy-3-{[(9Z)-octadec-9-enoyl]oxy}propyl] phosphate (S,S) 18:1(9Z) BMP(1-)|(S,S)-bis-(3-oleoyl-sn-glycero)-1-phosphate(1-)|(S,S)-bis-[3-(9Z-octadecenoyl)-2-lyso-sn-glycero]-1-phosphate(1-)|(S,S)-bis-[3-(9Z-octadecenoyl)]-1-phosphate(1-)|3-(9Z-octadecenoyl)-sn-glycero-1-phospho-(3'-(9Z-octadecenoyl)-1'-sn-glycerol)|bis[(2S)-2-hydroxy-3-{[(9Z)-octadec-9-enoyl]oxy}propyl] phosphate http://purl.obolibrary.org/obo/CHEBI_139150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139151 biolink:ChemicalEntity ADP-5-ethyl-4-methylthiazole-2-carboxylate(3-) A organophosphate oxoanion obtained by deprotonation of the carboxy and phosphate groups of ADP-5-ethyl-4-methylthiazole-2-carboxylic acid; major species at pH 7.3. metacyc.compound:CPDQT-400|pubmed:22031445|pubmed:26919468 Graph ADP-5-ethyl-4-methylthiazole-2-carboxylate ADP-5-ethyl-4-methylthiazole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_139151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139166 biolink:ChemicalEntity secoiridoid An iridoid monoterpenoid in which a bond in the cyclopentane ring has been cleaved. Graph secoiridoids secoiridoids http://purl.obolibrary.org/obo/CHEBI_139166 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139173 biolink:ChemicalEntity heparin oligosaccharide Any oligosaccharide derivative resulting from either chemical or enzymatic cleavage of the polymeric glycosaminoglycan heparin. Graph heparin oligosaccharides heparin oligosaccharides http://purl.obolibrary.org/obo/CHEBI_139173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139189 biolink:ChemicalEntity 2-hydroxy fatty acid anion 16:0 A hydroxy fatty acid anion 16:0 in which the hydroxy substituent is located at position 2. Graph 2-hydroxy fatty acid 16:0 2-hydroxy fatty acid 16:0 http://purl.obolibrary.org/obo/CHEBI_139189 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139190 biolink:ChemicalEntity hydroxy fatty acid anion 16:0 Any hydroxy saturated fatty acid anion containing 16 carbons. Graph http://purl.obolibrary.org/obo/CHEBI_139190 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139191 biolink:ChemicalEntity 2-hydroxy fatty acid anion 18:0 A hydroxy fatty acid anion 18:0 in which the hydroxy substituent is located at position 2. Graph 2-hydroxy fatty acid 18:0 2-hydroxy fatty acid 18:0 http://purl.obolibrary.org/obo/CHEBI_139191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139192 biolink:ChemicalEntity hydroxy fatty acid anion 18:0 Any hydroxy saturated fatty acid anion containing 18 carbons. Graph http://purl.obolibrary.org/obo/CHEBI_139192 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139212 biolink:ChemicalEntity heparin pentasaccharide Any amino pentasaccharide obtained by either chemical or enzymatic cleavage of the polymeric glycosaminoglycan heparin. Graph heparin pentasaccharides heparin pentasaccharides http://purl.obolibrary.org/obo/CHEBI_139212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139217 biolink:ChemicalEntity 4-hydroxytryptamine A member of the class of tryptamines that is tryptamine in which the the indole ring has been substituted by a hydroxy group at position 4. cas:570-14-9|metacyc.compound:CPD-20575|pubmed:13697285|pubmed:1850475|pubmed:2812041|pubmed:600026|reaxys:151446 Graph 3-(2-aminoethyl)-1H-indol-4-ol|3-(2-aminoethyl)-indol-4-ol 3-(2-aminoethyl)-1H-indol-4-ol 3-(2-aminoethyl)-1H-indol-4-ol|3-(2-aminoethyl)-indol-4-ol http://purl.obolibrary.org/obo/CHEBI_139217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139218 biolink:ChemicalEntity secondary nitroalkane A nitroalkane in which the nitro group, -NO2, is attached to a saturated carbon atom which has two other carbon atoms attached to it. Major microspecies at pH 7.3. pubmed:15609931|pubmed:1719412|pubmed:22543734|pubmed:7762004|pubmed:9437534 Graph a secondary nitroalkane a secondary nitroalkane http://purl.obolibrary.org/obo/CHEBI_139218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139231 biolink:ChemicalEntity 5-methyldeoxycytidine 5'-monophosphate residue A deoxyribonucleotide residue derived from 5-methyldeoxycytidine 5'-monophosphate. Graph 5-methyl-dCMP residue 5-methyl-dCMP residue http://purl.obolibrary.org/obo/CHEBI_139231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139252 biolink:ChemicalEntity [8)-alpha-Neu5Ac-(2->]n polyanion A polyanionic polymer obtained by deprotonation of the carboxy groups of [8)-α-Neu5Ac-(2→]n; major species at pH 7.3. metacyc.compound:CPD-10464|pubmed:15809431|pubmed:17519228|pubmed:21390252|pubmed:6987220 Graph (N-acetyl-alpha-D-neuraminosyl-(2->8))(n) (N-acetyl-alpha-D-neuraminosyl-(2->8))(n) http://purl.obolibrary.org/obo/CHEBI_139252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139253 biolink:ChemicalEntity 9-cis-4-hydroxyretinoate A retinoid anion that is the conjugate base of 9-cis-4-hydroxyretinoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:14532297 Graph (2E,4E,6Z,8E)-9-(3-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoate|(9cis)-4-hydroxyretinoate|4-hydroxy-9-cis-retinoate|9-cis-4-hydroxyretinoate (2E,4E,6Z,8E)-9-(3-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoate|(9cis)-4-hydroxyretinoate (2E,4E,6Z,8E)-9-(3-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoate|(9cis)-4-hydroxyretinoate|4-hydroxy-9-cis-retinoate|9-cis-4-hydroxyretinoate http://purl.obolibrary.org/obo/CHEBI_139253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139258 biolink:ChemicalEntity all-trans-18-hydroxyretinoate A retinoid anion that is the conjugate base of all-trans-18-hydroxyretinoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:22020119 Graph (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoate|18-hydroxy-all-trans-retinoate|18-hydroxyretinoate|all-trans-18-hydroxyretinoate (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoate (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoate|18-hydroxy-all-trans-retinoate|18-hydroxyretinoate|all-trans-18-hydroxyretinoate http://purl.obolibrary.org/obo/CHEBI_139258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139285 biolink:ChemicalEntity [(2->8)-N,O(7)-diacetyl-alpha-D-neuraminosyl]n polyanion A polyanionic polymer obtained by deprotonation of the carboxy groups of [(2→8)-N,O7-diacetyl-α-D-neuraminosyl]n; major species at pH 7.3. pubmed:17519228|pubmed:6987220 Graph [(2->8)-O(7),N-diacetyl-alpha-D-neuraminosyl]n [(2->8)-O(7),N-diacetyl-alpha-D-neuraminosyl]n http://purl.obolibrary.org/obo/CHEBI_139285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139291 biolink:ChemicalEntity chlorophyll(1-) A cyclic tetrapyrrole anion that is the carbanion obtained by removal of the acidic proton from position 21 of any chlorophyll. Major species at pH 7.3 wikipedia.en:Chlorophyll Graph a chlorophyll a chlorophyll http://purl.obolibrary.org/obo/CHEBI_139291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139292 biolink:ChemicalEntity chlorophyllide(2-) A cyclic tetrapyrrole anion obtained by removal of the acidic proton from position 21 as well as deprotonation of the carboxy group of any chlorophyllide. Major species at pH 7.3 Graph a chlorophyllide a chlorophyllide http://purl.obolibrary.org/obo/CHEBI_139292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139300 biolink:ChemicalEntity (+)-jasmonic acid reaxys:2415413 Graph (1S,2S)-jasmonic acid|{(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetic acid {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetic acid (1S,2S)-jasmonic acid|{(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetic acid http://purl.obolibrary.org/obo/CHEBI_139300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139301 biolink:ChemicalEntity N-[(3R)-12-hydroxyjasmonyl]-L-isoleucine An L-isoleucine derivative resulting from the formal condensation of the carboxy group of (3R)-12-hydroxyjasmonic acid with the amino group of L-isoleucine. reaxys:26688570 Graph N-({(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine N-({(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine N-({(1R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine http://purl.obolibrary.org/obo/CHEBI_139301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139302 biolink:ChemicalEntity N-[(3R)-jasmonyl]-L-isoleucine An L-isoleucine derivative resulting from the formal condensation of the carboxy group of (3R)-jasmonic acid with the amino group of L-isoleucine. reaxys:18883676 Graph (3R)-jasmonoyl-L-isoleucine|N-({(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine N-({(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine (3R)-jasmonoyl-L-isoleucine|N-({(1R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetyl)-L-isoleucine http://purl.obolibrary.org/obo/CHEBI_139302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139338 biolink:ChemicalEntity EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitor Any EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor that interferes with the action of any such enzyme with reduced ascorbate as one donor, and incorporating of one atom of oxygen (EC 1.14.17.*). Graph EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitors|EC 1.14.17.* inhibitor|EC 1.14.17.* inhibitors EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitors|EC 1.14.17.* inhibitor|EC 1.14.17.* inhibitors http://purl.obolibrary.org/obo/CHEBI_139338 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:139339 biolink:ChemicalEntity EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitor An EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitor that interferes with the action of dopamine monooxygenase (EC 1.14.17.1). wikipedia.en:Dopamine_beta-hydroxylase Graph (3,4-dihydroxyphenethylamine)beta-mono-oxygenase inhibitor|(3,4-dihydroxyphenethylamine)beta-mono-oxygenase inhibitors|3,4-dihydroxyphenethylamine beta-oxidase inhibitor|3,4-dihydroxyphenethylamine beta-oxidase inhibitors|3,4-dihydroxyphenethylamine,ascorbate:oxygen oxidoreductase (beta-hydroxylating) inhibitor|3,4-dihydroxyphenethylamine,ascorbate:oxygen oxidoreductase (beta-hydroxylating) inhibitors|4-(2-aminoethyl)pyrocatechol beta-oxidase inhibitor|4-(2-aminoethyl)pyrocatechol beta-oxidase inhibitors|DbetaH inhibitor|DbetaH inhibitors|EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitors|EC 1.14.17.1 inhibitor|EC 1.14.17.1 inhibitors|MDBH (membrane-associated dopamine beta-monooxygenase) inhibitor|MDBH (membrane-associated dopamine beta-monooxygenase) inhibitors|SDBH (soluble dopamine beta-monooxygenase) inhibitor|SDBH (soluble dopamine beta-monooxygenase) inhibitors|dopa beta-hydroxylase inhibitor|dopa beta-hydroxylase inhibitors|dopamine beta-hydroxylase inhibitor|dopamine beta-hydroxylase inhibitors|dopamine beta-monooxygenase (EC 1.14.17.1) inhibitor|dopamine beta-monooxygenase (EC 1.14.17.1) inhibitors|dopamine beta-monooxygenase inhibitor|dopamine beta-monooxygenase inhibitors|dopamine beta-oxidase inhibitor|dopamine beta-oxidase inhibitors|dopamine hydroxylase inhibitor|dopamine hydroxylase inhibitors|dopamine-B-hydroxylase inhibitor|dopamine-B-hydroxylase inhibitors|oxygenase, dopamine beta-mono-phenylamine beta-hydroxylase inhibitor|oxygenase, dopamine beta-mono-phenylamine beta-hydroxylase inhibitors (3,4-dihydroxyphenethylamine)beta-mono-oxygenase inhibitor|(3,4-dihydroxyphenethylamine)beta-mono-oxygenase inhibitors|3,4-dihydroxyphenethylamine beta-oxidase inhibitor|3,4-dihydroxyphenethylamine beta-oxidase inhibitors|3,4-dihydroxyphenethylamine,ascorbate:oxygen oxidoreductase (beta-hydroxylating) inhibitor|3,4-dihydroxyphenethylamine,ascorbate:oxygen oxidoreductase (beta-hydroxylating) inhibitors|4-(2-aminoethyl)pyrocatechol beta-oxidase inhibitor|4-(2-aminoethyl)pyrocatechol beta-oxidase inhibitors|DbetaH inhibitor|DbetaH inhibitors|EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitors|EC 1.14.17.1 inhibitor|EC 1.14.17.1 inhibitors|MDBH (membrane-associated dopamine beta-monooxygenase) inhibitor|MDBH (membrane-associated dopamine beta-monooxygenase) inhibitors|SDBH (soluble dopamine beta-monooxygenase) inhibitor|SDBH (soluble dopamine beta-monooxygenase) inhibitors|dopa beta-hydroxylase inhibitor|dopa beta-hydroxylase inhibitors|dopamine beta-hydroxylase inhibitor|dopamine beta-hydroxylase inhibitors|dopamine beta-monooxygenase (EC 1.14.17.1) inhibitor|dopamine beta-monooxygenase (EC 1.14.17.1) inhibitors|dopamine beta-monooxygenase inhibitor|dopamine beta-monooxygenase inhibitors|dopamine beta-oxidase inhibitor|dopamine beta-oxidase inhibitors|dopamine hydroxylase inhibitor|dopamine hydroxylase inhibitors|dopamine-B-hydroxylase inhibitor|dopamine-B-hydroxylase inhibitors|oxygenase, dopamine beta-mono-phenylamine beta-hydroxylase inhibitor|oxygenase, dopamine beta-mono-phenylamine beta-hydroxylase inhibitors http://purl.obolibrary.org/obo/CHEBI_139339 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139340 biolink:ChemicalEntity 1,3-dihydroimidazole-2-thiones A member of the class of imidazoles that is 1,3-dihydroimidazole-2-thione and its derivatives by substitution. Graph http://purl.obolibrary.org/obo/CHEBI_139340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139350 biolink:ChemicalEntity alpha-D-Gal-(1->3)-alpha-D-GlcNAc-(1->4)-D-Gal-yl group A galactosyl group derived from α-D-Gal-(1→3)-α-D-GlcNAc-(1→4)-D-Gal. The precursor oligosaccharide group for the ABO blood group system. Graph alpha-D-galactosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-(1->4)-D-galactosyl group alpha-D-galactosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-(1->4)-D-galactosyl group http://purl.obolibrary.org/obo/CHEBI_139350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139351 biolink:ChemicalEntity alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group An α-D-galactosyl group derived from α-L-Fuc-(1→2)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-α-D-Gal-yl group. The blood group O (H) antigen from which subsequent sugar additions form blood groups A, B and AB Graph http://purl.obolibrary.org/obo/CHEBI_139351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139352 biolink:ChemicalEntity alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group An α-D-galactosyl group derived from α-D-GalNAc-(1→3)-[α-L-Fuc-(1→2)]-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-α-D-Gal. Blood group A antigen. Graph http://purl.obolibrary.org/obo/CHEBI_139352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139353 biolink:ChemicalEntity alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group A galactosyl group derived from α-D-Gal-(1→3)-[α-L-Fuc-(1→2)]-β-D-Gal-(1→4)-β-D-GlcNAc-(1→3)-α-D-Gal-yl group. Blood group B antigen. Graph alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group http://purl.obolibrary.org/obo/CHEBI_139353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139357 biolink:ChemicalEntity (13)C-modified compound An isotopically modified compound in which the abundance of a 13C isotope at one or more positions has been increased above that of the naturally occurring level. Graph (13)C-enriched compound|(13)C-enriched compounds|(13)C-labeled compound|(13)C-labeled compounds|(13)C-labelled compound|(13)C-labelled compounds|(13)C-modified compounds (13)C-enriched compound|(13)C-enriched compounds|(13)C-labeled compound|(13)C-labeled compounds|(13)C-labelled compound|(13)C-labelled compounds|(13)C-modified compounds http://purl.obolibrary.org/obo/CHEBI_139357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139358 biolink:ChemicalEntity isotopically modified compound Any molecular entity in which the isotopic ratio of nuclides for at least one element deviates measurably from that occurring in nature. The term includes both isotopically substituted compounds (in which essentially all the molecules of the compound have only the indicated nuclide(s) at each designated position) and isotopically labeled compounds (a formal mixture of an isotopically unmodified compound with one or more analogous isotopically substituted compound(s). Graph isotopically modified compounds isotopically modified compounds http://purl.obolibrary.org/obo/CHEBI_139358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139361 biolink:ChemicalEntity TRP channel blocker An agent that inhibits the passage of cations through the transient receptor potential (TRP) channels. pubmed:17445088|pubmed:21198543|pubmed:21607648|pubmed:22308955|wikipedia.en:Transient_receptor_potential_channel Graph TRP channel blockers|transient receptor potential channel blocker|transient receptor potential channel blockers TRP channel blockers|transient receptor potential channel blocker|transient receptor potential channel blockers http://purl.obolibrary.org/obo/CHEBI_139361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139371 biolink:ChemicalEntity aryl sulfate oxoanion An organosulfate oxoanion obtained by deprotonation of the sulfo group of any aryl sulfate. The R group in this structure represents an aromatic ring. Graph aryl sulfate anion|aryl sulfate anions|aryl sulfate oxoanions aryl sulfate anion|aryl sulfate anions|aryl sulfate oxoanions http://purl.obolibrary.org/obo/CHEBI_139371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139388 biolink:ChemicalEntity 1,3,7,9-tetramethyluric acid An oxopurine that is uric acid in which the hydrogens at positions 1,3,7 and 9 are replaced by methyl groups. It is a purine alkaloid that is found in Chinese tea known as kucha (Camellia assamica var. kucha) and exhibits anti-inflammatory and analgesic properties. cas:2309-49-1|chemspider:67862|foodb.food:FDB015351|hmdb:HMDB0004328|knapsack:C00034312|metacyc.compound:CPD-12505|patent:CN101289448|pubmed:12009315|pubmed:1383710|pubmed:14977550|pubmed:20227468|pubmed:22579816|pubmed:23678853|pubmed:23724689|pubmed:26610558|pubmed:26766930|pubmed:27164220|pubmed:27635133|pubmed:28864241|pubmed:28875060|pubmed:29727630|pubmed:31172618|pubmed:31298401|pubmed:32193380|pubmed:32286351|pubmed:32546720|pubmed:32707370|pubmed:32730889|pubmed:32829142|pubmed:331090|wikipedia.en:Theacrine Graph 1,3,7,9-tetramethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione|1,3,7,9-tetramethyluric acid|Ba 2750|TeaCrine|temorine|temurin|tetramethyl uric acid|tetramethyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione|tetramethyluric acid|theacrine 1,3,7,9-tetramethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione 1,3,7,9-tetramethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione|1,3,7,9-tetramethyluric acid|Ba 2750|TeaCrine|temorine|temurin|tetramethyl uric acid|tetramethyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione|tetramethyluric acid|theacrine http://purl.obolibrary.org/obo/CHEBI_139388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139394 biolink:ChemicalEntity alpha-D-galactosyl ditrans,octacis-undecaprenyl diphosphate A polyprenyl glucosyl phosphate in which an α-D-galactosyl residue is linked to a undecaprenyl group via a diphospho group. Graph 1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-galactopyranose|alpha-D-galactosyl ditrans,polycis-undecaprenyl diphosphate 1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-galactopyranose 1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-galactopyranose|alpha-D-galactosyl ditrans,polycis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_139394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13941 biolink:ChemicalEntity carbamate beilstein:3903503|cas:302-11-4|gmelin:239604 Graph Carbamat|Karbamat|carbamate|carbamate ion|carbamic acid, ion(1-) carbamate Carbamat|Karbamat|carbamate|carbamate ion|carbamic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_13941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139419 biolink:ChemicalEntity beta-D-fructofuranose 1-phosphate A D-fructofuranose 1-phosphate in which the anomeric centre has β-configuration. metacyc.compound:FRU1P|pdb-ccd:F1X|pubmed:21239488|reaxys:8783840 Graph 1-O-phosphono-beta-D-fructofuranose|1-O-phosphono-beta-D-fructose|beta-D-fructofuranose 1-(dihydrogen phosphate)|beta-D-fructose 1-phosphate 1-O-phosphono-beta-D-fructofuranose|beta-D-fructofuranose 1-(dihydrogen phosphate) 1-O-phosphono-beta-D-fructofuranose|1-O-phosphono-beta-D-fructose|beta-D-fructofuranose 1-(dihydrogen phosphate)|beta-D-fructose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_139419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139479 biolink:ChemicalEntity norbaeocystin A tryptamine alkaloid that is tryptamine carrying an additional phosphoryloxy substituent at position 4. cas:21420-59-7|metacyc.compound:CPD-20577|pubmed:25826052|pubmed:28763571|pubmed:5684732|reaxys:421031|wikipedia.en:Norbaeocystin Graph 3-(2-aminoethyl)-1H-indol-4-yl dihydrogen phosphate|4-hydoxytryptamine 4-phosphate|4-hydoxytryptamine phosphate 3-(2-aminoethyl)-1H-indol-4-yl dihydrogen phosphate 3-(2-aminoethyl)-1H-indol-4-yl dihydrogen phosphate|4-hydoxytryptamine 4-phosphate|4-hydoxytryptamine phosphate http://purl.obolibrary.org/obo/CHEBI_139479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139485 biolink:ChemicalEntity Mycolipanolic acid (C24) lipidmaps:LMFA01020332 Graph http://purl.obolibrary.org/obo/CHEBI_139485 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:139492 biolink:ChemicalEntity sensitiser A chemical compound that causes a substantial proportion of exposed people or animals to develop an allergic reaction in normal tissue after repeated exposure to the compound. Graph sensitisers|sensitizer|sensitizers sensitisers|sensitizer|sensitizers http://purl.obolibrary.org/obo/CHEBI_139492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139493 biolink:ChemicalEntity N(4)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc]-L-Asn residue An N4-glycosylated L-asparagine residue derived from N4-[α-D-Man-(1→2)-α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc]-L-Asn. metacyc.compound:Man9GlcNAc2-proteins|pubmed:11162524|pubmed:16373354|pubmed:17933909|pubmed:8910335 Graph an N(4)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->6))-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc]-L-Asn residue an N(4)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->6))-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc]-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_139493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1395 biolink:ChemicalEntity 3,5-dibromo-4-hydroxybenzoic acid A monohydroxybenzoic acid that is p-salicylic acid with bromo- substituents at C-3 and C-5 of the benzene ring. cas:3337-62-0|kegg.compound:C03925|pubmed:15589368|reaxys:2416147 Graph 3,5-Dibrom-4-hydroxy-benzoesaeure|3,5-dibromo-4-hydroxybenzoic acid|3,5-dibromo-p-salicylic acid|DiBrHBz|acide dibromo-3,5 hydroxy-4-benzoique|bromoxynylbenzoic acid 3,5-dibromo-4-hydroxybenzoic acid 3,5-Dibrom-4-hydroxy-benzoesaeure|3,5-dibromo-4-hydroxybenzoic acid|3,5-dibromo-p-salicylic acid|DiBrHBz|acide dibromo-3,5 hydroxy-4-benzoique|bromoxynylbenzoic acid http://purl.obolibrary.org/obo/CHEBI_1395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139504 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[β-D-GlcNAc-(1→4)]-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc}-L-Asn metacyc.compound:2-4-2-N-linked-Glycan|pubmed:1325461 Graph N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asp residue N(4)-{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asp residue http://purl.obolibrary.org/obo/CHEBI_139504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139507 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→4)]-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc}-L-Asn. kegg.glycan:G00020|metacyc.compound:24-2-N-linked-Glycan|pubmed:10372966|pubmed:20015870 Graph N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_139507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139510 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→4)]-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc}-L-Asn. kegg.glycan:G00021|metacyc.compound:24-26-N-linked-Glycan Graph N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_139510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139511 biolink:ChemicalEntity reduced coenzyme F420-(gamma-Glu)n polyanion A polyanionic polymer obtained by global deprotonation of the carboxy and phosphate groups of reduced coenzyme F420-(γ-Glu)n. Major microspecies at pH 7.3 Graph reduced coenzyme F420-(gamma-Glu)n reduced coenzyme F420-(gamma-Glu)n http://purl.obolibrary.org/obo/CHEBI_139511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139512 biolink:ChemicalEntity EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor An EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of enoyl-[acyl-carrier-protein] reductase (NADH), EC 1.3.1.9. wikipedia.en:Enoyl-acyl_carrier_protein_reductase Graph EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitors|EC 1.3.1.9 inhibitor|EC 1.3.1.9 inhibitors|ENR inhibitor|ENR inhibitors|NADH-enoyl acyl carrier protein reductase inhibitor|NADH-enoyl acyl carrier protein reductase inhibitors|NADH-specific enoyl-ACP reductase inhibitor|NADH-specific enoyl-ACP reductase inhibitors|acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitor|acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitors|enoyl-ACP reductase inhibitor|enoyl-ACP reductase inhibitors|enoyl-[acyl carrier protein] reductase inhibitor|enoyl-[acyl carrier protein] reductase inhibitors EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitors|EC 1.3.1.9 inhibitor|EC 1.3.1.9 inhibitors|ENR inhibitor|ENR inhibitors|NADH-enoyl acyl carrier protein reductase inhibitor|NADH-enoyl acyl carrier protein reductase inhibitors|NADH-specific enoyl-ACP reductase inhibitor|NADH-specific enoyl-ACP reductase inhibitors|acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitor|acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitors|enoyl-ACP reductase inhibitor|enoyl-ACP reductase inhibitors|enoyl-[acyl carrier protein] reductase inhibitor|enoyl-[acyl carrier protein] reductase inhibitors http://purl.obolibrary.org/obo/CHEBI_139512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139513 biolink:ChemicalEntity N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue An N4-glycosylated L-asparagine residue derived from N4-{β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→4)]-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→4)]-[β-D-GlcNAc-(1→6)]-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAc}-L-Asn. kegg.glycan:G00022|metacyc.compound:24-246-N-linked-Glycan Graph N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue N(4)-{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue http://purl.obolibrary.org/obo/CHEBI_139513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139519 biolink:ChemicalEntity thymidine dimer(2-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of thymidine dimer residue; major microspecies at pH 7.3 metacyc.compound:CPD-11643 Graph thymidine dimer residue thymidine dimer residue http://purl.obolibrary.org/obo/CHEBI_139519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139520 biolink:ChemicalEntity phenolic donor Any phenol that acts as an electron donor. metacyc.compound:Phenolic-Donors|pubmed:16098794 Graph a phenolic donor|phenolic donors a phenolic donor|phenolic donors http://purl.obolibrary.org/obo/CHEBI_139520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139521 biolink:ChemicalEntity phenolic radical donor Any phenoxy radical that acts as an electron donor. metacyc.compound:Phenoxyl-rad-of-phenolic-donors|pubmed:33810819 Graph a phenolic radical donor|a phenoxyl radical of a phenolic donor|phenolic radical donors a phenolic radical donor|a phenoxyl radical of a phenolic donor|phenolic radical donors http://purl.obolibrary.org/obo/CHEBI_139521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139539 biolink:ChemicalEntity (S,S)-bis-(3-oleoylglycero)-1-phosphate A 2,2'-lysobisphosphatidic acid in which both acyl groups are specified as oleoyl. pubmed:21788486|reaxys:28957883 Graph (S,S) 18:1(9Z) BMP|(S,S)-bis-(3-oleoyl-sn-glycero)-1-phosphate|(S,S)-bis-[3-(9Z-octadecenoyl)-sn-glycero]-1-phosphate|(S,S)-bis-[3-(9Z-octadecenoyl)glycero]-1-phosphate|(hydroxyphosphoryl)bis[oxy(2S)-2-hydroxypropane-3,1-diyl] (9Z,9'Z)di-octadec-9-enoate (hydroxyphosphoryl)bis[oxy(2S)-2-hydroxypropane-3,1-diyl] (9Z,9'Z)di-octadec-9-enoate (S,S) 18:1(9Z) BMP|(S,S)-bis-(3-oleoyl-sn-glycero)-1-phosphate|(S,S)-bis-[3-(9Z-octadecenoyl)-sn-glycero]-1-phosphate|(S,S)-bis-[3-(9Z-octadecenoyl)glycero]-1-phosphate|(hydroxyphosphoryl)bis[oxy(2S)-2-hydroxypropane-3,1-diyl] (9Z,9'Z)di-octadec-9-enoate http://purl.obolibrary.org/obo/CHEBI_139539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139556 biolink:ChemicalEntity EC 4.1.1.17 (ornithine decarboxylase) inhibitor An EC 4.1.1.* (carboxy-lyase) inhibitor that interferes with the action of ornithine decarboxylase (EC 4.1.1.17). Graph EC 4.1.1.17 (ornithine decarboxylase) inhibitors|EC 4.1.1.17 inhibitor|EC 4.1.1.17 inhibitors|L-ornithine carboxy-lyase (putrescine-forming) inhibitor|L-ornithine carboxy-lyase (putrescine-forming) inhibitors|L-ornithine carboxy-lyase inhibitor|L-ornithine carboxy-lyase inhibitors|ODC inhibitor|ODC inhibitors|SpeC inhibitor|SpeC inhibitors EC 4.1.1.17 (ornithine decarboxylase) inhibitors|EC 4.1.1.17 inhibitor|EC 4.1.1.17 inhibitors|L-ornithine carboxy-lyase (putrescine-forming) inhibitor|L-ornithine carboxy-lyase (putrescine-forming) inhibitors|L-ornithine carboxy-lyase inhibitor|L-ornithine carboxy-lyase inhibitors|ODC inhibitor|ODC inhibitors|SpeC inhibitor|SpeC inhibitors http://purl.obolibrary.org/obo/CHEBI_139556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139557 biolink:ChemicalEntity antalarmin A pyrrolopyrimidine that is 7H-pyrrolo[2,3-d]pyrimidin-4-amine which is substituted by methyl groups at positions 2, 5, and 6, by a mesityl group at position 7, and in which the amino substituent at position 4 has been substituted by ethyl and butyl groups. It is an antagonist of corticotropin-releasing factor 1 (CRF-1) receptors (Ki = 1 nM). cas:157284-96-3|pubmed:12097816|pubmed:15696320|pubmed:16820021|pubmed:17182090|pubmed:17397037|pubmed:17705061|pubmed:18423834|pubmed:18428980|pubmed:18830607|pubmed:19573565|pubmed:21203337|pubmed:23211705|pubmed:23796983|pubmed:24444675|pubmed:8940412|pubmed:9886810|wikipedia.en:Antalarmin Graph N-butyl-N-ethyl-7-mesityl-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine N-butyl-N-ethyl-7-mesityl-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine N-butyl-N-ethyl-7-mesityl-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine http://purl.obolibrary.org/obo/CHEBI_139557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13956 biolink:ChemicalEntity ceramide 1-phosphate A phosphosphingolipid consisting of any ceramide phosphorylated at position 1 Graph http://purl.obolibrary.org/obo/CHEBI_13956 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139563 biolink:ChemicalEntity octadecatrienoyl-CoA(4-) A polyunsaturated fatty acyl-CoA(4−) in which the S-acyl moiety contains 18 carbons and 3 double bonds at unknown positions. Major species at pH 7.3. Graph octadecatrienoyl-CoA octadecatrienoyl-CoA http://purl.obolibrary.org/obo/CHEBI_139563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139565 biolink:ChemicalEntity octadecadienoyl-CoA(4-) A polyunsaturated fatty acyl-CoA(4−) in which the S-acyl moiety contains 18 carbons and 2 double bonds at unknown positions. Major species at pH 7.3. Graph octadecadienoyl-CoA octadecadienoyl-CoA http://purl.obolibrary.org/obo/CHEBI_139565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139567 biolink:ChemicalEntity octadecenoyl-CoA(4-) A long-chain fatty acyl-CoA(4−) in which the S-acyl moiety contains 18 carbons and 1 double bond. Major species at pH 7.3. Graph octadecenoate-CoA octadecenoate-CoA http://purl.obolibrary.org/obo/CHEBI_139567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139572 biolink:ChemicalEntity hexadecenoyl-CoA(4-) A long-chain fatty acyl-CoA in which the S-acyl moiety contains 16 carbons and 1 double bond. Major species at pH 7.3. Graph hexadecenoate-CoA|hexadecenoyl-CoA (4-)|hexadecenoyl-coenzyme A(4-) hexadecenoate-CoA|hexadecenoyl-CoA (4-)|hexadecenoyl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_139572 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139574 biolink:ChemicalEntity octadecenoyl-CoA Any unsaturated fatty acyl-CoA in which the S-acyl moiety contains 18 carbons and 1 double bond. Graph http://purl.obolibrary.org/obo/CHEBI_139574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139575 biolink:ChemicalEntity monounsaturated fatty acyl-CoA Any unsaturated fatty acyl-CoA in which the fatty acyl chain contains one carbon-carbon double bond. pubmed:17277381|pubmed:3382682 Graph monounsaturated fatty acyl-CoAs|monounsaturated fatty acyl-Coenzyme A monounsaturated fatty acyl-CoAs|monounsaturated fatty acyl-Coenzyme A http://purl.obolibrary.org/obo/CHEBI_139575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139576 biolink:ChemicalEntity octadecatrienoyl-CoA An unsaturated fatty acyl-CoA in which the S-acyl moiety contains 18 carbons and 3 double bonds at unknown positions. Graph http://purl.obolibrary.org/obo/CHEBI_139576 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139578 biolink:ChemicalEntity octadecadienoyl-CoA An unsaturated fatty acyl-CoA in which the S-acyl moiety contains 18 carbons and 2 double bonds at unknown positions. Graph octadecadienoyl-Coenzyme A octadecadienoyl-Coenzyme A http://purl.obolibrary.org/obo/CHEBI_139578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139588 biolink:ChemicalEntity alpha-hydroxy ketone A ketone containing a hydroxy group on the α-carbon relative to the C=O group. pubmed:15326516|pubmed:19908854|pubmed:20382022|pubmed:23295224 Graph alpha-hydroxy ketones|alpha-hydroxy-ketone|alpha-hydroxy-ketones|alpha-hydroxyketone|alpha-hydroxyketones alpha-hydroxy ketones|alpha-hydroxy-ketone|alpha-hydroxy-ketones|alpha-hydroxyketone|alpha-hydroxyketones http://purl.obolibrary.org/obo/CHEBI_139588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139589 biolink:ChemicalEntity retinoid anion A carboxylic acid anion obtained by deprotonation of any retinoid carboxy group. Graph retinoate|retinoates|retinoid anions|retinoid carboxylate anion|retinoid carboxylate anions|retinoid carboxylic acid anion|retinoid carboxylic acid anions retinoate|retinoates|retinoid anions|retinoid carboxylate anion|retinoid carboxylate anions|retinoid carboxylic acid anion|retinoid carboxylic acid anions http://purl.obolibrary.org/obo/CHEBI_139589 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139590 biolink:ChemicalEntity primary alpha-hydroxy ketone An α-hydroxy ketone in which the carbonyl group and the hydroxy group are linked by a -CH2 (methylene) group. Graph primary alpha-hydroxy ketones|primary alpha-hydroxy-ketone|primary alpha-hydroxy-ketones|primary alpha-hydroxyketone|primary alpha-hydroxyketones primary alpha-hydroxy ketones|primary alpha-hydroxy-ketone|primary alpha-hydroxy-ketones|primary alpha-hydroxyketone|primary alpha-hydroxyketones http://purl.obolibrary.org/obo/CHEBI_139590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139592 biolink:ChemicalEntity tertiary alpha-hydroxy ketone An α-hydroxy ketone in which the carbonyl group and the hydroxy group are linked by a carbon bearing two organyl groups. Graph tertiary alpha-hydroxy ketones|tertiary alpha-hydroxy-ketone|tertiary alpha-hydroxy-ketones|tertiary alpha-hydroxyketone|tertiary alpha-hydroxyketones tertiary alpha-hydroxy ketones|tertiary alpha-hydroxy-ketone|tertiary alpha-hydroxy-ketones|tertiary alpha-hydroxyketone|tertiary alpha-hydroxyketones http://purl.obolibrary.org/obo/CHEBI_139592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139596 biolink:ChemicalEntity N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminide(1-) A carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of any α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-N-acetyl-α-D-galactosaminide; major species at pH 7.3. Graph an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl derivative an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_139596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139604 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminide Any glycoside derived from β-D-galactosyl-(1→3)-[N-acetyl-β-D-glucosaminyl-(1→6)]-N-acetyl-α-D-galactosamine. Graph a beta-D-galactosyl-(1->3)-(N-acetyl-beta-D-glucosaminyl-(1->6))-N-acetyl-alpha-D-galactosaminyl derivative|beta-D-Gal-(1->3)-[beta-D-GlcNAc-(1->6)]-alpha-D-GalNAc-OR a beta-D-galactosyl-(1->3)-(N-acetyl-beta-D-glucosaminyl-(1->6))-N-acetyl-alpha-D-galactosaminyl derivative|beta-D-Gal-(1->3)-[beta-D-GlcNAc-(1->6)]-alpha-D-GalNAc-OR http://purl.obolibrary.org/obo/CHEBI_139604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139608 biolink:ChemicalEntity sepantronium bromide An organic bromide salt consisting of sepantronium cations and bromide anions. It has been found to selectively inhibit survivin (BIRC5) gene promoter activity and to down-regulate survivin in vitro, so leading to induction of apoptosis. cas:781661-94-7|kegg.drug:D10164|patent:EP2127652|patent:US7618992|pubmed:22787117|pubmed:22806304|pubmed:22842455|pubmed:22892872|pubmed:23138529|pubmed:23325792|pubmed:23740602|pubmed:23857959|pubmed:24297644|pubmed:24432379|pubmed:24518133|pubmed:24993306|pubmed:25033765|pubmed:25296978|pubmed:25533314|pubmed:25659731|pubmed:25955434|pubmed:26023798|pubmed:26090615|pubmed:26547260|pubmed:26857688|pubmed:27151995|pubmed:27271121|pubmed:27754993|pubmed:28618939 Graph 1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide|3-(2-methoxyethyl)-2-methyl-4,9-dioxo-1-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide|YM 155|YM-155|bromure de sepantronium|bromuro de sepantronio|sepantronii bromidum|sepantronium bromide 1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide 1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide|3-(2-methoxyethyl)-2-methyl-4,9-dioxo-1-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide|YM 155|YM-155|bromure de sepantronium|bromuro de sepantronio|sepantronii bromidum|sepantronium bromide http://purl.obolibrary.org/obo/CHEBI_139608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:139609 biolink:ChemicalEntity survivin suppressant An apoptosis inducer that works by selectively inhibiting survivin (BIRC5) gene promoter activity so as to down-regulate survivin, a protein that inhibits apoptosis, so leading to induction of apoptosis. Graph survivin suppressants|survivin suppressor|survivin suppressors survivin suppressants|survivin suppressor|survivin suppressors http://purl.obolibrary.org/obo/CHEBI_139609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:13997 biolink:ChemicalEntity citramalate(2-) A dicarboxylic acid dianion that is obtained by removal of a proton from both of the carboxylic acid groups of citramalic acid. reaxys:3944359 Graph 2-hydroxy-2-methylbutanedioate|2-hydroxy-2-methylsuccinate|2-methylmalate|citramalate 2-hydroxy-2-methylbutanedioate 2-hydroxy-2-methylbutanedioate|2-hydroxy-2-methylsuccinate|2-methylmalate|citramalate http://purl.obolibrary.org/obo/CHEBI_13997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140079 biolink:ChemicalEntity itasetron chemspider:16736654 Graph http://purl.obolibrary.org/obo/CHEBI_140079 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140159 biolink:ChemicalEntity D-hexose phosphate(2-) An organophosphate oxoanion that is the dianion of any mono-phosphorylated D-hexose having a chain of six carbon atoms in the molecule. (Formula C6H11O9P). Graph a D-hexose phosphate a D-hexose phosphate http://purl.obolibrary.org/obo/CHEBI_140159 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140162 biolink:ChemicalEntity beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group An α-D-galactosyl group derived from β-D-Gal-(1→3)-β-D-GlcNAc-(1→3)-α-D-Gal The minimum precursor oligosaccharide sequence required by the ABO blood group system to form antigens. This sequence is for Type 1 chains found in secretions. Graph Type 1 chain|beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-(1->3)-alpha-D-galactosyl group Type 1 chain|beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-(1->3)-alpha-D-galactosyl group http://purl.obolibrary.org/obo/CHEBI_140162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140165 biolink:ChemicalEntity Brassica napus metabolite Any plant metabolite that is produced by rapeseed (Brassica napus). wikipedia.en:Rapeseed Graph Brassica napus metabolites|rapeseed metabolite|rapeseed metabolites Brassica napus metabolites|rapeseed metabolite|rapeseed metabolites http://purl.obolibrary.org/obo/CHEBI_140165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140180 biolink:ChemicalEntity alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group An α-D-galactosyl group derived from α-L-Fuc-(1→2)-β-D-Gal-(1→3)-β-D-GlcNAc-(1→3)-α-D-Gal-yl group. The H (O) antigen formed from a Type 1 precursor chain. pubmed:7691279 Graph 6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|O blood Ag|alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|blood group O antigen alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl 6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|O blood Ag|alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|blood group O antigen http://purl.obolibrary.org/obo/CHEBI_140180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140181 biolink:ChemicalEntity (3R,4R)-4,2'-dihydroxyisoflavans Any member of the class of hydroxyisoflavans that has two hydroxy substituents located at positions 2' and 4 as well as 3R,4R-stereochemistry. Graph a (3R,4R)-4,2'-dihydroxyisoflavan a (3R,4R)-4,2'-dihydroxyisoflavan http://purl.obolibrary.org/obo/CHEBI_140181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140183 biolink:ChemicalEntity (3R)-2'-hydroxyisoflavanones Any member of the class of hydroxyisoflavans that has a hydroxy substituent located at position 2 and 3R-stereochemistry. metacyc.compound:2prime-hydroxyisoflavanones Graph a (3R)-2'-hydroxyisoflavanone a (3R)-2'-hydroxyisoflavanone http://purl.obolibrary.org/obo/CHEBI_140183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140186 biolink:ChemicalEntity alpha-L-Fuc-(1->2)-[alpha-D-GalNAc-(1->3)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group A galactosyl group derived from α-D-GalNAc-(1→3)-[α-L-Fuc-(1→2)]-β-D-Gal-(1→3)-β-D-GlcNAc-(1→3)-α-D-Gal. Antigen A formed in 'secretor' individuals pubmed:7691279 Graph 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|A antigen (secretor)|A blood Ag|N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group|alpha-L-Fucp-(1->2)-[alpha-D-GalpNAc-(1->3)]-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|blood group A antigen 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranosyl|A antigen (secretor)|A blood Ag|N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group|alpha-L-Fucp-(1->2)-[alpha-D-GalpNAc-(1->3)]-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|blood group A antigen http://purl.obolibrary.org/obo/CHEBI_140186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140187 biolink:ChemicalEntity alpha-L-Fuc-(1->2)-[alpha-D-Gal-(1->3)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl group A galactosyl group derived from α-L-Fuc-(1→2)-[α-D-Gal-(1→3)]-β-D-Gal-(1→3)-β-D-GlcNAc-(1→3)-α-D-Gal. B Antigen formed in 'secretor' individuals. pubmed:7691279 Graph B Antigen (secretor)|B blood Ag|alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl|alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|alpha-L-Fucp-(1->2)-[alpha-D-Galp-(1->3)]-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|alpha-L-fucosyl-(1->2)-[alpha-D-galactosyl-(1->3)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl|blood group B antigen B Antigen (secretor)|B blood Ag|alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-alpha-D-Gal-yl|alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl group|alpha-L-Fucp-(1->2)-[alpha-D-Galp-(1->3)]-beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-alpha-D-Galp-yl|alpha-L-fucosyl-(1->2)-[alpha-D-galactosyl-(1->3)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-alpha-D-galactosyl|blood group B antigen http://purl.obolibrary.org/obo/CHEBI_140187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140190 biolink:ChemicalEntity calcium-dependent antibiotics Any antimicrobial agent whose activity is dependent on the presence of calcium ions. pubmed:18489906|pubmed:22711659|pubmed:29108098|pubmed:29434326 Graph Ca(2+)-dependent antibiotic|Ca(2+)-dependent antibiotics|Ca-dependent antibiotic|Ca-dependent antibiotics|calcium-dependent antibiotic Ca(2+)-dependent antibiotic|Ca(2+)-dependent antibiotics|Ca-dependent antibiotic|Ca-dependent antibiotics|calcium-dependent antibiotic http://purl.obolibrary.org/obo/CHEBI_140190 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140192 biolink:ChemicalEntity 17R,(16)-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosahexa-4,7,10,13,15,19-enoic acid pubmed:17055291 Graph (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoic acid|17R,(16)-epoxy-DHA (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoic acid (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoic acid|17R,(16)-epoxy-DHA http://purl.obolibrary.org/obo/CHEBI_140192 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140193 biolink:ChemicalEntity (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid A dihydroxydocosahexaenoic acid that is (4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at the 7S- and 14S-positions. pubmed:19103881|reaxys:21813988 Graph (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoic acid|(7S)-MaR1|(7S)-maresin 1|(7S,14S)-dihydroxydocosahexaenoic acid|7(S),14(S)-dihydroxy-docosahexaenoic acid|7-epi-MaR1|7-epi-maresin 1 (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoic acid|(7S)-MaR1|(7S)-maresin 1|(7S,14S)-dihydroxydocosahexaenoic acid|7(S),14(S)-dihydroxy-docosahexaenoic acid|7-epi-MaR1|7-epi-maresin 1 http://purl.obolibrary.org/obo/CHEBI_140193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140196 biolink:ChemicalEntity (7S,14S)-bis(hydroperoxy)-(4Z,8E,10Z,12E,16Z,19Z)-docosahexaenoic acid A docosanoid that is (4Z,8E,10Z,12E,16Z,19Z)-docosahexaenoic acid carrying two hydroperoxy substituents at the 7S- and 14S-positions. pubmed:19103881 Graph (4Z,7S,8E,10Z,12E,14S,16Z,19Z)-7,14-bis(hydroperoxy)docosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7S,8E,10Z,12E,14S,16Z,19Z)-7,14-bis(hydroperoxy)docosahexaenoic acid|7(S),14(S)-diHpDHA (4Z,7S,8E,10Z,12E,14S,16Z,19Z)-7,14-bis(hydroperoxy)docosa-4,8,10,12,16,19-hexaenoic acid (4Z,7S,8E,10Z,12E,14S,16Z,19Z)-7,14-bis(hydroperoxy)docosa-4,8,10,12,16,19-hexaenoic acid|(4Z,7S,8E,10Z,12E,14S,16Z,19Z)-7,14-bis(hydroperoxy)docosahexaenoic acid|7(S),14(S)-diHpDHA http://purl.obolibrary.org/obo/CHEBI_140196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140200 biolink:ChemicalEntity (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoic acid An epoxydocosapentaenoic acid (7Z,9E,11E,16Z,19Z)-docosapentaenoic acid in which the epoxy group is located at the 13,14-position. An intermediate in the specialised proresolving mediators pubmed:23736886 Graph (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoic acid|13,14-epoxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid|13,14-epoxy-DPAn-3|13,14-epoxydocosapentaenoic acid (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoic acid (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoic acid|13,14-epoxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid|13,14-epoxy-DPAn-3|13,14-epoxydocosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140202 biolink:ChemicalEntity aspirin-triggered protectin D1 A dihydroxydocosahexaenoic acid that is (4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at positions 10 and 17 (the 10R,17R-stereoisomer). pubmed:21867913|pubmed:22542947|pubmed:22566962|pubmed:22690022|pubmed:24262603|pubmed:24520010|pubmed:25139562|pubmed:27121596|reaxys:22110134 Graph (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoic acid|10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|AT-(NPD1/PD1)|AT-NPD1|AT-PD1|aspirin-triggered neuroprotectin D1 (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoic acid|10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|AT-(NPD1/PD1)|AT-NPD1|AT-PD1|aspirin-triggered neuroprotectin D1 http://purl.obolibrary.org/obo/CHEBI_140202 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140204 biolink:ChemicalEntity (4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosahexaenoic acid An oxodocosahexaenoic acid that is (4Z,7Z,10Z,14E,16Z,19Z)-docosahexaenoic acid in which the oxo group is located at position 13. An intermediate of specialised proresolving mediators. pubmed:26339618 Graph (4Z,7Z,10Z,14E,16Z,19Z)-13-ketodocosahexaenoic acid|(4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoic acid|13-oxo-(4Z,7Z,10Z,14E,16Z,19Z)-docosahexaenoic acid|13-oxo-DHA|13-oxodocosahexaenoic acid (4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoic acid (4Z,7Z,10Z,14E,16Z,19Z)-13-ketodocosahexaenoic acid|(4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoic acid|13-oxo-(4Z,7Z,10Z,14E,16Z,19Z)-docosahexaenoic acid|13-oxo-DHA|13-oxodocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_140204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140205 biolink:ChemicalEntity (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid An docosanoid that is (7Z,10Z,14E,16Z,19Z)-docosapentaenoic acid carrying an oxo substituent at position 13. An intermediate of specialised proresolving mediators. pubmed:26339618 Graph (7Z,10Z,14E,16Z,19Z)-13-ketodocosapentaenoic acid|(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoic acid|13-oxo-(7Z,10Z,14E,16Z,19Z)-docosapentaenoic acid|13-oxo-DPAn-3|13-oxo-omega-3-docosapentaenoic acid (7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoic acid (7Z,10Z,14E,16Z,19Z)-13-ketodocosapentaenoic acid|(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoic acid|13-oxo-(7Z,10Z,14E,16Z,19Z)-docosapentaenoic acid|13-oxo-DPAn-3|13-oxo-omega-3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140208 biolink:ChemicalEntity aspirin-triggered protectin D1(1-) A dihydroxydocosahexaenoate that is the conjugate base of aspirin-triggered protectin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate|(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoate|10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoate|AT-(NPD1/PD1)(1-)|AT-NPD1(1-)|AT-PD1(1-)|aspirin-triggered neuroprotectin D1(1-) (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate (4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate|(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoate|10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoate|AT-(NPD1/PD1)(1-)|AT-NPD1(1-)|AT-PD1(1-)|aspirin-triggered neuroprotectin D1(1-) http://purl.obolibrary.org/obo/CHEBI_140208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140218 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosapentaenoic acid A hydroxydocosapentaenoic acid that is (4Z,7Z,10Z,12E,16Z)-docosapentaenoic acid in which the hydroxy group is located at the 14S-position. An intermediate of specialised proresolving mediators Graph (14S)-hydroxy-(4Z,7Z,10Z,12E,16Z)-docosapentaenoic acid|(4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoic acid|14(S)-HDoPEn-6|14(S)-hydroxy-omega-6-docosapentaenoic acid (4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoic acid (14S)-hydroxy-(4Z,7Z,10Z,12E,16Z)-docosapentaenoic acid|(4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoic acid|14(S)-HDoPEn-6|14(S)-hydroxy-omega-6-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140220 biolink:ChemicalEntity (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoic acid A hydroperoxy fatty acid that is (4Z,8E,10Z,12E,16Z,19Z)-docosahexaenoic acid in which the hydroperoxy group is located at position 14S. An intermediate of specialised proresolving mediators pubmed:23736886 Graph (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoic acid|14(S)-HpDHA|14(S)-hydroperoxydocosahexaenoic acid (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoic acid (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoic acid|14(S)-HpDHA|14(S)-hydroperoxydocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_140220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140222 biolink:ChemicalEntity (7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosapentaenoic acid A (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoic acid in which the chiral centre at position 14 has S-configuration. An intermediate of specialised proresolving mediators. pubmed:23736886 Graph (14S)-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid|(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid|14(S)-HPDoPE(n-3)|14(S)-HpDPA(n-3)|14(S)-HpDPAn-3|14(S)-hydroperoxy-omega-3-docosapentaenoic acid (7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid (14S)-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid|(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid|14(S)-HPDoPE(n-3)|14(S)-HpDPA(n-3)|14(S)-HpDPAn-3|14(S)-hydroperoxy-omega-3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140222 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140223 biolink:ChemicalEntity 15-deoxy-Delta(12,14)-prostaglandin J3 A prostaglandin J derivative comprising prostaglandin J3 lacking the 15-hydroxy group and having C=C double bonds at the 12- and 14-positions. An intermediate of specialised proresolving mediators pubmed:21967980|pubmed:23734181|pubmed:26339618|reaxys:29567714 Graph (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,12E,14E,17Z)-11-oxoprosta-5,9,12,14,17-pentaen-1-oic acid|15-deoxy-delta(12,14)-prostaglandin J3|15-deoxyprostaglandin J3|15d-PGJ3 (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,12E,14E,17Z)-11-oxoprosta-5,9,12,14,17-pentaen-1-oic acid|15-deoxy-delta(12,14)-prostaglandin J3|15-deoxyprostaglandin J3|15d-PGJ3 http://purl.obolibrary.org/obo/CHEBI_140223 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140224 biolink:ChemicalEntity (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoic acid A (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoic acid in which the chiral centres at positions 16 and 17 both have S-configuration. An intermediate of specialized proresolving mediators pubmed:23736886|reaxys:31878856 Graph (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosa-7,10,12,14,19-pentaenoic acid|(7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoic acid|16(S),17(S)-epoxy-omega-3-docosapentaenoic acid (7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoic acid (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosa-7,10,12,14,19-pentaenoic acid|(7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoic acid|16(S),17(S)-epoxy-omega-3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140224 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140225 biolink:ChemicalEntity (16S,17S)-epoxy-(4Z,7Z,10Z,12E,14E,19Z)-docosahexaenoic acid An epoxy fatty acid consisting of (4Z,7Z,10Z,12E,14E,19Z)-docosahexaenoic acid having an epoxy group located at the 16,17-position. An intermediate lipid in specialized proresolving mediators. pubmed:26580578|pubmed:26878209|reaxys:29003682 Graph (16S,17S)-epoxydocosahexaenoic acid|(16S,17S)-epoxyprotectin|(4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoic acid (4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoic acid (16S,17S)-epoxydocosahexaenoic acid|(16S,17S)-epoxyprotectin|(4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140226 biolink:ChemicalEntity (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosapentaenoic acid A (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoic acid in which the chiral centre at position 17 has S-configuration. An intermediate of specialised proresolving mediators. pubmed:23736886 Graph (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid|17(S)-Hp-DPA(n-3)|17(S)-HpDoPE(n-3)|17(S)-hydroperoxy-omega-3-docosapentaenoic acid (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid|17(S)-Hp-DPA(n-3)|17(S)-HpDoPE(n-3)|17(S)-hydroperoxy-omega-3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140234 biolink:ChemicalEntity 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid A docosanoid that is (9E,11E,13Z,15E,19Z)-docosapentaenoic acid carrying an epoxy group across positions 7 and 8 as well as a hydroxy substituent at position 17. An intermediate of specialised proresolving mediators. pubmed:23736886 Graph (9E,11E,13Z,15E,19Z)-7,8-epoxy,17-hydroxydocosapentaenoic acid|6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoic acid|7,8-epoxy,17-HDPA(n-3)|7,8-epoxy,17-hydroxy-omega-3-docosapentaenoic acid 6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoic acid (9E,11E,13Z,15E,19Z)-7,8-epoxy,17-hydroxydocosapentaenoic acid|6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoic acid|7,8-epoxy,17-HDPA(n-3)|7,8-epoxy,17-hydroxy-omega-3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140235 biolink:ChemicalEntity (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate A docosanoid anion that is the conjugate base of (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoate|13,14-epoxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoate (7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoate|13,14-epoxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140236 biolink:ChemicalEntity (4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosahexaenoate An oxodocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10Z,14E,16Z,19Z)-13-ketodocosahexaenoate|(4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoate|13-oxo-(4Z,7Z,10Z,14E,16Z,19Z)-docosahexaenoate|13-oxo-DHA(1-) (4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoate (4Z,7Z,10Z,14E,16Z,19Z)-13-ketodocosahexaenoate|(4Z,7Z,10Z,14E,16Z,19Z)-13-oxodocosa-4,7,10,14,16,19-hexaenoate|13-oxo-(4Z,7Z,10Z,14E,16Z,19Z)-docosahexaenoate|13-oxo-DHA(1-) http://purl.obolibrary.org/obo/CHEBI_140236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140237 biolink:ChemicalEntity (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoate A docosanoid anion that is the conjugate base of (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,10Z,14E,16Z,19Z)-13-ketodocosapentaenoate|(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoate|13-oxo-(7Z,10Z,14E,16Z,19Z)-docosapentaenoate|13-oxo-DPAn-3(1-)|13-oxo-omega-3-docosapentaenoate (7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoate (7Z,10Z,14E,16Z,19Z)-13-ketodocosapentaenoate|(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoate|13-oxo-(7Z,10Z,14E,16Z,19Z)-docosapentaenoate|13-oxo-DPAn-3(1-)|13-oxo-omega-3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140238 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosahexaenoic acid An oxodocosahexaenoic acid that is (4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid in which the oxo group is located at position 17. An intermediate of specialised proresolving mediators. pubmed:24594225|pubmed:26339618|pubmed:27337155|pubmed:27883019|pubmed:29435611|reaxys:26960428 Graph (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoic acid|17-oxo-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid|17-oxo-DHA|17-oxodocosahexaenoic acid (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoic acid (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoic acid|17-oxo-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoic acid|17-oxo-DHA|17-oxodocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_140238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140239 biolink:ChemicalEntity (7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoic acid A docosanoid that is (7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid carrying an oxo substituent at position 17. An intermediate of specialised proresolving mediators. pubmed:24736647|pubmed:26339618|reaxys:24889878 Graph (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoic acid|17-oxo-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid|17-oxo-DPA|17-oxo-DPA(n-3)|17-oxo-omega3-docosapentaenoic acid (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoic acid (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoic acid|17-oxo-(7Z,10Z,13Z,15E,19Z)-docosapentaenoic acid|17-oxo-DPA|17-oxo-DPA(n-3)|17-oxo-omega3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140243 biolink:ChemicalEntity 22-hydroxyprotectin D1 A docosanoid that is protectin D1 in which one of the terminal methyl hydrogens has been replaced by a hydroxy group. An intermediate of specialised proresolving mediators pubmed:25247845|reaxys:27632053 Graph (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosahexaenoic acid|10(R),17(S),20-trihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|22-OH-PD1|22-hydroxy-(neuro)protectin D1|22-hydroxyneuroprotectin D1 (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoic acid (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoic acid|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosahexaenoic acid|10(R),17(S),20-trihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid|22-OH-PD1|22-hydroxy-(neuro)protectin D1|22-hydroxyneuroprotectin D1 http://purl.obolibrary.org/obo/CHEBI_140243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140244 biolink:ChemicalEntity (6E,8Z,11Z,14Z,17Z)-5-oxoicosapentaenoic acid An icosanoid that is (6E,8Z,11Z,14Z,17Z)-icosapentaenoic acid carrying an oxo substituent at position 5. An intermediate of specialised proresolving mediators. pubmed:24736647|pubmed:26339618|pubmed:8847485|reaxys:15801996 Graph (6E,8Z,11Z,14Z,17Z)-5-oxoeicosapentaenoic acid|(6E,8Z,11Z,14Z,17Z)-5-oxoicosa-6,8,11,14,17-pentaenoic acid|5-oxo-(6E,8Z,11Z,14Z,17Z)-eicosapentaenoic acid|5-oxo-(6E,8Z,11Z,14Z,17Z)-icosapentaenoic acid|5-oxo-EPA|5-oxo-EPE|5-oxoeicosapentaenoic acid|5-oxoicosapentaenoic acid (6E,8Z,11Z,14Z,17Z)-5-oxoicosa-6,8,11,14,17-pentaenoic acid (6E,8Z,11Z,14Z,17Z)-5-oxoeicosapentaenoic acid|(6E,8Z,11Z,14Z,17Z)-5-oxoicosa-6,8,11,14,17-pentaenoic acid|5-oxo-(6E,8Z,11Z,14Z,17Z)-eicosapentaenoic acid|5-oxo-(6E,8Z,11Z,14Z,17Z)-icosapentaenoic acid|5-oxo-EPA|5-oxo-EPE|5-oxoeicosapentaenoic acid|5-oxoicosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140245 biolink:ChemicalEntity (7S,17S)-bis(hydroperoxy)-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid A docosanoid that is (4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid carrying two hydroperoxy substituents at the 7S- and 17S-positions. pubmed:23471029 Graph (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosa-4,8,10,13,15,19-hexaenoic acid|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosahexaenoic acid|7(S),17(S)-diHpDHA|7(S),17(S)-dihydroperoxydocosahexaenoic acid|7S,17S-diH(P)DHA (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosa-4,8,10,13,15,19-hexaenoic acid (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosa-4,8,10,13,15,19-hexaenoic acid|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosahexaenoic acid|7(S),17(S)-diHpDHA|7(S),17(S)-dihydroperoxydocosahexaenoic acid|7S,17S-diH(P)DHA http://purl.obolibrary.org/obo/CHEBI_140245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140248 biolink:ChemicalEntity (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosapentaenoic acid A hydroperoxydocosapentaenoic acid that is (8E,10Z,13Z,15E,19Z)-docosapentaenooic acid carrying two hydroperoxy substituents at positions 7 and 17. An intermediate of specialised proresolving mediators. pubmed:23736886 Graph (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoic acid|7,17-DHpDPE(n-3)|7,17-bis(hydroperoxy)-(8E,10Z,13Z,15E,19Z)-docosapentaenoic acid|7,17-diHp-DPAn-3|7,17-diHpDPA(n-3)|7,17-dihydroperoxy-omega3-docosapentaenoic acid (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoic acid (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoic acid|7,17-DHpDPE(n-3)|7,17-bis(hydroperoxy)-(8E,10Z,13Z,15E,19Z)-docosapentaenoic acid|7,17-diHp-DPAn-3|7,17-diHpDPA(n-3)|7,17-dihydroperoxy-omega3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140250 biolink:ChemicalEntity (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosapentaenoic acid A hydroxydocosapentaenoic acid that consists of (8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid carrying a hydroxy substituent at position 7. An intermediate of specialised proresolving mediators. pubmed:21807091|pubmed:26339618|reaxys:25832718 Graph (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoic acid|7-HDPA(n-3)|7-HDPAn-3|7-HDoPE(n-3)|7-hydroxy-(8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid|7-hydroxy-omega3-docosapentaenoic acid (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoic acid (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoic acid|7-HDPA(n-3)|7-HDPAn-3|7-HDoPE(n-3)|7-hydroxy-(8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid|7-hydroxy-omega3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140251 biolink:ChemicalEntity (4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosapentaenoate A hydroxydocosapentaenoate that is the conjugate base of (4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosapentaenoic acid, arising from deprotonation of the carboxy group; major species at pH 7.3. Graph (14S)-hydroxy-(4Z,7Z,10Z,12E,16Z)-docosapentaenoate|(4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoate|14(S)-HDPAn-6(1-)|14(S)-HDoPEn-6(1-)|14(S)-hydroxy-omega-6-docosapentaenoate (4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoate (14S)-hydroxy-(4Z,7Z,10Z,12E,16Z)-docosapentaenoate|(4Z,7Z,10Z,12E,14S,16Z)-14-hydroxydocosa-4,7,10,12,16-pentaenoate|14(S)-HDPAn-6(1-)|14(S)-HDoPEn-6(1-)|14(S)-hydroxy-omega-6-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140252 biolink:ChemicalEntity (4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosahexaenoic acid A oxodocosahexaenoic acid that consists of (4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoic acid carrying an oxo substituent at position 7. An intermediate of specialised proresolving mediators. pubmed:26339618|reaxys:27937080 Graph (4Z,8E,10Z,13Z,16Z,19Z)-7-ketodocosahexaenoic acid|(4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoic acid|7-oxo-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoic acid|7-oxo-DHA|7-oxodocosahexaenoic acid (4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoic acid (4Z,8E,10Z,13Z,16Z,19Z)-7-ketodocosahexaenoic acid|(4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoic acid|7-oxo-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoic acid|7-oxo-DHA|7-oxodocosahexaenoic acid http://purl.obolibrary.org/obo/CHEBI_140252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140253 biolink:ChemicalEntity (8E,10Z,13Z,16Z,19Z)-7-oxodocosapentaenoic acid A docosanoid that consists of (8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid carrying an oxo substituent at position 7. An intermediate of specialised proresolving mediators. pubmed:26339618 Graph (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoic acid|7-oxo-(8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid|7-oxo-DPA(n-3)|7-oxo-DPAn-3|7-oxo-omega3-docosapentaenoic acid (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoic acid (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoic acid|7-oxo-(8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid|7-oxo-DPA(n-3)|7-oxo-DPAn-3|7-oxo-omega3-docosapentaenoic acid http://purl.obolibrary.org/obo/CHEBI_140253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140256 biolink:ChemicalEntity (7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoic acid A docosanoid that is (8E,10E,12Z,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 7R and 14S. An intermediate of specialised proresolving mediators. pubmed:23736886|pubmed:24262603|pubmed:25225129|pubmed:28408222 Graph (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoic acid|(7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosapentaenoic acid|7(R),14(S)-dihydroxy-omega3-docosapentaenoic acid|MaR1n-3 DPA (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoic acid (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoic acid|(7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosapentaenoic acid|7(R),14(S)-dihydroxy-omega3-docosapentaenoic acid|MaR1n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140257 biolink:ChemicalEntity 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid A docosanoid that is (7Z,9E,11E,16Z,19Z )-docosapentaenoic acid carrying two hydroxy substituents at positions 13 and 14. An intermediate of specialised proresolving mediators. pubmed:23736886|pubmed:28408222 Graph (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoic acid|(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosapentaenoic acid|13,14(S)-dihydroxy-omega3-docosapentaenoic acid|MaR2n-3 DPA (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoic acid (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoic acid|(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosapentaenoic acid|13,14(S)-dihydroxy-omega3-docosapentaenoic acid|MaR2n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140258 biolink:ChemicalEntity 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid A docosanoid that is (7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 14S and 21. An intermediate of specialised proresolving mediators. pubmed:23736886|pubmed:28408222 Graph (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoic acid|(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosapentaenoic acid|14(S),21-dihydroxy-omega3-docosapentaenoic acid|MaR3n-3 DPA (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoic acid (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoic acid|(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosapentaenoic acid|14(S),21-dihydroxy-omega3-docosapentaenoic acid|MaR3n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140260 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoate A hydroxydocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid, arising from deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoate|17-HDHA(1-)|17-HDoHE(1-) (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoate (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoate|17-HDHA(1-)|17-HDoHE(1-) http://purl.obolibrary.org/obo/CHEBI_140260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140262 biolink:ChemicalEntity 16(S)-glutathionyl-17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid A docosanoid that is 17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid in which a glutathionyl group is attached at position 16S via a sulfide linkage. An intermediate of specialised proresolving mediators. pubmed:25713027 Graph 16-glutathionyl-17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoic acid|L-gamma-glutamyl-S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine|PCTR1|protectin conjugate in tissue regeneration 1 L-gamma-glutamyl-S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine 16-glutathionyl-17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoic acid|L-gamma-glutamyl-S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine|PCTR1|protectin conjugate in tissue regeneration 1 http://purl.obolibrary.org/obo/CHEBI_140262 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140263 biolink:ChemicalEntity 16(S)-glycinylcystein-S-yl-17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid A docosanoid that is 17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid in which a cysteinylglycinyl group is attached at position 16S via a sulfide linkage. An intermediate of specialized proresolving mediators pubmed:25713027 Graph 16-cysteinylglycinyl,17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoic acid|PCTR2|S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine|protectin conjugate in tissue regeneration 2 S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine 16-cysteinylglycinyl,17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoic acid|PCTR2|S-[(3Z,6R,7S,15Z,18Z)-21-carboxy-6-hydroxyhenicosa-3,8,10,12,15,18-hexaen-7-yl]-L-cysteinylglycine|protectin conjugate in tissue regeneration 2 http://purl.obolibrary.org/obo/CHEBI_140263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140264 biolink:ChemicalEntity 16(S)-cystein-S-yl,17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid A docosanoid that is 17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid in which a glycinyl group is attached at position 16S via a sulfide linkage. An intermediate of specialised proresolving mediators pubmed:25713027 Graph (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoic acid|16-cysteinyl,17-hydroxy-4Z,7Z,16S,17R,19Z-docosahexaenoic acid|PCTR3|protectin conjugate in tissue regeneration 3 (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoic acid (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoic acid|16-cysteinyl,17-hydroxy-4Z,7Z,16S,17R,19Z-docosahexaenoic acid|PCTR3|protectin conjugate in tissue regeneration 3 http://purl.obolibrary.org/obo/CHEBI_140264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140265 biolink:ChemicalEntity (10R,17S)-dihydroxy-(7Z,11E,13E,15Z,19Z)-docosapentaenoic acid A dihydroxydocosapentaenoic acid (DiHDPE) that is (7Z,11E,13E,15Z,19Z)-docosapentaenoic acid in which the hydrogens at the 10 pro-R and 17 pro-S positions have been replaced by hydroxy groups. It is an intermediate of specialized proresolving mediators. pubmed:23736886|pubmed:24576195|pubmed:28356517|pubmed:28408222|pubmed:28602942|reaxys:27066730 Graph (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoic acid|(7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosapentaenoic acid|(PD)1n-3 DPA|10(R),17(S)-dihydroxy-omega3-docosapentaenoic acid|PD1n-3 DPA|protectin D1n-3 DPA (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoic acid (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoic acid|(7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosapentaenoic acid|(PD)1n-3 DPA|10(R),17(S)-dihydroxy-omega3-docosapentaenoic acid|PD1n-3 DPA|protectin D1n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140266 biolink:ChemicalEntity 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid A dihydroxydocosapentaenoic acid (DiHDPE) that is (7Z,10Z,13E,14E,19Z)-docosapentaenoic acid carrying two hydroxy substituents at the 16 and 17-S positions. It is an intermediate of specialised proresolving mediators. pubmed:23736886|pubmed:28408222|reaxys:31878852 Graph (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoic acid|(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosapentaenoic acid|(PD)2n-3 DPA|16,17(S)-dihydroxy-7Z,10Z,13E,14E,19Z-docosapentaenoic acid|16,17(S)-dihydroxy-omega3-docosapentaenoic acid|PD2n-3 DPA|protectin D2n-3 DPA (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoic acid (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoic acid|(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosapentaenoic acid|(PD)2n-3 DPA|16,17(S)-dihydroxy-7Z,10Z,13E,14E,19Z-docosapentaenoic acid|16,17(S)-dihydroxy-omega3-docosapentaenoic acid|PD2n-3 DPA|protectin D2n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140267 biolink:ChemicalEntity prostaglandin J3 A member of the class of prostaglandins J that is (5Z,9Z,13E,17Z)-prostatetraenoic acid carrying hydroxy and oxo substituents at positions 11 and 15 respectively. An intermediate of specialised proresolving mediators lipidmaps:LMFA03010180|pubmed:22442337|pubmed:26339618 Graph (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,9Z,13E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoic acid|15S-hydroxy-11-oxo-5Z,9Z,13E,17Z-prostatetraenoic acid|PGJ3 (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,9Z,13E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoic acid|15S-hydroxy-11-oxo-5Z,9Z,13E,17Z-prostatetraenoic acid|PGJ3 http://purl.obolibrary.org/obo/CHEBI_140267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140268 biolink:ChemicalEntity (8S)-glutathionyl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid A docosanoid that is (7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid in which a glutathionyl group is attached at position 8S via a sulfide linkage. An intermediate of specialised proresolving mediators. pubmed:25713027 Graph 8-glutathionyl-7,17-dihydroxydocosahexaenoic acid|L-gamma-glutamyl-S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine|RCTR1|resolvin conjugate in tissue regeneration 1 L-gamma-glutamyl-S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine 8-glutathionyl-7,17-dihydroxydocosahexaenoic acid|L-gamma-glutamyl-S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine|RCTR1|resolvin conjugate in tissue regeneration 1 http://purl.obolibrary.org/obo/CHEBI_140268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140269 biolink:ChemicalEntity (8S)-glycinylcystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid A docosanoid that is (7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid in which a cysteinylglycinyl group is attached at position 8S via a sulfide linkage. An intermediate of specialised proresolving mediators. Graph 8-cysteinylglycinyl-7,17-dihydroxydocosahexaenoic acid|RCTR2|S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine|resolvin conjugate in tissue regeneration 2 S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine 8-cysteinylglycinyl-7,17-dihydroxydocosahexaenoic acid|RCTR2|S-[(3Z,6R,7S,12Z,14E,16S,18Z)-1-carboxy-6,16-dihydroxyhenicosa-3,8,10,12,14,18-hexaen-7-yl]-L-cysteinylglycine|resolvin conjugate in tissue regeneration 2 http://purl.obolibrary.org/obo/CHEBI_140269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14027 biolink:ChemicalEntity corydaline beilstein:96972|cas:518-69-4|kegg.compound:C15530|knapsack:C00026115 Graph (+)-Corydaline|(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline|2,3,9,10-tetramethoxy-13beta-methyl-13abeta-berbine|corydaline 2,3,9,10-tetramethoxy-13beta-methyl-13abeta-berbine (+)-Corydaline|(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline|2,3,9,10-tetramethoxy-13beta-methyl-13abeta-berbine|corydaline http://purl.obolibrary.org/obo/CHEBI_14027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140270 biolink:ChemicalEntity (8S)-cystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid A docosanoid that is (7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid in which a cysteinyl group is attached at position 8S via a sulfide linkage. An intermediate of specialised proresolving mediators. pubmed:25713027 Graph (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoic acid|8-cysteinyl-7,17-dihydroxydocosahexaenoic acid|RCTR3|resolvin conjugate in tissue regeneration 3 (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoic acid (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoic acid|8-cysteinyl-7,17-dihydroxydocosahexaenoic acid|RCTR3|resolvin conjugate in tissue regeneration 3 http://purl.obolibrary.org/obo/CHEBI_140270 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140271 biolink:ChemicalEntity (7S,8,17S)-trihydroxy-(15E,19Z)-docosa-9,11,13,15,19-pentaenoic acid A docosanoid that is (15E,19Z)-docosa-9,11,13,15,19-pentaenoic acid carrying three hydroxy substituents at positions 7S, 8 and 17S. An intermediate of specialised proresolving mediators pubmed:23736886|pubmed:28356517|pubmed:28408222|pubmed:28887458 Graph (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoic acid|(7S,8,17S)-trihydroxy-(9,11,13,15E,19Z)-docosapentaenoic acid|7,8,17-trihydroxy-omega3-docosapentaenoic acid|RvD1n-3 DPA|resolvin D1n-3 DPA (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoic acid (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoic acid|(7S,8,17S)-trihydroxy-(9,11,13,15E,19Z)-docosapentaenoic acid|7,8,17-trihydroxy-omega3-docosapentaenoic acid|RvD1n-3 DPA|resolvin D1n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140272 biolink:ChemicalEntity 7,16,17-trihydroxy-(14E,19Z)-docosa-8,10,12,14,19-pentaenoic acid A docosanoid that is (14E,19Z)-docosa-8,10,12,14,19-pentaenoic acid carrying three hydroxy substituents at positions 7, 16 and 17. An intermediate of specialised proresolving mediators pubmed:23736886|pubmed:28356517|pubmed:28408222 Graph (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoic acid|7,16,17-trihydroxy-(8,10,12,14E,19Z)-docosapentaenoic acid|7,16,17-trihydroxy-omega3-docosapentaenoic acid|RvD2n-3 DPA|resolvin D2n-3 DPA (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoic acid (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoic acid|7,16,17-trihydroxy-(8,10,12,14E,19Z)-docosapentaenoic acid|7,16,17-trihydroxy-omega3-docosapentaenoic acid|RvD2n-3 DPA|resolvin D2n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140273 biolink:ChemicalEntity 7,17-dihydroxy-(8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoic acid A dihydroxydocosapentaenoic acid (DiHDPE) that is (8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoic acid carrying two hydroxy substituents at positions 7 and 17. An intermediate of specialized proresolving mediators pubmed:23736886|pubmed:28408222 Graph (8Z,15E,19Z)-7,17-dihydroxydocosa-8,10,13,15,19-pentaenoic acid|7,17-dihydroxy-(8Z,10,13,15E,19Z)-docosapentaenoic acid|7,17-dihydroxy-omega3-docosapentaenoic acid|RvD5n-3 DPA|resolvin D5n-3 DPA (8Z,15E,19Z)-7,17-dihydroxydocosa-8,10,13,15,19-pentaenoic acid (8Z,15E,19Z)-7,17-dihydroxydocosa-8,10,13,15,19-pentaenoic acid|7,17-dihydroxy-(8Z,10,13,15E,19Z)-docosapentaenoic acid|7,17-dihydroxy-omega3-docosapentaenoic acid|RvD5n-3 DPA|resolvin D5n-3 DPA http://purl.obolibrary.org/obo/CHEBI_140273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140274 biolink:ChemicalEntity Delta(12)-prostaglandin J3 A member of the class of prostaglandins J that is (5Z,9Z,12E,17Z)-prostatetraenoic acid carrying hydroxy and oxo substituents at positions 11 and 15 respectively. An intermediate of specialised proresolving mediators and potent anti-leukemic agent. pubmed:21967980|pubmed:22194393|pubmed:22442337|pubmed:24312486|pubmed:25098181|pubmed:26290393|pubmed:26339618|pubmed:27187634|reaxys:29567731 Graph (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,9Z,12E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoic acid|Delta(12)-prostaglandin J3|delta(12)-PGJ3|delta(12)-prostaglandin J3|delta-12-PGJ3 (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid|(5Z,9Z,12E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoic acid|Delta(12)-prostaglandin J3|delta(12)-PGJ3|delta(12)-prostaglandin J3|delta-12-PGJ3 http://purl.obolibrary.org/obo/CHEBI_140274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140275 biolink:ChemicalEntity 2alpha,3alpha-dihydroxy-ent-isokaurene An ent-kaurane diterpenoid in which the ent-kaurane skeleton has a double bond at C-15 and carries two α-configured hydroxy groups at C-2 and C-3. metacyc.compound:CPD-20322|pubmed:21985968|pubmed:25758958 Graph ent-isokaurene-2beta,3beta-diol ent-isokaurene-2beta,3beta-diol http://purl.obolibrary.org/obo/CHEBI_140275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140277 biolink:ChemicalEntity 5-hydroxyanthocyanidin Any anthocyanidin cation that carries a hydroxy substituent at position 5. Graph 5-hydroxyanthocyanidin cation|5-hydroxyanthocyanidin cations|a 5-hydroxy anthocyanidin 5-hydroxyanthocyanidin cation|5-hydroxyanthocyanidin cations|a 5-hydroxy anthocyanidin http://purl.obolibrary.org/obo/CHEBI_140277 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140278 biolink:ChemicalEntity 5-hydroxyanthocyanin O-beta-D-glucoside An anthocyanin cation that is any 5-hydroxyanthocyanidin in which the phenolic hydrogen has been replaced by a β-D-glucosyl residue. Graph 5-hydroxyanthocyanin O-beta-D-glucosides|5-hydroxyanthocyanin beta-D-glucoside|5-hydroxyanthocyanin beta-D-glucosides|an anthocyanin 5-O-beta-D-glucoside 5-hydroxyanthocyanin O-beta-D-glucosides|5-hydroxyanthocyanin beta-D-glucoside|5-hydroxyanthocyanin beta-D-glucosides|an anthocyanin 5-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_140278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140279 biolink:ChemicalEntity (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate A docosanoid anion that is the conjugate base of (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoate|14(S)-HpDHA(1-) (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoate (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoate|14(S)-HpDHA(1-) http://purl.obolibrary.org/obo/CHEBI_140279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140283 biolink:ChemicalEntity 15-deoxy-Delta(12,14)-prostaglandin J3(1-) A prostaglandin carboxylic acid anion that is the conjugate base of 15-deoxy-Δ12,14-prostaglandin J3. obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,12E,14E,17Z)-11-oxoprosta-5,9,12,14,17-pentaen-1-oate|15-deoxy-delta(12,14)-prostaglandin J3(1-)|15-deoxyprostaglandin J3(1-)|15d-PGJ3(1-) (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate (5Z)-7-{(1S,5E)-5-[(2E,5Z)-octa-2,5-dien-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,12E,14E,17Z)-11-oxoprosta-5,9,12,14,17-pentaen-1-oate|15-deoxy-delta(12,14)-prostaglandin J3(1-)|15-deoxyprostaglandin J3(1-)|15d-PGJ3(1-) http://purl.obolibrary.org/obo/CHEBI_140283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140284 biolink:ChemicalEntity deoxyribonucleotide(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH group of any deoxyribonucleotide residue; major species at pH 7.3. Graph a deoxyribonucleotide residue a deoxyribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_140284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140285 biolink:ChemicalEntity prostaglandin J3(1-) A prostaglandin carboxylic acid anion that is the conjugate base of prostaglandin J3. obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,9Z,13E,15S,17Z)-hydroxy-11-oxoprostatetraenoate|PGJ3(1-) (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoate (5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,9Z,13E,15S,17Z)-hydroxy-11-oxoprostatetraenoate|PGJ3(1-) http://purl.obolibrary.org/obo/CHEBI_140285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140288 biolink:ChemicalEntity Delta(12)-prostaglandin J3(1-) A prostaglandin carboxylic acid anion that is the conjugate base of Δ12-prostaglandin J3. obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,9Z,12E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoate|Delta(12)-prostaglandin J3(1-)|delta(12)-PGJ3(1-)|delta(12)-prostaglandin J3(1-)|delta-12-PGJ3(1-) (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate (5Z)-7-{(1S,5E)-5-[(3S,5Z)-3-hydroxyoct-5-en-1-ylidene]-4-oxocyclopent-2-en-1-yl}hept-5-enoate|(5Z,9Z,12E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoate|Delta(12)-prostaglandin J3(1-)|delta(12)-PGJ3(1-)|delta(12)-prostaglandin J3(1-)|delta-12-PGJ3(1-) http://purl.obolibrary.org/obo/CHEBI_140288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140289 biolink:ChemicalEntity (7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosapentaenoate A (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoate in which the chiral centre at position 14 has S-configuration. Graph (14S)-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate|(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate|14(S)-HPDoPE(n-3)(1-)|14(S)-HpDPA(n-3)(1-)|14(S)-hydroperoxy-omega-3-docosapentaenoate (7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate (14S)-hydroperoxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate|(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoate|14(S)-HPDoPE(n-3)(1-)|14(S)-HpDPA(n-3)(1-)|14(S)-hydroperoxy-omega-3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140290 biolink:ChemicalEntity (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoate A (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoate in which the chiral centres at positions 16 and 17 both have S-configuration. An intermediate of specialised proresolving mediators Graph (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosa-7,10,12,14,19-pentaenoate|(7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoate|16(S),17(S)-epoxy-DPA(n-3)(1-)|16(S),17(S)-epoxy-omega-3-docosapentaenoate (7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoate (16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosa-7,10,12,14,19-pentaenoate|(7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-7,10,12,14-tetraenoate|16(S),17(S)-epoxy-DPA(n-3)(1-)|16(S),17(S)-epoxy-omega-3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140291 biolink:ChemicalEntity (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosapentaenoate A (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoate in which the chiral centre at position 17 has S-configuration. An intermediate of specialised proresolving mediators. Graph (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate|17(S)-HpDPA(n-3)(1-)|17(S)-HpDoPE(n-3)(1-)|17(S)-hydroperoxy-omega-3-docosapentaenoate (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate (7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoate|17(S)-HpDPA(n-3)(1-)|17(S)-HpDoPE(n-3)(1-)|17(S)-hydroperoxy-omega-3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140293 biolink:ChemicalEntity 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of 7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (9E,11E,13Z,15E,19Z)-7,8-epoxy,17-hydroxydocosapentaenate|6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoate|7,8-epoxy,17-HDPA(n-3)(1-)|7,8-epoxy,17-hydroxy-omega-3-docosapentaenoate 6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoate (9E,11E,13Z,15E,19Z)-7,8-epoxy,17-hydroxydocosapentaenate|6-{3-[(1E,3E,5Z,7E,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hexanoate|7,8-epoxy,17-HDPA(n-3)(1-)|7,8-epoxy,17-hydroxy-omega-3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140293 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140296 biolink:ChemicalEntity quinaprilat A dicarboxylic acid resulting from the hydrolysis of the ethyl ester group of quinapril to give the corresponding dicarboxylic acid. The active angiotensin-converting enzyme inhibitor (ACE inhibitor) of the prodrug quinapril. cas:82768-85-2|chemspider:97106|hmdb:HMDB0042005|kegg.compound:C21540|kegg.drug:D03773|pubmed:11300367|pubmed:11422007|pubmed:11824807|pubmed:12698173|pubmed:12808303|pubmed:15223904|pubmed:19016233|pubmed:19135197|pubmed:19761414|pubmed:21083190|pubmed:24175935|pubmed:9336392|reaxys:5653070|wikipedia.en:Quinaprilat Graph (3S)-2-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid|CI 928|CI-928|CI928|CL-928|quinaprilat|quinaprilate|quinaprilatum (3S)-2-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (3S)-2-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid|CI 928|CI-928|CI928|CL-928|quinaprilat|quinaprilate|quinaprilatum http://purl.obolibrary.org/obo/CHEBI_140296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14030 biolink:ChemicalEntity crepenynate A long-chain fatty acid anion and the conjugate base of crepenynic acid, arising from deprotonation of the carboxylic acid group. kegg.compound:C07289 Graph (9Z)-Octadec-9-en-12-ynoate|(9Z)-octadec-9-en-12-ynoate|(Z)-9-octadecen-12-ynoate|Crepenynate|cis-9-octadecen-12-ynoate|crepenynate (9Z)-octadec-9-en-12-ynoate (9Z)-Octadec-9-en-12-ynoate|(9Z)-octadec-9-en-12-ynoate|(Z)-9-octadecen-12-ynoate|Crepenynate|cis-9-octadecen-12-ynoate|crepenynate http://purl.obolibrary.org/obo/CHEBI_14030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140301 biolink:ChemicalEntity 7-hydroxyisoflavones 7-O-beta-D-glucoside A glycosyloxyisoflavone that is any 7-hydroxyisoflavone compound in which the 7-hydroxy group has been converted into its corresponding O-β-D-glucoside. Graph a 7-hydroxyisoflavone 7-O-beta-D-glucoside a 7-hydroxyisoflavone 7-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_140301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140302 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucoside Any β-D-glucoside derived from β-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucose metacyc.compound:D-GALACTOSYL-13-BETA-D-GALACTOSYL-14-B Graph a beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-OR a beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-OR http://purl.obolibrary.org/obo/CHEBI_140302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140303 biolink:ChemicalEntity beta-D-galactosyl-(1->4)-beta-D-glucoside Any glycoside derived from β-D-galactosyl-(1→4)-β-D-glucose. metacyc.compound:beta-Gal-14-beta-Glc-R Graph a beta-D-galactosyl-(1->4)-beta-D-glucosyl derivative|beta-D-Gal-(1->4)-beta-D-Glc-OR a beta-D-galactosyl-(1->4)-beta-D-glucosyl derivative|beta-D-Gal-(1->4)-beta-D-Glc-OR http://purl.obolibrary.org/obo/CHEBI_140303 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140304 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminide Any glycoside derived from β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-β-D-glucosamine metacyc.compound:Lewis-a-epitope Graph a beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-beta-D-GlcNAc-OR a beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl derivative|beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-beta-D-GlcNAc-OR http://purl.obolibrary.org/obo/CHEBI_140304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140305 biolink:ChemicalEntity genistein 7-O-beta-D-glucoside(1-) A flavonoid oxoanion obtained by deprotonation of the 5-hydroxy group of genistein 7-O-β-D-glucoside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Graph 7-(beta-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-5-olate|genistein 7-O-beta-D-glucoside|genistein 7-beta-D-glucoside(1-)|genistein 7-beta-glucoside(1-) 7-(beta-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-5-olate 7-(beta-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-5-olate|genistein 7-O-beta-D-glucoside|genistein 7-beta-D-glucoside(1-)|genistein 7-beta-glucoside(1-) http://purl.obolibrary.org/obo/CHEBI_140305 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140308 biolink:ChemicalEntity alpha-N-acetylneuraminyl-(2->3)-beta-D-galactoside(1-) An N-acetylneuraminate that is the conjugate base of any α-N-acetylneuraminyl-(2→3)-β-D-galactoside, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph alpha-Neu5Ac-(2->3)-beta-D-Gal-OR(1-)|an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl derivative alpha-Neu5Ac-(2->3)-beta-D-Gal-OR(1-)|an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_140308 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140309 biolink:ChemicalEntity alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactoside(2-) An N-acetylneuraminate obtained by deprotonation of the carboxy groups of any α-N-acetylneuraminyl-(2→8)-α-N-acetylneuraminyl-(2→3)-β-D-galactoside; major species at pH 7.3. metacyc.compound:ALPHA-N-ACETYLNEURAMINYL-28-ETCETERA Graph alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-OR(2-)|an N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl derivative alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-OR(2-)|an N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_140309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140310 biolink:ChemicalEntity phenyl acetates An acetate ester obtained by formal condensation of the carboxy group of acetic acid with the hydroxy group of any phenol. metacyc.compound:Phenyl-Acetates Graph a phenyl acetate|phenyl acetate derivative|phenyl acetate derivatives a phenyl acetate|phenyl acetate derivative|phenyl acetate derivatives http://purl.obolibrary.org/obo/CHEBI_140310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140311 biolink:ChemicalEntity FMNH(.)(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of FMNH•. Major microspecies at pH 7.3 Graph FMNH(.) FMNH(.) http://purl.obolibrary.org/obo/CHEBI_140311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140312 biolink:ChemicalEntity [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-N-(beta-D-Asp)-L-Lys-D-Ala-D-Ala)]n polyanion A polyanionic polymer corresponding to the major form of [β-GlcNAc-(1→4)-Mur2Ac(oyl-L-Ala-γ-D-Glu-N-(β-D-Asp)-L-Lys-D-Ala-D-Ala)]n at pH 7.3. Graph [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-N-(beta-D-Asp)-L-Lys-D-Ala-D-Ala)]n [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-N-(beta-D-Asp)-L-Lys-D-Ala-D-Ala)]n http://purl.obolibrary.org/obo/CHEBI_140312 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140313 biolink:ChemicalEntity (16S,17S)-epoxy-(4Z,7Z,10Z,12E,14E,19Z)-docosahexaenoate A docosanoid anion that is the conjugate base of (16S,17S)-epoxy-(4Z,7Z,10Z,12E,14E,19Z)-docosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (16S,17S)-epoxy-DHA(1-)|(16S,17S)-epoxydocosahexaenoate|(16S,17S)-epoxyprotectin(1-)|(4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoate (4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoate (16S,17S)-epoxy-DHA(1-)|(16S,17S)-epoxydocosahexaenoate|(16S,17S)-epoxyprotectin(1-)|(4Z,7Z,10Z,12E,14E)-15-{(2S,3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-yl}pentadeca-4,7,10,12,14-pentaenoate http://purl.obolibrary.org/obo/CHEBI_140313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140316 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosahexaenoate An oxodocosahexaenoate that is the conjugate base of (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoate|17-oxo-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate|17-oxo-DHA(1-)|17-oxodocosahexaenoate (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoate (4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosa-4,7,10,13,15,19-hexaenoate|17-oxo-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate|17-oxo-DHA(1-)|17-oxodocosahexaenoate http://purl.obolibrary.org/obo/CHEBI_140316 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140317 biolink:ChemicalEntity phenyl sulfate oxoanion An aryl sulfate oxoanion obtained by deprotonation of the sulfo group of any phenyl sulfate; major species at pH 7.3. Graph an aryl sulfate|phenyl sulfate derivative|phenyl sulfate derivatives|phenyl sulfate oxoanions an aryl sulfate|phenyl sulfate derivative|phenyl sulfate derivatives|phenyl sulfate oxoanions http://purl.obolibrary.org/obo/CHEBI_140317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140322 biolink:ChemicalEntity triketone A compound that contains three ketone functionalities. Graph triketones triketones http://purl.obolibrary.org/obo/CHEBI_140322 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140323 biolink:ChemicalEntity beta-triketone A triketone in which the each ketone functionality is located β- to the other two. Graph beta-triketones beta-triketones http://purl.obolibrary.org/obo/CHEBI_140323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140324 biolink:ChemicalEntity primary carboxamide A carboxamide resulting from the formal condensation of a carboxylic acid with ammonia; formula RC(=O)NH2. Graph an amide|primary carboxamides an amide|primary carboxamides http://purl.obolibrary.org/obo/CHEBI_140324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140325 biolink:ChemicalEntity secondary carboxamide A carboxamide resulting from the formal condensation of a carboxylic acid with a primary amine; formula RC(=O)NHR1. Graph secondary carboxamides secondary carboxamides http://purl.obolibrary.org/obo/CHEBI_140325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140326 biolink:ChemicalEntity tertiary carboxamide A carboxamide resulting from the formal condensation of a carboxylic acid with a secondary amine; formula RC(=O)NHR1R2. Graph tertiary carboxamides tertiary carboxamides http://purl.obolibrary.org/obo/CHEBI_140326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140327 biolink:ChemicalEntity alpha-L-fucosyl-(1->2)-beta-D-galactoside Any β-D-galactoside derived from α-L-fucosyl-(1→2)-β-D-galactose. metacyc.compound:H-antigen Graph alpha-L-Fuc-(1->2)-beta-D-Gal-OR|an alpha-L-fucosyl-(1->2)-beta-D-galactosyl derivative alpha-L-Fuc-(1->2)-beta-D-Gal-OR|an alpha-L-fucosyl-(1->2)-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_140327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140328 biolink:ChemicalEntity alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactoside Any β-D-galactoside derived from α-D-galactosyl-(1→3)-[α-L-fucosyl-(1→2)]-β-D-galactose. metacyc.compound:B-antigen Graph alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-OR|an alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl derivative alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-OR|an alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_140328 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140331 biolink:ChemicalEntity 4'-hydroxyflavanones Any hydroxyflavanone having a hydroxy substituent located at position 4'. Graph a 4'-hydroxyflavanone a 4'-hydroxyflavanone http://purl.obolibrary.org/obo/CHEBI_140331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140332 biolink:ChemicalEntity 4'-methoxyflavanones Any methoxyflavanone having a methoxy substituent located at position 4'. Graph 2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|a 4'-methoxyflavanone 2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one 2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|a 4'-methoxyflavanone http://purl.obolibrary.org/obo/CHEBI_140332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140333 biolink:ChemicalEntity (7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoate A docosanoid anion that is the conjugate base of (7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoate|17-oxo-(7Z,10Z,13Z,15E,19Z)-docosapentaenoate|17-oxo-DPA(n-3)(1-)|17-oxo-omega3-docosapentaenoate (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoate (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoate|17-oxo-(7Z,10Z,13Z,15E,19Z)-docosapentaenoate|17-oxo-DPA(n-3)(1-)|17-oxo-omega3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140335 biolink:ChemicalEntity glucuronoxylan D-glucuronate polyanion A polyanionic polymer obtained by deprotonation of the carboxy groups of glucuronoxylan D-glucuronate. Major microspecies at pH 7.3 Graph glucuronoxylan D-glucuronate glucuronoxylan D-glucuronate http://purl.obolibrary.org/obo/CHEBI_140335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140336 biolink:ChemicalEntity glucuronoxylan 4-O-methyl-D-glucuronate polyanion A polyanionic polymer obtained by deprotonation of the carboxy groups of glucuronoxylan 4-O-methyl-D-glucuronate. Major microspecies at pH 7.3 Graph glucuronoxylan 4-O-methyl-D-glucuronate glucuronoxylan 4-O-methyl-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_140336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140337 biolink:ChemicalEntity (6E,8Z,11Z,14Z,17Z)-5-oxoicosapentaenoate An icosanoid anion that is the conjugate base of (6E,8Z,11Z,14Z,17Z)-5-oxoicosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (6E,8Z,11Z,14Z,17Z)-5-oxoeicosapentaenoate|5-oxo-(6E,8Z,11Z,14Z,17Z)-eicosapentaenoate|5-oxo-(6E,8Z,11Z,14Z,17Z)-icosapentaenoate|5-oxo-EPA(1-)|5-oxo-EPE(1-)|5-oxoeicosapentaenoate|5-oxoicosapentaenoate (6E,8Z,11Z,14Z,17Z)-5-oxoeicosapentaenoate|5-oxo-(6E,8Z,11Z,14Z,17Z)-eicosapentaenoate|5-oxo-(6E,8Z,11Z,14Z,17Z)-icosapentaenoate|5-oxo-EPA(1-)|5-oxo-EPE(1-)|5-oxoeicosapentaenoate|5-oxoicosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140345 biolink:ChemicalEntity hydroxy polyunsaturated fatty acid Any polyunsaturated fatty acid carrying one or more hydroxy substituents. Graph http://purl.obolibrary.org/obo/CHEBI_140345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140346 biolink:ChemicalEntity 17R,(16)-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosahexa-4,7,10,13,15,19-enoate A docosanoid anion that is the conjugate base of 17R,(16)-epoxy-(4Z,7Z,10Z,13Z,19Z)-docosahexa-4,7,10,13,15,19-enoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoate|17R,(16)-epoxy-DHA(1-) (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoate (4Z,7Z,10Z,13Z)-15-{(3R)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}pentadeca-4,7,10,13-tetraenoate|17R,(16)-epoxy-DHA(1-) http://purl.obolibrary.org/obo/CHEBI_140346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140347 biolink:ChemicalEntity substituted beta-amino acid zwitterion An amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of any substituted β-amino acid; major species at pH 7.3. Graph a substituted beta-amino acid a substituted beta-amino acid http://purl.obolibrary.org/obo/CHEBI_140347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140348 biolink:ChemicalEntity 22-hydroxyprotectin D1(1-) A docosanoid anion that is the conjugate base of 22-hydroxyprotectin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoate|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosahexaenoate|10(R),17(S),20-trihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoate|22-OH-(N)PD1(1-)|22-OH-PD1(1-)|22-hydroxy-(neuro)protectin D1(1-)|22-hydroxyneuroprotectin D1(1-) (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoate (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosa-4,7,11,13,15,19-hexaenoate|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17,22-trihydroxydocosahexaenoate|10(R),17(S),20-trihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoate|22-OH-(N)PD1(1-)|22-OH-PD1(1-)|22-hydroxy-(neuro)protectin D1(1-)|22-hydroxyneuroprotectin D1(1-) http://purl.obolibrary.org/obo/CHEBI_140348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140349 biolink:ChemicalEntity (7S,17S)-bis(hydroperoxy)-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoate A docosanoid anion that is the conjugate base of (7S,17S)-bis(hydroperoxy)-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosahexaenoate|(7S,17S)-dihydroperoxy-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoate|7(S),17(S)-diHpDHA(1-)|7(S),17(S)-dihydroperoxydocosahexaenoate|7S,17S-diH(P)DHA(1-) (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-bis(hydroperoxy)docosahexaenoate|(7S,17S)-dihydroperoxy-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoate|7(S),17(S)-diHpDHA(1-)|7(S),17(S)-dihydroperoxydocosahexaenoate|7S,17S-diH(P)DHA(1-) http://purl.obolibrary.org/obo/CHEBI_140349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140350 biolink:ChemicalEntity (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoate A dihydroxydocosahexaenoate that is the conjugate base of (7S,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoate|(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoate|(7S)-MaR1(1-)|(7S)-maresin 1(1-)|(7S,14S)-dihydroxydocosahexaenoate|7-epi-MaR1(1-)|7-epi-maresin 1(1-) (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoate (4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-4,8,10,12,16,19-hexaenoate|(4Z,7S,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosahexaenoate|(7S)-MaR1(1-)|(7S)-maresin 1(1-)|(7S,14S)-dihydroxydocosahexaenoate|7-epi-MaR1(1-)|7-epi-maresin 1(1-) http://purl.obolibrary.org/obo/CHEBI_140350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140351 biolink:ChemicalEntity 3'-methoxyflavanones Any methoxyflavanone having a methoxy substituent located at position 3'. Graph a 3'-methoxyflavanone a 3'-methoxyflavanone http://purl.obolibrary.org/obo/CHEBI_140351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140352 biolink:ChemicalEntity resolvin D5(1-) A dihydroxydocosahexaenoate that is the conjugate base of resolvin D5, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:32404334 Graph (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoate|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosahexaenoate|(7S,17S)-dihydroxy-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoate|7S,17S-diHDHA(1-)|7S,17S-dihydroxy-22:6n-3(1-)|RvD5(1-)|resolvin D5(1-) (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoate (4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosa-4,8,10,13,15,19-hexaenoate|(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7,17-dihydroxydocosahexaenoate|(7S,17S)-dihydroxy-(4Z,8E,10Z,13Z,15E,19Z)-docosahexaenoate|7S,17S-diHDHA(1-)|7S,17S-dihydroxy-22:6n-3(1-)|RvD5(1-)|resolvin D5(1-) http://purl.obolibrary.org/obo/CHEBI_140352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140353 biolink:ChemicalEntity phosphatidic acid 40:6 Graph PA 40:6|PA(40:6)|phosphatidic acid(40:6) PA 40:6|PA(40:6)|phosphatidic acid(40:6) http://purl.obolibrary.org/obo/CHEBI_140353 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140354 biolink:ChemicalEntity phosphatidic acid 38:4 Graph PA 38:4|PA(38:4)|phosphatidic acid(38:4) PA 38:4|PA(38:4)|phosphatidic acid(38:4) http://purl.obolibrary.org/obo/CHEBI_140354 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140356 biolink:ChemicalEntity 7-methoxyisoflavones Any methoxyisoflavone that has a methoxy group at the 7-position of the isoflavone moiety. Graph a 7-methoxyisoflavone a 7-methoxyisoflavone http://purl.obolibrary.org/obo/CHEBI_140356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140357 biolink:ChemicalEntity N(4)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue An N4-glycosylated L-asparagine residue that is a representation of high mannose glucans. Graph N(4)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue N(4)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_140357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140358 biolink:ChemicalEntity monosaccharide 1-phosphate(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of any monosaccharide 1-phosphate.This compound class represents generic and unspecified sugar 1-phosphates. metacyc.compound:Sugar-1-Phosphate Graph a monosaccharide 1-phosphate|monosaccharide 1-monophosphate(2-)|sugar 1-monophosphate(2-) a monosaccharide 1-phosphate|monosaccharide 1-monophosphate(2-)|sugar 1-monophosphate(2-) http://purl.obolibrary.org/obo/CHEBI_140358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140359 biolink:ChemicalEntity UDP-monosaccharide(2-) A nucleotide-sugar oxoanion obtained by deprotonation of the phosphate OH groups of any UDP-monosaccharide. This compound class represents generic and unspecified UDP-sugars. metacyc.compound:UDP-sugar Graph UDP-sugar(2-)|a UDP-monosaccharide UDP-sugar(2-)|a UDP-monosaccharide http://purl.obolibrary.org/obo/CHEBI_140359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140362 biolink:ChemicalEntity phosphatidylinositol 38:3 Graph PI 38:3|PI(38:3)|phosphatidylinositol(38:3) PI 38:3|PI(38:3)|phosphatidylinositol(38:3) http://purl.obolibrary.org/obo/CHEBI_140362 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140369 biolink:ChemicalEntity N(4)-[6-(N-acetyl-alpha-D-glucosaminyl-1-phospho)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue(1-) An anionic amino-acid residue residue that is a representation of high mannose glucans. Graph N(4)-[6-(N-acetyl-alpha-D-glucosaminyl-1-phospho)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue N(4)-[6-(N-acetyl-alpha-D-glucosaminyl-1-phospho)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_140369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140371 biolink:ChemicalEntity N(4)-[6-phospho-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue An N4-glycosylated L-asparagine residue that is a representation of high mannose glucans, but it is not known exactly which high mannose glucan is modified, (see EC 2.7.8.17 and EC 3.1.4.45) Graph N(4)-[6-phospho-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue N(4)-[6-phospho-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue http://purl.obolibrary.org/obo/CHEBI_140371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140372 biolink:ChemicalEntity 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate(13-) An inositol phosphate oxoanion obtained by deprotonation of all but one of the phosphate and diphosphate OH groups of 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). pubmed:18981179 Graph 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate http://purl.obolibrary.org/obo/CHEBI_140372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140373 biolink:ChemicalEntity (4Z,8E,10Z,13Z,16Z,19Z)-7-hydroxydocosahexaenoate A hydroxydocosahexaenoate that is the conjugate base of (4Z,8E,10Z,13Z,16Z,19Z)-7-hydroxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-4,8,10,13,16,19-hexaenoate|7-HDHA(1-)|7-HDoHE(1-)|7-hydroxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate|7-hydroxydocosahexaenoate (4Z,8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-4,8,10,13,16,19-hexaenoate (4Z,8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-4,8,10,13,16,19-hexaenoate|7-HDHA(1-)|7-HDoHE(1-)|7-hydroxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate|7-hydroxydocosahexaenoate http://purl.obolibrary.org/obo/CHEBI_140373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140374 biolink:ChemicalEntity 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate(13-) An inositol phosphate oxoanion obtained by deprotonation of the phosphate and diphosphate OH groups of 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate. It is the major microspecies at pH 7.3. pubmed:18981179 Graph 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate http://purl.obolibrary.org/obo/CHEBI_140374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140375 biolink:ChemicalEntity (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosapentaenoate A hydroxydocosahexaenoate that is the conjugate base of (8E,10Z,13Z,16Z,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoate|7-HDPA(n-3)(1-)|7-HDPAn-3(1-)|7-HDoPE(n-3)(1-)|7-hydroxy-(8E,10Z,13Z,16Z,19Z)-docosapentaenoate|7-hydroxy-omega3-docosapentaenoate (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoate (8E,10Z,13Z,16Z,19Z)-7-hydroxydocosa-8,10,13,16,19-pentaenoate|7-HDPA(n-3)(1-)|7-HDPAn-3(1-)|7-HDoPE(n-3)(1-)|7-hydroxy-(8E,10Z,13Z,16Z,19Z)-docosapentaenoate|7-hydroxy-omega3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140377 biolink:ChemicalEntity (2S)-flavan-4-one Any flavanone in which the chiral centre at position 2 has S-configuration. metacyc.compound:2S-Flavanones Graph (2S)-flavan-4-ones|(2S)-flavanone|(2S)-flavanones|a (2S)-flavan-4-one (2S)-flavan-4-ones|(2S)-flavanone|(2S)-flavanones|a (2S)-flavan-4-one http://purl.obolibrary.org/obo/CHEBI_140377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140379 biolink:ChemicalEntity an aldopyranose Any aldose having undefined stereochemistry. A representative structure is provided. Graph an aldopyranose an aldopyranose http://purl.obolibrary.org/obo/CHEBI_140379 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140380 biolink:ChemicalEntity an aldono-1,5-lactone Any aldono-1,5-lactone having undefined stereochemistry. A representative structure is provided. Graph aldono-1,5-lactone aldono-1,5-lactone http://purl.obolibrary.org/obo/CHEBI_140380 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140381 biolink:ChemicalEntity (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosapentaenoate A hydroperoxydocosapentaenoate that is the conjugate base of (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoate|7,17-DHpDPE(n-3)(1-)|7,17-bis(hydroperoxy)-(8E,10Z,13Z,15E,19Z)-docosapentaenoate|7,17-diHp-DPAn-3(1-)|7,17-diHpDPA(n-3)(1-)|7,17-dihydroperoxy-omega3-docosapentaenoate (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoate (8E,10Z,13Z,15E,19Z)-7,17-bis(hydroperoxy)docosa-8,10,13,15,19-pentaenoate|7,17-DHpDPE(n-3)(1-)|7,17-bis(hydroperoxy)-(8E,10Z,13Z,15E,19Z)-docosapentaenoate|7,17-diHp-DPAn-3(1-)|7,17-diHpDPA(n-3)(1-)|7,17-dihydroperoxy-omega3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140382 biolink:ChemicalEntity (4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosahexaenoate An oxodocosahexaenoate that is the conjugate base of (4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (4Z,8E,10Z,13Z,16Z,19Z)-7-ketodocosahexaenoate|(4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoate|7-oxo-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate|7-oxo-DHA(1-)|7-oxodocosahexaenoate (4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoate (4Z,8E,10Z,13Z,16Z,19Z)-7-ketodocosahexaenoate|(4Z,8E,10Z,13Z,16Z,19Z)-7-oxodocosa-4,8,10,13,16,19-hexaenoate|7-oxo-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate|7-oxo-DHA(1-)|7-oxodocosahexaenoate http://purl.obolibrary.org/obo/CHEBI_140382 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140386 biolink:ChemicalEntity (8E,10Z,13Z,16Z,19Z)-7-oxodocosapentaenoate A docosanoid anion that is the conjugate base of (8E,10Z,13Z,16Z,19Z)-7-oxodocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoate|7-oxo-(8E,10Z,13Z,16Z,19Z)-docosapentaenoate|7-oxo-DPA(n-3)(1-)|7-oxo-DPAn-3(1-)|7-oxo-omega3-docosapentaenoate (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoate (8E,10Z,13Z,16Z,19Z)-7-oxodocosa-8,10,13,16,19-pentaenoate|7-oxo-(8E,10Z,13Z,16Z,19Z)-docosapentaenoate|7-oxo-DPA(n-3)(1-)|7-oxo-DPAn-3(1-)|7-oxo-omega3-docosapentaenoate http://purl.obolibrary.org/obo/CHEBI_140386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140387 biolink:ChemicalEntity 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z )-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoate|(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosapentaenoate|13,14(S)-dihydroxy-omega3-docosapentaenoate|MaR2n-3 DPA(1-) (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoate (7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoate|(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosapentaenoate|13,14(S)-dihydroxy-omega3-docosapentaenoate|MaR2n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140389 biolink:ChemicalEntity (7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of (7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoate|(7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosapentaenoate|7(R),14(S)-dihydroxy-omega3-docosapentaenoate|MaR1n-3 DPA(1-) (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoate (7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoate|(7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosapentaenoate|7(R),14(S)-dihydroxy-omega3-docosapentaenoate|MaR1n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140392 biolink:ChemicalEntity (3R)-3-hydroxybutanoic acid oligomer An oligomer consisting of units of (3R)-3-hydroxybutanoic acid joined by esterification of the carboxy group of one unit with the 3-hydroxy group of the next. pubmed:28355070 Graph (3R)-3-hydroxybutyric acid oligomer|(R)-3-hydroxybutanoic acid oligomer|(R)-3-hydroxybutyric acid oligomer (3R)-3-hydroxybutyric acid oligomer|(R)-3-hydroxybutanoic acid oligomer|(R)-3-hydroxybutyric acid oligomer http://purl.obolibrary.org/obo/CHEBI_140392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140393 biolink:ChemicalEntity 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoate|(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosapentaenoate|14(S),21-dihydroxy-omega3-docosapentaenoate|MaR3n-3 DPA(1-) (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoate (7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoate|(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosapentaenoate|14(S),21-dihydroxy-omega3-docosapentaenoate|MaR3n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140394 biolink:ChemicalEntity 16(S)-glutathionyl-17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoate(2-) A docosanoid anion obtained by deprotonation of the three carboxy groups and protonation of the glutamyl α-amino group of 16(S)-glutathionyl,17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph 16-glutathionyl-17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoate(2-)|PCTR1(2-)|protectin conjugate in tissue regeneration 1(2-) 16-glutathionyl-17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoate(2-)|PCTR1(2-)|protectin conjugate in tissue regeneration 1(2-) http://purl.obolibrary.org/obo/CHEBI_140394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140395 biolink:ChemicalEntity poly(nucleoside 5'-monophosphate) polyanion An ionic polymer obtained by deprotonation of the phosphate OH groups of any poly(nucleoside 5'-monophosphate). Graph (nucleoside 5'-monophosphate)n (nucleoside 5'-monophosphate)n http://purl.obolibrary.org/obo/CHEBI_140395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140397 biolink:ChemicalEntity 16(S)-glycinylcystein-S-yl-17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoate(1-) A docosanoid anion obtained by deprotonation of the two carboxy groups and protonation of the α-amino group of 16(S)-glycinylcystein-S-yl-17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph (4Z,7Z,16S,17R,19Z)-16-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate|16-cysteinylglycinyl,17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoate(1-)|PCTR2(1-)|protectin conjugate in tissue regeneration 2(1-) (4Z,7Z,16S,17R,19Z)-16-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate (4Z,7Z,16S,17R,19Z)-16-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate|16-cysteinylglycinyl,17-hydroxy-4Z,7Z,10,12,14,19Z-docosahexaenoate(1-)|PCTR2(1-)|protectin conjugate in tissue regeneration 2(1-) http://purl.obolibrary.org/obo/CHEBI_140397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140399 biolink:ChemicalEntity specialised pro-resolving mediator A class of cell signaling molecules enzymatically derived from n-3 long chain polyunsaturated fatty acids that have important roles in orchestrating the resolution of tissue inflammation. wikipedia.en:Specialized_pro-resolving_mediators Graph SPM|SPMs|specialised pro-resolving mediators|specialised proresolving mediator|specialised proresolving mediators|specialized pro-resolving mediator|specialized pro-resolving mediators|specialized proresolving mediator|specialized proresolving mediators SPM|SPMs|specialised pro-resolving mediators|specialised proresolving mediator|specialised proresolving mediators|specialized pro-resolving mediator|specialized pro-resolving mediators|specialized proresolving mediator|specialized proresolving mediators http://purl.obolibrary.org/obo/CHEBI_140399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140401 biolink:ChemicalEntity 16(S)-cystein-S-yl,17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoate(1-) A docosanoid anion obtained by deprotonation of the two carboxy groups and protonation of the α-amino group of 16(S)-cystein-S-yl,17(R)-hydroxy-(4Z,7Z,10,12,14,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate|16-cysteinyl,17-hydroxy-4Z,7Z,16S,17R,19Z-docosahexaenoate(1-)|PCTR3(1-)|protectin conjugate in tissue regeneration 3(1-) (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate (4Z,7Z,16S,17R,19Z)-16-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-17-hydroxydocosa-4,7,10,12,14,19-hexaenoate|16-cysteinyl,17-hydroxy-4Z,7Z,16S,17R,19Z-docosahexaenoate(1-)|PCTR3(1-)|protectin conjugate in tissue regeneration 3(1-) http://purl.obolibrary.org/obo/CHEBI_140401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140402 biolink:ChemicalEntity tert-butyl ester A carboxylic ester resulting from the formal condensation of a carboxylic acid with tert-butanol. Graph 1,1-dimethylethyl ester|1,1-dimethylethyl esters|t-butyl ester|t-butyl esters|tert-butyl esters 1,1-dimethylethyl ester|1,1-dimethylethyl esters|t-butyl ester|t-butyl esters|tert-butyl esters http://purl.obolibrary.org/obo/CHEBI_140402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140405 biolink:ChemicalEntity (10R,17S)-dihydroxy-(7Z,11E,13E,15Z,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of (10R,17S)-dihydroxy-(7Z,11E,13E,15Z,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoate|(7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosapentaenoate|(PD)1n-3 DPA(1-)|10(R),17(S)-dihydroxy-omega3-docosapentaenoate|PD1n-3 DPA(1-)|protectin D1n-3 DPA(1-) (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoate (7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoate|(7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosapentaenoate|(PD)1n-3 DPA(1-)|10(R),17(S)-dihydroxy-omega3-docosapentaenoate|PD1n-3 DPA(1-)|protectin D1n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140406 biolink:ChemicalEntity 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoate A docosanoid anion that is the conjugate base of 16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoate|(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosapentaenoate|(PD)2n-3 DPA(1-)|16,17(S)-dihydroxy-7Z,10Z,13E,14E,19Z-docosapentaenoate|16,17(S)-dihydroxy-omega3-docosapentaenoate|PD2n-3 DPA(1-)|protectin D2n-3 DPA(1-) (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoate (7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoate|(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosapentaenoate|(PD)2n-3 DPA(1-)|16,17(S)-dihydroxy-7Z,10Z,13E,14E,19Z-docosapentaenoate|16,17(S)-dihydroxy-omega3-docosapentaenoate|PD2n-3 DPA(1-)|protectin D2n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140407 biolink:ChemicalEntity ceftobiprole A fifth-generation cephalosporin antibiotic having (E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl and [(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino side groups located at positions 3 and 7 respectively; developed for the treatment of hospital-acquired pneumonia (HAP, excluding ventilator-associated pneumonia, VAP) and community-acquired pneumonia (CAP). cas:209467-52-7|kegg.drug:D08885|pmc:PMC5631058|pubmed:25753637|pubmed:26316697|pubmed:26443816|pubmed:28264613|pubmed:29017833|pubmed:29395713|pubmed:29452992|reaxys:9105776 Graph (6R,7R)-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-8-oxo-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-3,4-didehydrocepham-4-carboxylic acid|ceftobiprol|ceftobiprole|ceftobiprolum 7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-3,4-didehydrocepham-4-carboxylic acid (6R,7R)-7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-8-oxo-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|7-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-3-{(E)-[(3'R)-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl}-3,4-didehydrocepham-4-carboxylic acid|ceftobiprol|ceftobiprole|ceftobiprolum http://purl.obolibrary.org/obo/CHEBI_140407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140409 biolink:ChemicalEntity (8S)-glutathionyl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoate(2-) A docosanoid anion obtained by deprotonation of the three carboxy groups and protonation of the glutamyl α-amino group of (8S)-glutathionyl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph 8-glutathionyl-7,17-dihydroxydocosahexaenoate(2-)|RCTR1(2-)|resolvin conjugate in tissue regeneration 1(2-) 8-glutathionyl-7,17-dihydroxydocosahexaenoate(2-)|RCTR1(2-)|resolvin conjugate in tissue regeneration 1(2-) http://purl.obolibrary.org/obo/CHEBI_140409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140412 biolink:ChemicalEntity (8S)-glycinylcystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoate(1-) A docosanoid anion obtained by deprotonation of the two carboxy groups and protonation of the α-amino group of (8S)-glycinylcystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph (4Z,7R,8S,13Z,15E,17S,19Z)-8-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate|8-cysteinylglycinyl-7,17-dihydroxydocosahexaenoate(1-)|RCTR2(1-)|resolvin conjugate in tissue regeneration 2(1-) (4Z,7R,8S,13Z,15E,17S,19Z)-8-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate (4Z,7R,8S,13Z,15E,17S,19Z)-8-({(2R)-2-azaniumyl-3-[(carboxylatomethyl)amino]-3-oxopropyl}sulfanyl)-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate|8-cysteinylglycinyl-7,17-dihydroxydocosahexaenoate(1-)|RCTR2(1-)|resolvin conjugate in tissue regeneration 2(1-) http://purl.obolibrary.org/obo/CHEBI_140412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140413 biolink:ChemicalEntity (8S)-cystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoate(1-) A docosanoid anion obtained by deprotonation of the two carboxy groups and protonation of the α-amino group of (8S)-cystein-S-yl-(7R,17S)-dihydroxy-(4Z,9,11,13Z,15E,19Z)-docosahexaenoic acid; major species at pH 7.3. Graph (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate|8-cysteinyl-7,17-dihydroxydocosahexaenoate(1-)|RCTR3(1-)|resolvin conjugate in tissue regeneration 3(1-) (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate (4Z,7R,8S,13Z,15E,17S,19Z)-8-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-7,17-dihydroxydocosa-4,9,11,13,15,19-hexaenoate|8-cysteinyl-7,17-dihydroxydocosahexaenoate(1-)|RCTR3(1-)|resolvin conjugate in tissue regeneration 3(1-) http://purl.obolibrary.org/obo/CHEBI_140413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140415 biolink:ChemicalEntity (7S,8,17S)-trihydroxy-(15E,19Z)-docosa-9,11,13,15,19-pentaenoate A docosanoid anion that is the conjugate base of (7S,8,17S)-trihydroxy-(15E,19Z)-docosa-9,11,13,15,19-pentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoate|(7S,8,17S)-trihydroxy-(9,11,13,15E,19Z)-docosapentaenoate|7,8,17-trihydroxy-omega3-docosapentaenoate|RvD1n-3 DPA(1-)|resolvin D1n-3 DPA(1-) (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoate (7S,15E,17S,19Z)-7,8,17-trihydroxydocosa-9,11,13,15,19-pentaenoate|(7S,8,17S)-trihydroxy-(9,11,13,15E,19Z)-docosapentaenoate|7,8,17-trihydroxy-omega3-docosapentaenoate|RvD1n-3 DPA(1-)|resolvin D1n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140416 biolink:ChemicalEntity 7,16,17-trihydroxy-(14E,19Z)-docosa-8,10,12,14,19-pentaenoate A docosanoid anion that is the conjugate base of 7,16,17-trihydroxy-(14E,19Z)-docosa-8,10,12,14,19-pentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoate|7,16,17-trihydroxy-(8,10,12,14E,19Z)-docosapentaenoate|7,16,17-trihydroxy-omega3-docosapentaenoate|RvD2n-3 DPA(1-)|resolvin D2n-3 DPA(1-) (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoate (14E,19Z)-7,16,17-trihydroxydocosa-8,10,12,14,19-pentaenoate|7,16,17-trihydroxy-(8,10,12,14E,19Z)-docosapentaenoate|7,16,17-trihydroxy-omega3-docosapentaenoate|RvD2n-3 DPA(1-)|resolvin D2n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140417 biolink:ChemicalEntity ketotifen(1+) An ammonium ion resulting from the protonation of the tertiary amino group of ketotifen. Graph 1-methyl-4-(10-oxo-9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)piperidinium 1-methyl-4-(10-oxo-9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)piperidinium 1-methyl-4-(10-oxo-9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ylidene)piperidinium http://purl.obolibrary.org/obo/CHEBI_140417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140419 biolink:ChemicalEntity 7,17-dihydroxy-(8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoate A docosanoid anion that is the conjugate base of 7,17-dihydroxy-(8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph 7,17-dihydroxy-(8Z,10,13,15E,19Z)-docosapentaenoate|7,17-dihydroxy-omega3-docosapentaenoate|RvD5n-3 DPA(1-)|resolvin D5n-3 DPA(1-) 7,17-dihydroxy-(8Z,10,13,15E,19Z)-docosapentaenoate|7,17-dihydroxy-omega3-docosapentaenoate|RvD5n-3 DPA(1-)|resolvin D5n-3 DPA(1-) http://purl.obolibrary.org/obo/CHEBI_140419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140420 biolink:ChemicalEntity eribaxaban A member of the class of pyrrolidines that is (2R,4R)-N1-(p-chlorophenyl)-4-methoxypyrrolidine-1,2-dicarboxamide in which the nitrogen of the 2-carbamoyl group has been substituted by a 2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl group. It is a synthetic organic anticoagulant compound that targets activated factor Xa in the coagulation cascade. cas:536748-46-6|drugbank:DB06920|kegg.drug:D08913|pdb-ccd:230|pubmed:17683371|pubmed:18096830|pubmed:18392334|pubmed:19071881|pubmed:23782955|pubmed:26861270|pubmed:27119575|pubmed:28793291|reaxys:12467251 Graph (2R,4R)-N(1)-(4-chlorophenyl)-N(2)-[2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl]-4-methoxypyrrolidine-1,2-dicarboxamide|PD 0348292|PD 348,292|PD 348292|PD-0348292|PD0348292|eribaxaban|eribaxabanum (2R,4R)-N(1)-(4-chlorophenyl)-N(2)-[2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl]-4-methoxypyrrolidine-1,2-dicarboxamide (2R,4R)-N(1)-(4-chlorophenyl)-N(2)-[2-fluoro-4-(2-oxopyridin-1(2H)-yl)phenyl]-4-methoxypyrrolidine-1,2-dicarboxamide|PD 0348292|PD 348,292|PD 348292|PD-0348292|PD0348292|eribaxaban|eribaxabanum http://purl.obolibrary.org/obo/CHEBI_140420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140421 biolink:ChemicalEntity betrixaban A secondary carboxamide obtained by formal condensation of the carboxy group of 4-(N,N-dimethylcarbamimidoyl)benzoic acid with the amino group of 2-amino-N-(5-chloropyridin-2-yl)-5-methoxybenzamide. A synthetic anticoagulant compound that targets activated factor Xa in the coagulation cascade. cas:330942-05-7|kegg.drug:D08873|pubmed:19297154|pubmed:23964817|pubmed:24344662|pubmed:26170684|pubmed:27232649|pubmed:27809616|pubmed:27824409|pubmed:27881569|pubmed:27974029|pubmed:27974030|pubmed:28032972|pubmed:28032973|pubmed:28193799|pubmed:28267480|pubmed:28294628|pubmed:28617144|pubmed:28698258|pubmed:28743769|pubmed:28808888|pubmed:28840662|pubmed:29092766|pubmed:29119147|pubmed:29171776|pubmed:29188425|pubmed:29212126|pubmed:29226697|pubmed:29279341|pubmed:29294463|pubmed:29338293|pubmed:29386864|pubmed:29434384|pubmed:29503590|pubmed:29543384|pubmed:29594815|pubmed:29609697|reaxys:15486817 Graph N-(5-chloropyridin-2-yl)-2-[4-(N,N-dimethylcarbamimidoyl)benzamido]-5-methoxybenzamide|PRT 054021|PRT054021|betrixaban N-(5-chloropyridin-2-yl)-2-[4-(N,N-dimethylcarbamimidoyl)benzamido]-5-methoxybenzamide N-(5-chloropyridin-2-yl)-2-[4-(N,N-dimethylcarbamimidoyl)benzamido]-5-methoxybenzamide|PRT 054021|PRT054021|betrixaban http://purl.obolibrary.org/obo/CHEBI_140421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140426 biolink:ChemicalEntity 2,4,6-trichlorophenolate A phenolate anion resulting from the deprotonation of the phenolic hydroxy group of 2,4,6-trichlorophenol. metacyc.compound:TRICHLOROPHENOL|pubmed:8680829 Graph 2,4,6-trichlorophenol|2,4,6-trichlorophenolate 2,4,6-trichlorophenolate 2,4,6-trichlorophenol|2,4,6-trichlorophenolate http://purl.obolibrary.org/obo/CHEBI_140426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140427 biolink:ChemicalEntity desirudin A heterodetic cyclic peptide composed of 65 amino acids joined in sequence and cyclised by three disulfide bridges between cysteine residues 6-14, 16-28 and 22-39. It is a highly specific inhibitor of thrombin and used as an anticoagulant in patients to prevent venous thromboembolism. Its amino acid sequence differs from natural hirudin by lack of sulfate group on Tyr-63. cas:120993-53-5|chemspider:16743713|drugcentral:2990|kegg.drug:D03692|patent:NZ248558|pubmed:10598155|pubmed:12090145|pubmed:1710836|pubmed:19915180|pubmed:2057916|pubmed:2096492|pubmed:21045759|pubmed:21646070|pubmed:21932952|pubmed:22672318|pubmed:23344102|pubmed:2363121|pubmed:2688102|pubmed:2749592|pubmed:33774764|pubmed:7504125|pubmed:7589048|pubmed:7719527|pubmed:7831657|pubmed:7979736|pubmed:8329573|pubmed:8409044|pubmed:8596376|pubmed:8684139 Graph 63-desulfohirudin (Hirudo medicinalis isoform HV1)|CGP 39393|CGP-39393|IK-HIR02|Iprivask|L-valyl-L-valyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide)|Revasc|VVYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ|VVYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ (disulfide bridge: 6->14; 16->28; 22->39)|desirudin|desirudin recombinant|desirudina|desirudine|desirudinum|desulfatohirudin|desulphatohirudin|desulphatohirudin HV1 L-valyl-L-valyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide) 63-desulfohirudin (Hirudo medicinalis isoform HV1)|CGP 39393|CGP-39393|IK-HIR02|Iprivask|L-valyl-L-valyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide)|Revasc|VVYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ|VVYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ (disulfide bridge: 6->14; 16->28; 22->39)|desirudin|desirudin recombinant|desirudina|desirudine|desirudinum|desulfatohirudin|desulphatohirudin|desulphatohirudin HV1 http://purl.obolibrary.org/obo/CHEBI_140427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140471 biolink:ChemicalEntity triricinolein A triglyceride formed by acylation of the three hydroxy groups of glycerol with ricinoleic acid, ((9Z,12R)-12-hydroxydec-9-enoic acid). It is the main constituent of castor oil. agr:IND44788222|agr:IND44788223|cas:2540-54-7|foodb.food:FDB017272|hmdb:HMDB0038061|pubmed:11800053|pubmed:14733366|pubmed:18643899|pubmed:5867691|reaxys:8608362|wikipedia.en:Ricinolein Graph 1,2,3-tri-(12R-hydroxy-9Z-octadecenoyl)-glycerol|glyceryl triricinoleate|propane-1,2,3-triyl (9Z,12R,9'Z,12'R,9''Z,12''R)tris(12-hydroxyoctadec-9-enoate) propane-1,2,3-triyl (9Z,12R,9'Z,12'R,9''Z,12''R)tris(12-hydroxyoctadec-9-enoate) 1,2,3-tri-(12R-hydroxy-9Z-octadecenoyl)-glycerol|glyceryl triricinoleate|propane-1,2,3-triyl (9Z,12R,9'Z,12'R,9''Z,12''R)tris(12-hydroxyoctadec-9-enoate) http://purl.obolibrary.org/obo/CHEBI_140471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140472 biolink:ChemicalEntity DuP-714 A hydrochloride resulting from the formal reaction of equimolar amounts of Ac-(D)Phe-Pro-boroArg-OH and hydrogen chloride. A thrombin (Factor IIa) inhibitor, thereby acting as an anticoagulant. cas:130982-43-3|pubmed:2211702|reaxys:24504803 Graph Ac-(D)Phe-Pro-boroArg-OH.HCl|DUP-714|Dup 714|Dup-714|N-acetyl-D-phenylalanyl-N-[(1R)-1-borono-4-carbamimidamidobutyl]-L-prolinamide hydrochloride|N-acetyl-D-phenylalanyl-N-[(1R)-4-{[ammonio(imino)methyl]amino}-1-boronobutyl]-L-prolinamide chloride|acetylphenylalanyl-prolyl-boroarginine hydrochloride|{(1R)-1-[({(2S)-1-[(2R)-2-acetamido-3-phenylpropanoyl]pyrrolidin-2-yl}carbonyl)amino]-4-carbamimidamidobutyl}boronic acid hydrochloride N-acetyl-D-phenylalanyl-N-[(1R)-1-borono-4-carbamimidamidobutyl]-L-prolinamide hydrochloride|N-acetyl-D-phenylalanyl-N-[(1R)-4-{[ammonio(imino)methyl]amino}-1-boronobutyl]-L-prolinamide chloride Ac-(D)Phe-Pro-boroArg-OH.HCl|DUP-714|Dup 714|Dup-714|N-acetyl-D-phenylalanyl-N-[(1R)-1-borono-4-carbamimidamidobutyl]-L-prolinamide hydrochloride|N-acetyl-D-phenylalanyl-N-[(1R)-4-{[ammonio(imino)methyl]amino}-1-boronobutyl]-L-prolinamide chloride|acetylphenylalanyl-prolyl-boroarginine hydrochloride|{(1R)-1-[({(2S)-1-[(2R)-2-acetamido-3-phenylpropanoyl]pyrrolidin-2-yl}carbonyl)amino]-4-carbamimidamidobutyl}boronic acid hydrochloride http://purl.obolibrary.org/obo/CHEBI_140472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140489 biolink:ChemicalEntity tropomyosin-related kinase B receptor agonist An agonist that binds to and deactivates the tropomyosin-related kinase B (TrkB) receptor, the main signaling receptor of the neurotrophin brain-derived neurotrophic factor (BDNF). wikipedia.en:Tropomyosin_receptor_kinase_B Graph TrkB receptor agonist|TrkB receptor agonists|tropomyosin-related kinase B receptor agonists TrkB receptor agonist|TrkB receptor agonists|tropomyosin-related kinase B receptor agonists http://purl.obolibrary.org/obo/CHEBI_140489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140517 biolink:ChemicalEntity C-terminal boronic acid peptide A member of the class of boronic acids that is any peptide in which the carboxy group at the C-terminus has been replaced by a borono (-B(OH)2) group. patent:US2010036159|pubmed:11814352|pubmed:16608165|pubmed:23412370|pubmed:27966962|pubmed:28827348|pubmed:8154328|pubmed:8154333|pubmed:9204385 Graph C-terminal boronic acid petides|peptide boronic acid|peptide boronic acids|peptide-boronic acid C-terminal boronic acid petides|peptide boronic acid|peptide boronic acids|peptide-boronic acid http://purl.obolibrary.org/obo/CHEBI_140517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140518 biolink:ChemicalEntity Ac-(D)Phe-Pro-boroArg-OH(1+) A guanidinium ion resulting from the protonation of the guanidino group of Ac-(D)Phe-Pro-boroArg-OH. The major species at pH 7.3. Graph http://purl.obolibrary.org/obo/CHEBI_140518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140522 biolink:ChemicalEntity [(1->4)-alpha-D-galacturonosyl methyl ester](n) Graph [(1->4)-alpha-D-galacturonosyl methyl ester](n) [(1->4)-alpha-D-galacturonosyl methyl ester](n) http://purl.obolibrary.org/obo/CHEBI_140522 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140523 biolink:ChemicalEntity [(1->4)-alpha-D-galacturonosyl](n) Graph [(1->4)-alpha-D-galacturonosyl](n) [(1->4)-alpha-D-galacturonosyl](n) http://purl.obolibrary.org/obo/CHEBI_140523 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140535 biolink:ChemicalEntity TRPV1 agonist An agonist at the transient receptor potential vanilloid 1 (TRPV1). wikipedia.en:TRPV1 Graph TRPV1 agonists|capsaicin receptor agonist|capsaicin receptor agonists|transient receptor potential cation channel subfamily V member 1 agonist|transient receptor potential cation channel subfamily V member 1 agonists|transient receptor potential vanilloid 1 agonist|transient receptor potential vanilloid 1 agonists|vanilloid receptor 1 agonist|vanilloid receptor 1 agonists TRPV1 agonists|capsaicin receptor agonist|capsaicin receptor agonists|transient receptor potential cation channel subfamily V member 1 agonist|transient receptor potential cation channel subfamily V member 1 agonists|transient receptor potential vanilloid 1 agonist|transient receptor potential vanilloid 1 agonists|vanilloid receptor 1 agonist|vanilloid receptor 1 agonists http://purl.obolibrary.org/obo/CHEBI_140535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140537 biolink:ChemicalEntity diethylphosphate(1-) A dialkyl phosphate having ethyl as the alkyl group; major microspecies at pH 7.3 metacyc.compound:DIETHYLPHOSPHATE Graph diethylphosphate diethylphosphate http://purl.obolibrary.org/obo/CHEBI_140537 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140559 biolink:ChemicalEntity N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactose derivative kegg.compound:C06483|metacyc.compound:A-antigen Graph an A antigen|an A histo-blood group antigen|an N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl derivative an A antigen|an A histo-blood group antigen|an N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_140559 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140561 biolink:ChemicalEntity (1->4)-3,6-bis(phospho)-alpha-D-glucan polyanion An organophosphate oxoanion obtained by global deprotonation of the phosphate OH groups of (1→4)-3,6-bis(phospho)-α-D-glucan; major species at pH 7.3. Graph (1->4)-3,6-bis(phospho)-alpha-D-glucan (1->4)-3,6-bis(phospho)-alpha-D-glucan http://purl.obolibrary.org/obo/CHEBI_140561 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140564 biolink:ChemicalEntity delta-cadinene A member of the cadinene family of sesquiterpenes in which the double bonds are located at the 4-4a and 7-8 positions, and in which the isopropyl group at position 1 is cis to the hydrogen at the adjacent bridgehead carbon (position 8a). Graph delta-cadinene|rel-(1R,8aS)-1-isopropyl-4,7-dimethyl-1,2,3,5,6,8a-hexahydronaphthalene rel-(1R,8aS)-1-isopropyl-4,7-dimethyl-1,2,3,5,6,8a-hexahydronaphthalene delta-cadinene|rel-(1R,8aS)-1-isopropyl-4,7-dimethyl-1,2,3,5,6,8a-hexahydronaphthalene http://purl.obolibrary.org/obo/CHEBI_140564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140572 biolink:ChemicalEntity heparan sulfate alpha-D-N-sulfoglucosamine polyanion A carbohydrate acid derivative anion arising from deprotonation of the carboxylic acid and sulfate groups of the repeating units of heparan sulfate α-D-glucosaminide N-sulfate; major species at pH 7.3. Graph heparan sulfate alpha-D-glucosaminide N-sulfate heparan sulfate alpha-D-glucosaminide N-sulfate http://purl.obolibrary.org/obo/CHEBI_140572 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140575 biolink:ChemicalEntity alpha-D-xylose-(1->3)-beta-D-glucose-L-seryl residue An L-α-amino acid residue derived from α-D-xylose-(1→3)-β-D-glucose-L-serine. Graph 3-O-(alpha-D-xylosyl-(1->3)-beta-D-glucosyl)-L-seryl residue 3-O-(alpha-D-xylosyl-(1->3)-beta-D-glucosyl)-L-seryl residue http://purl.obolibrary.org/obo/CHEBI_140575 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140576 biolink:ChemicalEntity beta-D-glucose-L-seryl residue An L-α-amino acid residue derived from β-D-glucose-L-serine. Graph 3-O-(beta-D-glucosyl)-L-seryl residue 3-O-(beta-D-glucosyl)-L-seryl residue http://purl.obolibrary.org/obo/CHEBI_140576 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140594 biolink:ChemicalEntity ethanediol derivative A substituted ethane carrying two hydroxy groups. Graph an ethanediol an ethanediol http://purl.obolibrary.org/obo/CHEBI_140594 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140599 biolink:ChemicalEntity alpha-D-xylose-(1->3)-alpha-D-xylose-(1->3)-beta-D-glucose-L-seryl residue An L-α-amino acid residue derived from α-D-xylose-(1→3)-α-D-xylose-(1→3)-β-D-glucose-L-serine. Graph 3-O-(alpha-D-xylosyl-(1->3)-alpha-D-xylosyl-(1->3)-beta-D-glucosyl)-L-seryl residue 3-O-(alpha-D-xylosyl-(1->3)-alpha-D-xylosyl-(1->3)-beta-D-glucosyl)-L-seryl residue http://purl.obolibrary.org/obo/CHEBI_140599 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140601 biolink:ChemicalEntity fatty acid 4:0 Any saturated fatty acid containing 4 carbons. Graph http://purl.obolibrary.org/obo/CHEBI_140601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140602 biolink:ChemicalEntity Arabidopsis thaliana metabolite Any plant metabolite that is produced by Arabidopsis thaliana. wikipedia.en:Arabidopsis_thaliana Graph Arabidopsis thaliana metabolites Arabidopsis thaliana metabolites http://purl.obolibrary.org/obo/CHEBI_140602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140604 biolink:ChemicalEntity heparan sulfate alpha-D-glucosaminide 6-sulfate polyanion A carbohydrate acid derivative anion arising from deprotonation of the carboxylic acid and sulfate groups of the repeating units of heparan sulfate α-D-glucosaminide 6-sulfate; major species at pH 7.3. Graph heparan sulfate alpha-D-glucosaminide 6-sulfate heparan sulfate alpha-D-glucosaminide 6-sulfate http://purl.obolibrary.org/obo/CHEBI_140604 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140607 biolink:ChemicalEntity S-(ADP-D-ribosyl)-L-cysteine(2-) residue An L-α-amino acid residue derived from S-(ADP-D-ribosyl)-L-cysteine. Graph S-(ADP-D-ribosyl)-L-cysteine residue S-(ADP-D-ribosyl)-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_140607 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140613 biolink:ChemicalEntity L,L-homocystine zwitterion A homocystine zwitterion in which both stereocentres have L configuration. metacyc.compound:HOMOCYSTINE Graph L,L-homocystine|L-homocystine zwitterion L,L-homocystine|L-homocystine zwitterion http://purl.obolibrary.org/obo/CHEBI_140613 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140618 biolink:ChemicalEntity castor oil A mixture of triglycerides obtained by pressing the seeds of the castor oil plant, Ricinus communis. The major component is triricinolein. Typical fatty acid composition on hydrolysis is 87% ricinoleic acid, 7% oleic acid, 3% linoleic acid, 2% palmitic acid, 1% stearic acid, and trace amounts of dihydroxystearic acid. cas:8001-79-4|drugbank:DB11113|kegg.drug:D06462|pubmed:28618920|pubmed:28671592|pubmed:28750937|pubmed:28838804|pubmed:28932063|reaxys:8196707|wikipedia.en:Castor_oil Graph Oleum Ricini|Ricinus communis oil|Ricinus oil|oil of Palma Christi|tangantangan oil Oleum Ricini|Ricinus communis oil|Ricinus oil|oil of Palma Christi|tangantangan oil http://purl.obolibrary.org/obo/CHEBI_140618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140621 biolink:ChemicalEntity cisatracurium A diester that is the (1R,1'R,2R,2'R)-diastereoisomer of atracurium, a quaternary ammonium ion consisting of pentane-1,5-diol with both hydroxy functions bearing 3-[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolinium-2(1H)-yl]propanoyl groups. The active species in the skeletal muscle relaxant cisatracurium besylate. cas:96946-41-7|drugbank:DB00565|patent:WO2013189800|pubmed:27703625|pubmed:28239805|pubmed:28351905|pubmed:28367286|pubmed:28770545|pubmed:29324189|pubmed:29368335|pubmed:29517695|pubmed:29635320|reaxys:8184048 Graph (1R,2R,1'R,2'R)-2,2'-{pentane-1,5-diylbis[oxy(3-oxopropane-3,1-diyl)]}bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium]|(1R,2R,1'R,2'R)-atracurium|(1R-cis,1'R-cis)-2,2'-{pentane-1,5-diylbis[oxy(3-oxopropane-3,1-diyl)]}bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium]|(1R-cis,1'R-cis)-atracurium (1R,2R,1'R,2'R)-2,2'-{pentane-1,5-diylbis[oxy(3-oxopropane-3,1-diyl)]}bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium] (1R,2R,1'R,2'R)-2,2'-{pentane-1,5-diylbis[oxy(3-oxopropane-3,1-diyl)]}bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium]|(1R,2R,1'R,2'R)-atracurium|(1R-cis,1'R-cis)-2,2'-{pentane-1,5-diylbis[oxy(3-oxopropane-3,1-diyl)]}bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium]|(1R-cis,1'R-cis)-atracurium http://purl.obolibrary.org/obo/CHEBI_140621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140629 biolink:ChemicalEntity dialurate A barbiturate anion resulting from deprotonation of the carbon bearing the hydroxy group of dialuric acid. Major microspecies at pH 7.3 metacyc.compound:CPD-15999|pubmed:21344938 Graph dialurate dialurate http://purl.obolibrary.org/obo/CHEBI_140629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140658 biolink:ChemicalEntity S-1,2-diacyl-sn-glyceryl-L-cysteine residue metacyc.compound:MONOMER0-4342|pubmed:7592473|pubmed:7896715 Graph an S-1,2-diacyl-sn-glyceryl-L-cysteine residue an S-1,2-diacyl-sn-glyceryl-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_140658 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140675 biolink:ChemicalEntity 3-hydroxyacyl derivative of bacterial toxin Graph a 3-hydroxyacyl derivative of bacterial toxin a 3-hydroxyacyl derivative of bacterial toxin http://purl.obolibrary.org/obo/CHEBI_140675 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140741 biolink:ChemicalEntity hypotaurine(1-) An organosulfinate oxoanion resulting from the deprotonation of the sulfinic acid group of hypotaurine. pubmed:22042256 Graph 2-aminoethanesulfinate 2-aminoethanesulfinate 2-aminoethanesulfinate http://purl.obolibrary.org/obo/CHEBI_140741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140764 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminyl-(2->6)]-N-acetyl-alpha-D-galactosaminide(1-) metacyc.compound:CPD-16485 Graph a beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminyl-(2->6)]-N-acetyl-alpha-D-galactosaminyl derivative a beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminyl-(2->6)]-N-acetyl-alpha-D-galactosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_140764 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140768 biolink:ChemicalEntity ascorbyl palmitate chemspider:16736579|kegg.drug:D02412|wikipedia.en:Ascorbyl_palmitate Graph http://purl.obolibrary.org/obo/CHEBI_140768 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140773 biolink:ChemicalEntity lysophosphatidylcholine P-16:0 Graph GPCho P-16:0|GPCho(P-16:0)|LPC P-16:0|LPC(16:0p)|LPC(P-16:0)|PC P-16:0_0:0|PC(P-16:0_0:0)|lysoPC P-16:0|lysoPC(P-16:0)|lysophosphatidylcholine(P-16:0) GPCho P-16:0|GPCho(P-16:0)|LPC P-16:0|LPC(16:0p)|LPC(P-16:0)|PC P-16:0_0:0|PC(P-16:0_0:0)|lysoPC P-16:0|lysoPC(P-16:0)|lysophosphatidylcholine(P-16:0) http://purl.obolibrary.org/obo/CHEBI_140773 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140774 biolink:ChemicalEntity 4-[(1->4)-alpha-D-glucosyl]n-D-glucose Graph 4-[(1->4)-alpha-D-glucosyl]n-D-glucose 4-[(1->4)-alpha-D-glucosyl]n-D-glucose http://purl.obolibrary.org/obo/CHEBI_140774 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140775 biolink:ChemicalEntity 1-[(1->4)-alpha-D-glucosyl]n-alpha-D-glucopyranoside Graph 1-[(1->4)-alpha-D-glucosyl]n-alpha-D-glucopyranoside 1-[(1->4)-alpha-D-glucosyl]n-alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_140775 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140785 biolink:ChemicalEntity R-cob(III)alamin metacyc.compound:CPD-20938 Graph an R-cob(III)alamin an R-cob(III)alamin http://purl.obolibrary.org/obo/CHEBI_140785 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140810 biolink:ChemicalEntity beta-D-glucosamine(1+) A 2-ammonio-2-deoxy-D-glucopyranose that has β- configuration at the anomeric carbon. Graph 2-ammonio-2-deoxy-beta-D-glucopyranose 2-ammonio-2-deoxy-beta-D-glucopyranose 2-ammonio-2-deoxy-beta-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_140810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14086 biolink:ChemicalEntity dTDP-D-galactose The D-enantiomer of dTDP-galactose. kegg.compound:C02097 Graph dTDP-D-galactose|thymidine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] dTDP-D-galactose|thymidine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_14086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140876 biolink:ChemicalEntity GlcNAc-beta1,3-Gal-R blood group Type 1 oligosaccharide chain precursor Graph http://purl.obolibrary.org/obo/CHEBI_140876 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140883 biolink:ChemicalEntity TG(18:2/18:2/18:2) Graph TAG(18:2/18:2/18:2) TAG(18:2/18:2/18:2) http://purl.obolibrary.org/obo/CHEBI_140883 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140905 biolink:ChemicalEntity N-{2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl}-N-propylpropan-1-amine hydrochloride An aromatic ether that is (2-phenoxyethyl)benzene which carries a 2-(dipropylamino)ethyl group at position 3 and a methoxy group at position 6. It is a potent and selective σ1 receptor antagonist. cas:149409-57-4|patent:EP0717990|patent:US5495046|pubmed:10090790|pubmed:17556637|pubmed:27208832|pubmed:7475936|pubmed:7603628|pubmed:7609777|pubmed:7821367|pubmed:7823755|pubmed:7901723|pubmed:8041225|pubmed:8137864|pubmed:9544798|reaxys:8296389 Graph 4-methoxy-3-(2-phenylethoxy)-N,N-dipropyl-benzeneethanamine hydrochloride|N,N-dipropyl-2-(4-methoxy-3-(2-phenylethoxy)phenyl)ethylamine monohydrochloride|N,N-dipropyl-2-[4-methoxy-3-(2-phenylethoxyl)phenyl]ethylamine hydrochloride|N-{2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl}-N-propylpropan-1-amine hydrochloride|NE 100|NE-100 N-{2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl}-N-propylpropan-1-amine hydrochloride 4-methoxy-3-(2-phenylethoxy)-N,N-dipropyl-benzeneethanamine hydrochloride|N,N-dipropyl-2-(4-methoxy-3-(2-phenylethoxy)phenyl)ethylamine monohydrochloride|N,N-dipropyl-2-[4-methoxy-3-(2-phenylethoxyl)phenyl]ethylamine hydrochloride|N-{2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl}-N-propylpropan-1-amine hydrochloride|NE 100|NE-100 http://purl.obolibrary.org/obo/CHEBI_140905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140908 biolink:ChemicalEntity GANT61 An aminal that is hexahydropyrimidine which is substituted on each nitrogen by a 2-(dimethylamino)benzyl group, and at the aminal carbon by a pyridin-4-yl group. A Hedgehog signaling pathway and Gli protein inhibitor. pubmed:20488474|pubmed:22265815|pubmed:22398221|pubmed:23200667|pubmed:24521409|pubmed:24694609|pubmed:24962990|pubmed:25064451|pubmed:25323222|pubmed:25432075|pubmed:25544756|pubmed:26843616|pubmed:27275540|pubmed:27349387|pubmed:27572939|pubmed:27601167|pubmed:27662839|pubmed:27713179|pubmed:27793816|pubmed:27863397|pubmed:27894350|pubmed:28109323|pubmed:28123507|pubmed:28144905|pubmed:28208838|pubmed:28211214|pubmed:28446294|pubmed:28457748|pubmed:28870808|pubmed:28965853|pubmed:29231999|pubmed:29250185|pubmed:29328464|pubmed:29329585|pubmed:29338454|pubmed:29581853|pubmed:29642386|pubmed:29702195 Graph 2-({3-[2-(dimethylamino)benzyl]-2-(pyridin-4-yl)tetrahydropyrimidin-1(2H)-yl}methyl)-N,N-dimethylaniline|GANT-61|NSC 136476 2-({3-[2-(dimethylamino)benzyl]-2-(pyridin-4-yl)tetrahydropyrimidin-1(2H)-yl}methyl)-N,N-dimethylaniline 2-({3-[2-(dimethylamino)benzyl]-2-(pyridin-4-yl)tetrahydropyrimidin-1(2H)-yl}methyl)-N,N-dimethylaniline|GANT-61|NSC 136476 http://purl.obolibrary.org/obo/CHEBI_140908 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140911 biolink:ChemicalEntity Lewis X antigen Graph Gal-beta1,4-GlcNAc-(alpha1,3-Fuc)-beta1,3-Gal-R|LeX Gal-beta1,4-GlcNAc-(alpha1,3-Fuc)-beta1,3-Gal-R|LeX http://purl.obolibrary.org/obo/CHEBI_140911 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140912 biolink:ChemicalEntity Lewis Y antigen Graph LeY|R-alpha-D-Gal-1,3-alpha-D-GlcNAc-(alpha1,3-Fuc)-1,4-D-Gal-1,2-alpha-D-Fuc LeY|R-alpha-D-Gal-1,3-alpha-D-GlcNAc-(alpha1,3-Fuc)-1,4-D-Gal-1,2-alpha-D-Fuc http://purl.obolibrary.org/obo/CHEBI_140912 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140915 biolink:ChemicalEntity disialyl-Lewis A antigen A disialylated Lewis blood group antigen Graph R-alpha-D-Gal-beta1,3-alpha-D-GlcNAc-(alpha2,6-Neu5Ac)-(alpha1,4-Fuc)-beta1,3-D-Gal-alpha2,3-Neu5Ac|dsLeA R-alpha-D-Gal-beta1,3-alpha-D-GlcNAc-(alpha2,6-Neu5Ac)-(alpha1,4-Fuc)-beta1,3-D-Gal-alpha2,3-Neu5Ac|dsLeA http://purl.obolibrary.org/obo/CHEBI_140915 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140917 biolink:ChemicalEntity Type 1 monosialylgalactosylgloboside Graph R-alpha-D-Gal-beta1,3-alpha-D-GlcNAc-beta1,3-D-Gal-alpha2,3-Neu5Ac|Type 1 MSGG|Type 1 sialyl-paragloboside R-alpha-D-Gal-beta1,3-alpha-D-GlcNAc-beta1,3-D-Gal-alpha2,3-Neu5Ac|Type 1 MSGG|Type 1 sialyl-paragloboside http://purl.obolibrary.org/obo/CHEBI_140917 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140918 biolink:ChemicalEntity Type 2 monosialylgalactosylgloboside Graph R-Gal-beta1,3-GlcNAc-beta1,4-Gal-alpha2,3-Neu5Ac|Type 2 MSGG R-Gal-beta1,3-GlcNAc-beta1,4-Gal-alpha2,3-Neu5Ac|Type 2 MSGG http://purl.obolibrary.org/obo/CHEBI_140918 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140919 biolink:ChemicalEntity Type 1 disialyl-paragloboside Formed by the addition of sialic acid (Neu5Ac) to Type 1 MSGG and is the precursor for disialyl-Lewis A antigen Graph Type 1 DSGG Type 1 DSGG http://purl.obolibrary.org/obo/CHEBI_140919 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140921 biolink:ChemicalEntity Hedgehog signaling pathway inhibitor Any pathway inhibitor that inhibits the Hedgehog signalling pathway. wikipedia.en:Hedgehog_pathway_inhibitors Graph Hedgehog pathway inhibitor|Hedgehog pathway inhibitors|Hedgehog signaling pathway inhibitors Hedgehog pathway inhibitor|Hedgehog pathway inhibitors|Hedgehog signaling pathway inhibitors http://purl.obolibrary.org/obo/CHEBI_140921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140922 biolink:ChemicalEntity glioma-associated oncogene inhibitor An inhibitor of any of the glioma-associated oncogene (GLI) proteins. Graph GLI inhibitor|GLI inhibitors|glioma-associated oncogene inhibitors GLI inhibitor|GLI inhibitors|glioma-associated oncogene inhibitors http://purl.obolibrary.org/obo/CHEBI_140922 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140936 biolink:ChemicalEntity 1-(1-methylindol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea A member of ther class of ureas that is urea in which a hydrogen attached to one of the nitrogens has been replaced by an N-methylindol-5-yl group, while a hydrogen attached to the other nitrogen has been replaced by a 3-methyl-1,2-thiazol-5-yl group. It is a potent and selective antagonist for the 5-hydroxytryptamine 2B (5-HT2B) receptor. cas:152239-46-8|pubmed:10821800|pubmed:20374255|pubmed:20472767|pubmed:20969855|pubmed:21860590|pubmed:22120177|pubmed:22210189|pubmed:23769718|pubmed:25544272|pubmed:25667920|pubmed:26293029|pubmed:27511837|pubmed:29649585|pubmed:7582481|pubmed:7699699|wikipedia.en:SB-204741 Graph 1-(1-methyl-1H-indol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea|3-(3-methyl-1,2-thiazol-5-yl)-1-(1-methylindol-5-yl)urea|N-(1-methyl-1H-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea|N-(1-methyl-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea|SB 204741|SB-204741|SB204741 1-(1-methyl-1H-indol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea 1-(1-methyl-1H-indol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea|3-(3-methyl-1,2-thiazol-5-yl)-1-(1-methylindol-5-yl)urea|N-(1-methyl-1H-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea|N-(1-methyl-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea|SB 204741|SB-204741|SB204741 http://purl.obolibrary.org/obo/CHEBI_140936 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140941 biolink:ChemicalEntity omega-9 fatty acid A family of polyunsaturated fatty acids that have in common a final carbon-carbon double bond in the ω−9 position, i.e., the ninth bond from the methyl end of the fatty acid. Graph http://purl.obolibrary.org/obo/CHEBI_140941 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140943 biolink:ChemicalEntity fatty acid 16:0 Any saturated fatty acid containing 16 carbons and 0 double bonds. Graph FA 16:0|FA(16:0) FA 16:0|FA(16:0) http://purl.obolibrary.org/obo/CHEBI_140943 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140948 biolink:ChemicalEntity fatty acid 18:1 Any monounsaturated fatty acid containing 18 carbons and 1 double bond. Graph FA 18:1|FA(18:1) FA 18:1|FA(18:1) http://purl.obolibrary.org/obo/CHEBI_140948 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140949 biolink:ChemicalEntity fatty acid 18:2 Any polyunsaturated fatty acid containing 18 carbons and 2 double bonds. Graph FA 18:2|FA(18:2) FA 18:2|FA(18:2) http://purl.obolibrary.org/obo/CHEBI_140949 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140991 biolink:ChemicalEntity omega-methyl-long-chain fatty acid anion A long-chain fatty acid anion obtained by deprotonation of the carboxy group of any ω-methyl fatty acid; major species at pH 7.3. Graph an omega-methyl-long-chain fatty acid|omega-methyl-long-chain fatty acid anions an omega-methyl-long-chain fatty acid|omega-methyl-long-chain fatty acid anions http://purl.obolibrary.org/obo/CHEBI_140991 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:140992 biolink:ChemicalEntity omega-hydroxy-long-chain fatty acid anion An ω-hydroxy fatty acid anion obtained by deprotonation of the carboxy group of any ω-hydroxy-long-chain fatty acid; major species at pH 7.3. Graph an omega-hydroxy-long-chain fatty acid|long-chain omega-hydroxy fatty acid anion|long-chain omega-hydroxy fatty acid anions|omega-hydroxy long-chain fatty acid anion|omega-hydroxy long-chain fatty acid anions|omega-hydroxy-long-chain fatty acid anions|omega-hydroxy-long-chain fatty acid(1-) an omega-hydroxy-long-chain fatty acid|long-chain omega-hydroxy fatty acid anion|long-chain omega-hydroxy fatty acid anions|omega-hydroxy long-chain fatty acid anion|omega-hydroxy long-chain fatty acid anions|omega-hydroxy-long-chain fatty acid anions|omega-hydroxy-long-chain fatty acid(1-) http://purl.obolibrary.org/obo/CHEBI_140992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140994 biolink:ChemicalEntity 4-nitrophenyl sulfate An aryl sulfate oxoanion resulting from the deprotonation of the sulfooxy group of 4-nitrophenyl hydrogen sulfate. The major microspecies at pH 7.3. pubmed:19036922 Graph 4-nitrophenyl sulfate|p-nitrophenyl sulfate 4-nitrophenyl sulfate|p-nitrophenyl sulfate 4-nitrophenyl sulfate|p-nitrophenyl sulfate http://purl.obolibrary.org/obo/CHEBI_140994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:140997 biolink:ChemicalEntity omega-hydroxy-long-chain fatty acid A ω-hydroxy-fatty acid with a chain length ranging from C13 to C22. Graph long-chain omega-hydroxy-fatty acid|long-chain omega-hydroxy-fatty acids|long-chain-omega-hydroxy-fatty acid|long-chain-omega-hydroxy-fatty acids|omega-hydroxy-long-chain fatty acids long-chain omega-hydroxy-fatty acid|long-chain omega-hydroxy-fatty acids|long-chain-omega-hydroxy-fatty acid|long-chain-omega-hydroxy-fatty acids|omega-hydroxy-long-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_140997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141004 biolink:ChemicalEntity alpha-D-galacturonosyl-(1->4)-D-galacturonate(2-) A carbohydrate acid anion arising from deprotonation of both carboxy groups of 4-(α-D-galactopyranuronosyl)-D-galactopyranuronic acid; major species at pH 7.3. Graph 4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronate|alpha-D-galacturonosyl-(1->4)-D-galacturonate 4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronate 4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronate|alpha-D-galacturonosyl-(1->4)-D-galacturonate http://purl.obolibrary.org/obo/CHEBI_141004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141005 biolink:ChemicalEntity (6S)-5,6,7,8-tetrahydrofolyl-poly(gamma-glutamate) macromolecule A tetrahydrofolyl-poly(glutamate) macromolecule in which the stereocentre at position 6 on the tetrahydrofolyl moiety has S-configuration. Graph (6S)-5,6,7,8-tetrahydrofolyl-(gamma-L-Glu)n (6S)-5,6,7,8-tetrahydrofolyl-(gamma-L-Glu)n http://purl.obolibrary.org/obo/CHEBI_141005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141006 biolink:ChemicalEntity alpha-D-GalpA-(1->4)-D-GalpA A digalacturonic acid in which an α-D-galactopyranuronic acid unit is joined to a D-galactopyranuronic acid unit via an α-(1→4)-linkage. cas:5894-59-7|glytoucan:G11876JO|kegg.compound:C02273|kegg.glycan:G02614 Graph 4-(alpha-D-glucopyranosyluronic acid)-D-glucuronic acid|4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronic acid|alpha-D-GalpA-(1->4)-D-GalpA|alpha-D-galactopyranuronosyl-(1->4)-D-galactopyranuronic acid 4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronic acid|alpha-D-galactopyranuronosyl-(1->4)-D-galactopyranuronic acid 4-(alpha-D-glucopyranosyluronic acid)-D-glucuronic acid|4-O-alpha-D-galactopyranuronosyl-D-galactopyranuronic acid|alpha-D-GalpA-(1->4)-D-GalpA|alpha-D-galactopyranuronosyl-(1->4)-D-galactopyranuronic acid http://purl.obolibrary.org/obo/CHEBI_141006 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141014 biolink:ChemicalEntity a pyrimidine ribonucleoside Any pyrimidine ribonucleoside Graph a pyrimidine ribonucleoside a pyrimidine ribonucleoside http://purl.obolibrary.org/obo/CHEBI_141014 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141023 biolink:ChemicalEntity 2,3,6-trichloro-4-hydroxyphenolate A phenolate anion that is 2,3,5-trichlorobenzene-1,4-diol in which the hydroxy group that is ortho- to two chlorines has undergone deprotonation. The major species at pH 7.3. metacyc.compound:236-TRICHLOROHYDROQUINONE|pubmed:1459949 Graph 2,3,5-trichlorobenzene-1,4-diol(1-)|2,3,6-trichloro-4-hydroxyphenolate|2,3,6-trichlorohydroquinone 2,3,6-trichloro-4-hydroxyphenolate 2,3,5-trichlorobenzene-1,4-diol(1-)|2,3,6-trichloro-4-hydroxyphenolate|2,3,6-trichlorohydroquinone http://purl.obolibrary.org/obo/CHEBI_141023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141024 biolink:ChemicalEntity 2,6-dichloro-4-hydroxyphenolate A phenolate anion that is 2,6-dichlorohydroquinone in which the hydroxy group that is ortho to both of the chlorines has been deprotonated. The major species at pH 7.3 metacyc.compound:26-DICHLORO-P-HYDROQUINONE|pubmed:1459949 Graph 2,6-dichloro-4-hydroxyphenolate|2,6-dichlorohydroquinone 2,6-dichloro-4-hydroxyphenolate 2,6-dichloro-4-hydroxyphenolate|2,6-dichlorohydroquinone http://purl.obolibrary.org/obo/CHEBI_141024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141046 biolink:ChemicalEntity 16,16-dimethylprostaglandin E2 A prostanoid that is prostaglandin E2 in which both of the hydrogens at position 16 have been replaced by methyl groups. A synthetic analogue of prostaglandin E2, it is a potent inhibitor of pancreatic function and growth of experimental tumors. It also protects the gastric mucosa, prevents ulceration, and promotes the healing of peptic ulcers. cas:39746-25-3|lipidmaps:LMFA03010065|pubmed:10630489|pubmed:10669047|pubmed:10952078|pubmed:11208431|pubmed:11991626|pubmed:1372575|pubmed:1373359|pubmed:1604570|pubmed:1629578|pubmed:174967|pubmed:19059888|pubmed:2116342|pubmed:23996087|pubmed:3562785|pubmed:7201834|pubmed:7513369|pubmed:7616483|pubmed:7625885|pubmed:7847837|pubmed:7874263|pubmed:8225563|pubmed:8322025|pubmed:8419232|pubmed:8514255|pubmed:8613460|pubmed:9073153|pubmed:9481403 Graph (5Z,11alpha,13E,15R)-11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-1-oic acid|16,16-Dimethyl-pge2|16,16-Dimethyl-prostaglandin E2|16,16-dimethyl Prostaglandin E2|9-oxo-11R,15R-dihydroxy-16,16-dimethyl-5Z,13E-prostadienoic acid|dmPGE(2)|dmPGE2 (5Z,11alpha,13E,15R)-11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-1-oic acid (5Z,11alpha,13E,15R)-11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-1-oic acid|16,16-Dimethyl-pge2|16,16-Dimethyl-prostaglandin E2|16,16-dimethyl Prostaglandin E2|9-oxo-11R,15R-dihydroxy-16,16-dimethyl-5Z,13E-prostadienoic acid|dmPGE(2)|dmPGE2 http://purl.obolibrary.org/obo/CHEBI_141046 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14105 biolink:ChemicalEntity deamido-NAD zwitterion beilstein:3865990 Graph adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] hydrogen diphosphate} adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] hydrogen diphosphate} adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] hydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_14105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141050 biolink:ChemicalEntity 1,6-didemethyltoxoflavin A pyrimidotriazine that is 5,6,7,8-tetrahydropyrimido[5,4-e][1,2,4]triazine with oxo groups at positions 5 and 7. cas:19359-69-4|kegg.compound:C21956|metacyc.compound:CPD-21063|pdb-ccd:AZ8|pubmed:27070241|reaxys:1110645 Graph 1,6-didemethyltoxoflavin|8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione|pyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione pyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione 1,6-didemethyltoxoflavin|8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione|pyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione http://purl.obolibrary.org/obo/CHEBI_141050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141056 biolink:ChemicalEntity 2-O-[alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl]-D-glycerate metacyc.compound:CPD-20963|pubmed:26324178 Graph (2R)-2-O-(alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl)-glycerate (2R)-2-O-(alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl)-glycerate http://purl.obolibrary.org/obo/CHEBI_141056 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141058 biolink:ChemicalEntity 2-O-[6-O-octanoyl-alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl]-D-glycerate metacyc.compound:CPD-20964|pubmed:26324178 Graph (2R)-2-O-(6-O-octanoyl-alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl)-glycerate (2R)-2-O-(6-O-octanoyl-alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl)-glycerate http://purl.obolibrary.org/obo/CHEBI_141058 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141063 biolink:ChemicalEntity rubimaillin A benzochromene that is 2H-benzo[h]chromene which is substituted by two methyl groups at position 2, a methoxycarbonyl group at position 5, and a hydroxy group at position 6. Found in the Chinese medical plant Rubia cordifola, It has an anti-cancer effect by inhibition of TNF-α-induced NF-κB activation. It is also a dual inhibitor of acyl-CoA:cholesterol acyltransferase 1 and 2 (ACAT1 and ACAT2), but is more selective for the ACAT2 isozyme. cas:55481-88-4|pubmed:19652367|pubmed:19716835|pubmed:19765578|pubmed:21077262|pubmed:21236252|pubmed:22997839|pubmed:23000442|pubmed:23065756|pubmed:23318249|pubmed:23466342|pubmed:23738323|pubmed:23845549|pubmed:24887566|pubmed:25310176|pubmed:25636867|pubmed:26126771|pubmed:26681510|pubmed:26697688|pubmed:27258244|pubmed:28933726|pubmed:29027119 Graph methyl 6-hydroxy-2,2-dimethyl-2H-benzo[h]chromene-5-carboxylate|mollugin methyl 6-hydroxy-2,2-dimethyl-2H-benzo[h]chromene-5-carboxylate methyl 6-hydroxy-2,2-dimethyl-2H-benzo[h]chromene-5-carboxylate|mollugin http://purl.obolibrary.org/obo/CHEBI_141063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141129 biolink:ChemicalEntity N(6)-tetradecanoyl-L-lysine residue An α-amino-acid residue derived from N6-tetradecanoyl-L-lysine. Graph N(6)-myristoyl-L-lysine residue|N(6)-tetradecanoyl-L-lysine residue N(6)-myristoyl-L-lysine residue|N(6)-tetradecanoyl-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_141129 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141153 biolink:ChemicalEntity quinone outside inhibitor A mitochondrial cytochrome-bc1 complex inhibitor that acts at the Quinone 'outer' (Qo) binding site of the cytochrome-bc1 complex. wikipedia.en:QoI Graph QOI|QOIs|Qo inhibitor|Qo inhibitors|quinone outside inhibitors QOI|QOIs|Qo inhibitor|Qo inhibitors|quinone outside inhibitors http://purl.obolibrary.org/obo/CHEBI_141153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141211 biolink:ChemicalEntity (R)-3-hydroxyisobutyrate The anion formed by loss of a proton from the carboxy group of (R)-3-hydroxyisobutyric acid; major microspecies at pH 7.3. metacyc.compound:CPD-12176 Graph (2R)-3-hydroxy-2-methylpropanoate|(R)-3-hydroxy-2-methylpropanoate|(R)-3-hydroxy-2-methylpropionate (2R)-3-hydroxy-2-methylpropanoate|(R)-3-hydroxy-2-methylpropanoate|(R)-3-hydroxy-2-methylpropionate http://purl.obolibrary.org/obo/CHEBI_141211 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141212 biolink:ChemicalEntity (R)-methylmalonate semialdehyde 2-methyl-3-oxopropanoate with R configuration at the chiral centre; major microspecies at pH 7.3. metacyc.compound:CPD-12177 Graph (R)-2-methyl-3-oxopropanoate (R)-2-methyl-3-oxopropanoate http://purl.obolibrary.org/obo/CHEBI_141212 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141283 biolink:ChemicalEntity (6E)-nerolidol A nerolidol in which the double bond at position 6 adopts a trans-configuration. agr:IND605928773|agr:IND606979241|bpdb:2114|cas:40716-66-3|chemspider:4447568|foodb.food:FDB021836|knapsack:C00029339|metacyc.compound:E-nerolidol|pubmed:28450026|pubmed:31259712|pubmed:31755290|pubmed:32257238|pubmed:32496135|pubmed:32858427|pubmed:33569782|pubmed:33677497|pubmed:33742746|pubmed:33790242 Graph (6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol|(6E)-nerolidol|(E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol|(E)-nerolidol|trans-nerolidol (6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol (6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol|(6E)-nerolidol|(E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol|(E)-nerolidol|trans-nerolidol http://purl.obolibrary.org/obo/CHEBI_141283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141297 biolink:ChemicalEntity phosphatidylglycerol 32:0 Graph PG 32:0|PG(32:0)|phosphatidylglycerol(32:0) PG 32:0|PG(32:0)|phosphatidylglycerol(32:0) http://purl.obolibrary.org/obo/CHEBI_141297 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141299 biolink:ChemicalEntity phosphatidylglycerol 34:0 Graph PG 34:0|PG(34:0)|phosphatidylglycerol(34:0) PG 34:0|PG(34:0)|phosphatidylglycerol(34:0) http://purl.obolibrary.org/obo/CHEBI_141299 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141346 biolink:ChemicalEntity solabegron A carboxybiphenyl that is [biphenyl]-3-carboxylic acid carrying a (2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)nitrilo group at the 3' position. A selective β3-adrenergic receptor agonist currently in clinical development for the treatment of overactive bladder and irritable bowel syndrome. cas:252920-94-8|drugbank:DB06190|patent:US8642661|pubmed:16640337|pubmed:17026593|pubmed:17626794|pubmed:18372395|pubmed:19786030|pubmed:22695239|pubmed:25557359|pubmed:25689345|pubmed:26954275|reaxys:10484931|wikipedia.en:Solabegron Graph (R)-3'-((2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)ethyl)amino)-(1,1'-biphenyl)-3-carboxylic acid|3'-[(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)amino][biphenyl]-3-carboxylic acid|GW 427353|GW-427353|GW427353|solabegron|solabegronum 3'-[(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)amino][biphenyl]-3-carboxylic acid (R)-3'-((2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)ethyl)amino)-(1,1'-biphenyl)-3-carboxylic acid|3'-[(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)amino][biphenyl]-3-carboxylic acid|GW 427353|GW-427353|GW427353|solabegron|solabegronum http://purl.obolibrary.org/obo/CHEBI_141346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141434 biolink:ChemicalEntity monoacyl-3-O-(beta-D-galactosyl)-sn-glycerol A monogalactosylmonoacylglycerol with the acyl chain at either sn-1 or sn-2. (R1= OH, R2 = acyl or vice versa). Formula: C10H17O9R1 pubmed:15287741 Graph MGMG|an acyl-3-O-(beta-D-galactosyl)-sn-glycerol MGMG|an acyl-3-O-(beta-D-galactosyl)-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_141434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141438 biolink:ChemicalEntity His-Phe A dipeptide obtained by formal condensation of the carboxy group of L-histidine with the amino group of L-phenylalanine. cas:16874-81-0|hmdb:HMDB0028892|pubmed:18343901|pubmed:24354419|reaxys:40775 Graph (2S)-2-{[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino}-3-phenylpropanoic acid|H-F|H-F dipeptide|HF|HF dipeptide|L-histidyl-L-phenylalanine|N-L-histidyl-L-phenylalanine|N-histidyl-phenylalanine|histidine phenylalanine dipeptide|histidylphenylalanine L-histidyl-L-phenylalanine (2S)-2-{[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino}-3-phenylpropanoic acid|H-F|H-F dipeptide|HF|HF dipeptide|L-histidyl-L-phenylalanine|N-L-histidyl-L-phenylalanine|N-histidyl-phenylalanine|histidine phenylalanine dipeptide|histidylphenylalanine http://purl.obolibrary.org/obo/CHEBI_141438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141474 biolink:ChemicalEntity diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate A diester that is diethyl succinate in which position 2 is substituted by a (dimethoxyphosphorothioyl)thio group. reaxys:5381514 Graph diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate http://purl.obolibrary.org/obo/CHEBI_141474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141475 biolink:ChemicalEntity (R)-malathion A diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate that is the R-enantiomer of malathion. Graph (R)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate|diethyl (2R)-2-[(dimethoxyphosphorothioyl)thio]succinate diethyl (2R)-2-[(dimethoxyphosphorothioyl)thio]succinate (R)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate|diethyl (2R)-2-[(dimethoxyphosphorothioyl)thio]succinate http://purl.obolibrary.org/obo/CHEBI_141475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141476 biolink:ChemicalEntity (S)-malathion A diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate that is the S-enantiomer of malathion. reaxys:5381515 Graph (S)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate|diethyl (2S)-2-[(dimethoxyphosphorothioyl)thio]succinate diethyl (2S)-2-[(dimethoxyphosphorothioyl)thio]succinate (S)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate|diethyl (2S)-2-[(dimethoxyphosphorothioyl)thio]succinate http://purl.obolibrary.org/obo/CHEBI_141476 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141486 biolink:ChemicalEntity (2R)-4-(2-ammonio-1-hydroxyethyl)phenol In nature, p-octopamine is believed to exist in only one stereoisomeric form, the L- or [R-(-)] form. pubmed:24654910 Graph (2R)-2-hydroxy-2-(4-hydroxyphenyl)ethan-1-aminium|(R)-octopamine|octopamine|p-octopamine (2R)-2-hydroxy-2-(4-hydroxyphenyl)ethan-1-aminium (2R)-2-hydroxy-2-(4-hydroxyphenyl)ethan-1-aminium|(R)-octopamine|octopamine|p-octopamine http://purl.obolibrary.org/obo/CHEBI_141486 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141487 biolink:ChemicalEntity N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine An aminoquinoline that is 8-aminoquinoline which is substituted by methoxy groups at positions 2 and 6, a methyl group at position 4, and a m-(trifluoromethyl)phenoxy group at position 5, and in which the amino substituent at position 8 is itself substituted by a 5-aminopentan-2-yl group. Graph N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine N(4)-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine http://purl.obolibrary.org/obo/CHEBI_141487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141488 biolink:ChemicalEntity (R)-tafenoquine A N4-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine that has R configuration. Graph http://purl.obolibrary.org/obo/CHEBI_141488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141489 biolink:ChemicalEntity (S)-tafenoquine A N4-{2,6-dimethoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl}pentane-1,4-diamine that has S configuration. Graph http://purl.obolibrary.org/obo/CHEBI_141489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141492 biolink:ChemicalEntity (3S)-3-hydroxy-L-lysine(1+) residue An amino-acid cation residue obtained by protonation of the side-chain amino group of (3S)-3-hydroxy-L-lysine residue residue; major species at pH 7.3. Graph (3S)-3-hydroxy-L-lysine residue (3S)-3-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_141492 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141493 biolink:ChemicalEntity carboxybiphenyl Any member of the class of biphenyls that has one or more carboxy groups attached to the biphenyl skeleton. Graph carboxybiphenyls carboxybiphenyls http://purl.obolibrary.org/obo/CHEBI_141493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141495 biolink:ChemicalEntity 4-hydroxy-L-lysine(1+) residue An amino-acid cation residue obtained by protonation of the side-chain amino group of 4-hydroxy-L-lysine residue residue; major species at pH 7.3. pubmed:24486019 Graph 4-hydroxy-L-lysine residue 4-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_141495 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141496 biolink:ChemicalEntity 4-hydroxy-L-lysine(1+) An α-amino-acid cation obtained by deprotonation of the carboxy group and protonation of the amino groups of 4-hydroxy-L-lysine: major species at pH 7.3. Graph http://purl.obolibrary.org/obo/CHEBI_141496 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141498 biolink:ChemicalEntity hemiaminal ether An organic amino compound that is a hemiaminal in which the hydrogen atom of the hydroxy group has been replaced by an organyl group. General formula: R2C(OR')NR2 ( R ≠ H ). Also known as α-amino ethers. Graph alpha-amino ether|alpha-amino ethers|hemiaminal ethers alpha-amino ether|alpha-amino ethers|hemiaminal ethers http://purl.obolibrary.org/obo/CHEBI_141498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141499 biolink:ChemicalEntity (3S)-3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine(1+) pubmed:27965989 Graph (3S)-3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine (3S)-3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_141499 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141520 biolink:ChemicalEntity imidaprilat A member of the class of imidazolidines that is imidapril in which the ethyl ester group has been hydrolysed to the corresponding acid group. It is the active metabolite of imidapril used to treat hypertension. cas:89371-44-8|kegg.compound:C21519|pubmed:11089901|pubmed:16406270|pubmed:18192036|pubmed:8923331|pubmed:9278890|pubmed:9591932|reaxys:5857382 Graph (4S)-1-methyl-3-{(2S)-2-[N-((1S)-1-carboxy-3-phenylpropyl)amino]propionyl}-2-oxo-imidazolidine-4-carboxylic acid|(4S)-3-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid|imidaprilat|imidaprilate|imidaprilatum (4S)-3-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid (4S)-1-methyl-3-{(2S)-2-[N-((1S)-1-carboxy-3-phenylpropyl)amino]propionyl}-2-oxo-imidazolidine-4-carboxylic acid|(4S)-3-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid|imidaprilat|imidaprilate|imidaprilatum http://purl.obolibrary.org/obo/CHEBI_141520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141521 biolink:ChemicalEntity trandolaprilat A heterobicyclic compound that is trandolapril in which the ethyl ester group has been hydrolysed to the corresponding acid group. It is the active metabolite of the prodrug trandolapril. cas:87679-71-8|chemspider:4576532|drugbank:DB14209|hmdb:HMDB0060583|kegg.compound:C21515|patent:CN101302185|patent:CN101460459|pdb-ccd:X93|pubmed:11409646|pubmed:12736518|pubmed:17117442|pubmed:20488190|pubmed:2478763|pubmed:2551273|pubmed:25864194|pubmed:2847673|pubmed:3383998|pubmed:7527094|pubmed:7527103|pubmed:7531766|pubmed:8258671|pubmed:8396059|reaxys:8875886 Graph (2S,3aR,7aS)-1-((S)-N-((S)-1-carboxy-3-phenylpropyl)alanyl)hexahydro-2-indolinecarboxylic acid|(2S,3aR,7aS)-1-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid|1-(2-((1-carboxy-3-phenylpropyl)amino)-1-oxopropyl)octahydro-1H-indole-2-carboxylic acid|RU 44403|RU-44403|RU44403|trandolapril diacid|trandolaprilat|trandolaprilate|trandolaprilatum (2S,3aR,7aS)-1-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid (2S,3aR,7aS)-1-((S)-N-((S)-1-carboxy-3-phenylpropyl)alanyl)hexahydro-2-indolinecarboxylic acid|(2S,3aR,7aS)-1-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid|1-(2-((1-carboxy-3-phenylpropyl)amino)-1-oxopropyl)octahydro-1H-indole-2-carboxylic acid|RU 44403|RU-44403|RU44403|trandolapril diacid|trandolaprilat|trandolaprilate|trandolaprilatum http://purl.obolibrary.org/obo/CHEBI_141521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141522 biolink:ChemicalEntity spiraprilat An azaspiro compound that is spirapril in which the ethyl ester group has been hydrolysed to the corresponding carboxylic acid group. It is the active metabolite of the angiotensin-converting enzyme (ACE) inhibitor spirapril. cas:83602-05-5|kegg.drug:D03775|pubmed:1384174|pubmed:7505361|pubmed:8061850|pubmed:9269955|reaxys:4275869|wikipedia.en:Spiraprilat Graph (8S)-7-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)-1,4-dithia-7-azaspiro(4.4)nonane-8-carboxylic acid|(8S)-7-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid|7-[N-(1(S)-carboxy-3-phenylpropyl)-S-alanyl]-1,4-dithia-7-azaspiro[4.4]nonane-8(S)-carboxylic acid|Spiraprilate|Spiraprilatum (8S)-7-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid (8S)-7-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)-1,4-dithia-7-azaspiro(4.4)nonane-8-carboxylic acid|(8S)-7-[(2S)-2-{[(1S)-1-carboxy-3-phenylpropyl]amino}propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid|7-[N-(1(S)-carboxy-3-phenylpropyl)-S-alanyl]-1,4-dithia-7-azaspiro[4.4]nonane-8(S)-carboxylic acid|Spiraprilate|Spiraprilatum http://purl.obolibrary.org/obo/CHEBI_141522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141547 biolink:ChemicalEntity desmethyldoxepin A dibenzooxepine resulting from the demethylation of the antidepressant doxepin. It is the active metabolite of doxepin. cas:1225-56-5|hmdb:HMDB0060840|patent:WO2007136741|pubmed:12136371|pubmed:19524381|pubmed:2865592|pubmed:4074620|pubmed:7062243|pubmed:7113722|pubmed:711683|pubmed:9140766|pubmed:9460230|reaxys:1348117|wikipedia.en:Nordoxepin Graph 11-(3-methylamino-propyliden)-dibenzo[b,e]oxepin|3-(6H-dibenz[b,e]oxepin-11-ylidene)-N-methylpropylamine|3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N-methyl-1-propanamine|3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N-methylpropan-1-amine|N-desmethyldoxepin|demethyldoxepin|desmethyldoxepin|desmethyldoxepine|monodesmethyldoxepin|nordoxepin 3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N-methylpropan-1-amine 11-(3-methylamino-propyliden)-dibenzo[b,e]oxepin|3-(6H-dibenz[b,e]oxepin-11-ylidene)-N-methylpropylamine|3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N-methyl-1-propanamine|3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N-methylpropan-1-amine|N-desmethyldoxepin|demethyldoxepin|desmethyldoxepin|desmethyldoxepine|monodesmethyldoxepin|nordoxepin http://purl.obolibrary.org/obo/CHEBI_141547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141552 biolink:ChemicalEntity forasartan A member of the class of pyridines that is pyridine which is substituted at positions 2 and 5 by o-(tetrazol-5-yl)phenyl and (3,5-dibutyl-1,2,4-triazol-1-yl)methyl groups, respectively. It is a nonpeptide antagonist of angiotensin II, type 1 (AT1) receptors, used for the treatment of hypertension. cas:145216-43-9|drugbank:DB01342|hmdb:HMDB0015434|kegg.drug:D04243|pubmed:7505365|pubmed:8981065|pubmed:9156352|pubmed:9194514|reaxys:9361619|wikipedia.en:Forasartan Graph 5-[(3,5-dibutyl-1H-1,2,4-triazol-1-yl)methyl]-2-[2-(1H-tetrazol-5-yl)phenyl]pyridine|SC 52458|SC-52458|forasartan|forasartanum 5-[(3,5-dibutyl-1H-1,2,4-triazol-1-yl)methyl]-2-[2-(1H-tetrazol-5-yl)phenyl]pyridine 5-[(3,5-dibutyl-1H-1,2,4-triazol-1-yl)methyl]-2-[2-(1H-tetrazol-5-yl)phenyl]pyridine|SC 52458|SC-52458|forasartan|forasartanum http://purl.obolibrary.org/obo/CHEBI_141552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141588 biolink:ChemicalEntity phosphatidylethanolamine 36:2 A phosphatidylethanolamine in which the acyl groups at C-1 and C-2 contain 36 carbons in total with 2 double bonds. metacyc.compound:Phosphatidylethanolamines-36-2|pubmed:26707637|pubmed:27002763|pubmed:27162539|pubmed:29852985|pubmed:30007793 Graph PE 36:2|PE(36:2) PE 36:2|PE(36:2) http://purl.obolibrary.org/obo/CHEBI_141588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141589 biolink:ChemicalEntity phosphatidylethanolamine 36:3 A phosphatidylethanolamine in which the acyl groups at C-1 and C-2 contain 36 carbons in total with 3 double bonds. metacyc.compound:Phosphatidylethanolamines-36-3|pubmed:27881988|pubmed:28754302|pubmed:28807032 Graph PE 36:3|PE(36:3)|PE-36:3 PE 36:3|PE(36:3)|PE-36:3 http://purl.obolibrary.org/obo/CHEBI_141589 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141590 biolink:ChemicalEntity phosphatidylethanolamine 38:3 A phosphatidylethanolamine in which the acyl groups at C-1 and C-2 contain 38 carbons in total with 3 double bonds. metacyc.compound:Phosphatidylethanolamines-38-3|pubmed:22546713|pubmed:27907021|pubmed:27976698 Graph PE 38:3|PE(38:3)|PE-38:3 PE 38:3|PE(38:3)|PE-38:3 http://purl.obolibrary.org/obo/CHEBI_141590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141591 biolink:ChemicalEntity PE(18:1_18:1) A phosphatidylethanolamine 36:2 in which both acyl groups have 18 carbons and 1 double bond each (position not specified). Graph PE 18:1_18:1|phosphatidylethanolamine 18:1_18:1|phosphatidylethanolamine(18:1_18:1) PE 18:1_18:1|phosphatidylethanolamine 18:1_18:1|phosphatidylethanolamine(18:1_18:1) http://purl.obolibrary.org/obo/CHEBI_141591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141597 biolink:ChemicalEntity PE(18:0_20:4) A phosphatidylethanolamine 38:4 in which one acyl group has 18 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). pubmed:25676385 Graph PE 18:0_20:4|phosphatidylethanolamine 18:0_20:4|phosphatidylethanolamine(18:0_20:4) PE 18:0_20:4|phosphatidylethanolamine 18:0_20:4|phosphatidylethanolamine(18:0_20:4) http://purl.obolibrary.org/obo/CHEBI_141597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141610 biolink:ChemicalEntity 3-hydroxy-D-kynurenine zwitterion Zwitterionic form of 3-hydroxy-D-kynurenine arising from transfer of a proton from the carboxy to the amino group; major microspecies at pH 7.3 pubmed:21612226 Graph 3-hydroxy-D-kynurenine|D-3HK 3-hydroxy-D-kynurenine|D-3HK http://purl.obolibrary.org/obo/CHEBI_141610 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141634 biolink:ChemicalEntity F420(ox.) A deazaflavin cofactor used by mycobacteria to protect itself from nitrosative damage. The oxidised form needs to be reduced for this use. pubmed:19325122 Graph http://purl.obolibrary.org/obo/CHEBI_141634 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141635 biolink:ChemicalEntity F420(red.) A deazaflavin cofactor in reduced form is used by mycobacteria to protect itself from nitrosative damage. pubmed:19325122 Graph http://purl.obolibrary.org/obo/CHEBI_141635 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141667 biolink:ChemicalEntity (-)-noscapine hemiacetal A lactol that is (−)-noscapine [which is also known as (−)-α-narcotine] in which the carbonyl group of the lactone moiety has been reduced to give the corresponding lactol. It is the biosynthetic precursor of (−)-noscapine. kegg.compound:C20297|metacyc.compound:CPD-14833|pubmed:25485687|pubmed:26369413|pubmed:27634038|pubmed:29723437|reaxys:6547265 Graph (-)-alpha-narcotine hemiacetal|(-)-narcotine hemiacetal|(3S)-6,7-dimethoxy-3-[(5R)-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-1,3-dihydro-2-benzofuran-1-ol|narcotine hemiacetal|noscapine hemiacetal (3S)-6,7-dimethoxy-3-[(5R)-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-1,3-dihydro-2-benzofuran-1-ol (-)-alpha-narcotine hemiacetal|(-)-narcotine hemiacetal|(3S)-6,7-dimethoxy-3-[(5R)-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-1,3-dihydro-2-benzofuran-1-ol|narcotine hemiacetal|noscapine hemiacetal http://purl.obolibrary.org/obo/CHEBI_141667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141668 biolink:ChemicalEntity L-tyrosinal(1+) A primary ammonium ion resulting from the protonation of the amino group of L-tyrosinal. metacyc.compound:CPD-21526|pubmed:23281040 Graph (2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-aminium|(2S)-1-(p-hydroxyphenyl)-3-oxopropan-2-aminium|L-tyrosinal (2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-aminium (2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-aminium|(2S)-1-(p-hydroxyphenyl)-3-oxopropan-2-aminium|L-tyrosinal http://purl.obolibrary.org/obo/CHEBI_141668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141698 biolink:ChemicalEntity L,L-homocystine A homocystine in which both chiral centres have L configuration. cas:626-72-2|foodb.food:FDB022176|hmdb:HMDB0000676|kegg.compound:C01817|metacyc.compound:HOMOCYSTINE|pubmed:12934959|pubmed:14980706|pubmed:16455044|pubmed:2105746|pubmed:22852134|pubmed:5748939|reaxys:1728583|wikipedia.en:Homocystine Graph (2S)-2-amino-4-{[(3S)-3-amino-3-carboxypropyl]disulfanyl}butanoic acid|(2S,2'S)-4,4'-dithiobis(2-aminobutanoic acid)|(2S,2'S)-4,4'-dithiobis(2-aminobutyric acid)|L-4,4'-dithio-bis(2-aminobutanoic acid)|L-4,4'-dithio-bis(2-aminobutyric acid)|L-4,4'-dithiobis(2-aminobutanoic acid)|L-homocystine (2S,2'S)-4,4'-dithiobis(2-aminobutanoic acid) (2S)-2-amino-4-{[(3S)-3-amino-3-carboxypropyl]disulfanyl}butanoic acid|(2S,2'S)-4,4'-dithiobis(2-aminobutanoic acid)|(2S,2'S)-4,4'-dithiobis(2-aminobutyric acid)|L-4,4'-dithio-bis(2-aminobutanoic acid)|L-4,4'-dithio-bis(2-aminobutyric acid)|L-4,4'-dithiobis(2-aminobutanoic acid)|L-homocystine http://purl.obolibrary.org/obo/CHEBI_141698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141748 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) Graph GT2(3-)|a ganglioside GT2|beta-D-GalNAc-(1->4)-[alpha-NeuAc-(2->8)-alpha-NeuAc-(2->8)-alpha-NeuAc-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(3-) GT2(3-)|a ganglioside GT2|beta-D-GalNAc-(1->4)-[alpha-NeuAc-(2->8)-alpha-NeuAc-(2->8)-alpha-NeuAc-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(3-) http://purl.obolibrary.org/obo/CHEBI_141748 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14178 biolink:ChemicalEntity 1D-myo-inositol bis(diphosphate) tetrakisphosphate A 1D-myo-inositol tetrakisphosphate compound of unknown isomeric configuration with diphosphate groups attached at the two remainig vacant positions. metacyc.compound:Bisdiphospho-myo-inositol-polyphosphates Graph diphospho-1D-myo-inositol tetrakisphosphates diphospho-1D-myo-inositol tetrakisphosphates http://purl.obolibrary.org/obo/CHEBI_14178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141782 biolink:ChemicalEntity undec-1-en-1-ol A fatty alcohol 11:1 that is undecanol containing a double bond located at position 1; a minor tautomer of undecanal. cas:25377-71-3|pubmed:21548633|pubmed:30119014 Graph 1-undecen-1-ol|1-undecenol|undec-1-en-1-ol|undecene-1-ol|undecenyl alcohol undec-1-en-1-ol 1-undecen-1-ol|1-undecenol|undec-1-en-1-ol|undecene-1-ol|undecenyl alcohol http://purl.obolibrary.org/obo/CHEBI_141782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141790 biolink:ChemicalEntity 3-hydroxybutane-1,2,3-tricarboxylate A tricarboxylic acid trianion resulting from the deprotonation of all three carboxy groups of 3-hydroxybutane-1,2,3-tricarboxylic acid; major microspecies at pH 7.3. pubmed:28956599 Graph 1-hydroxy-1-methylpropane-1,2,3-tricarboxylate|3-hydroxybutane-1,2,3-tricarboxylate 3-hydroxybutane-1,2,3-tricarboxylate 1-hydroxy-1-methylpropane-1,2,3-tricarboxylate|3-hydroxybutane-1,2,3-tricarboxylate http://purl.obolibrary.org/obo/CHEBI_141790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141817 biolink:ChemicalEntity 5-hydroxy-L-lysinium residue An L-lysinium residue that is substituted by an hydroxy group at position 5; major microspecies at pH 7.3. Graph (2S)-5-hydroxylysine residue|5-hydroxy-L-lysine residue (2S)-5-hydroxylysine residue|5-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_141817 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141828 biolink:ChemicalEntity 3-hydroxy-L-asparagine residue An L-asparagine residue that is substituted by an hydroxy group at position. Graph (2S)-3-hydroxyasparagine residue (2S)-3-hydroxyasparagine residue http://purl.obolibrary.org/obo/CHEBI_141828 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141843 biolink:ChemicalEntity (5S)-5-hydroxy-L-lysinium residue An L-lysinium residue that is substituted by an hydroxy group at position 5 (the 5S stereoisomer); major microspecies at pH 7.3. pubmed:19574390|pubmed:22238144|resid:AA0578 Graph (2S,5S)-5-hydroxylysine residue|(2S,5S)-5-hydroxylysinium residue|(5S)-5-hydroxy-L-lysine residue (2S,5S)-5-hydroxylysine residue|(2S,5S)-5-hydroxylysinium residue|(5S)-5-hydroxy-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_141843 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141847 biolink:ChemicalEntity 5'-end GMP-ribonucleotide(3-) residue pubmed:24548272 Graph 5'-phospho-guanosine-ribonucleotide residue 5'-phospho-guanosine-ribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_141847 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141856 biolink:ChemicalEntity 5'-end NMP-ribonucleotide(3-) residue Graph 5'-phospho-ribonucleoside-ribonucleotide residue 5'-phospho-ribonucleoside-ribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_141856 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:141969 biolink:ChemicalEntity tipifarnib A quinolone that is 1-methylquinolin-2-one which carries a 3-chlorophenyl and an amino(4-chlorophenyl)(1-methyl-imidazol-5-yl)methyl groups at the 4 and 6 positions, respectively (the R-isomer). cas:192185-72-1|drugbank:DB04960|kegg.drug:D03720|pubmed:12065441|pubmed:12769710|pubmed:16101130|pubmed:16885199|pubmed:22209975|pubmed:23672878|pubmed:24500418|pubmed:26323840|pubmed:28395021|pubmed:28988377|pubmed:29374384|pubmed:29760048|reaxys:9734901|wikipedia.en:Tipifarnib Graph (+)-(R)-6-[amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone|(R)-6-(amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone|6-[(R)-amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2(1H)-one|R-115777|R115777|Zarnestra|tipifarnib|tipifarnibum 6-[(R)-amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2(1H)-one (+)-(R)-6-[amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone|(R)-6-(amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl)-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone|6-[(R)-amino(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2(1H)-one|R-115777|R115777|Zarnestra|tipifarnib|tipifarnibum http://purl.obolibrary.org/obo/CHEBI_141969 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141992 biolink:ChemicalEntity 2-hydroxyflavanones Any hydroxyflavanone that has a hydroxy substituent at position 2. metacyc.compound:2-Hydroxyflavanones Graph a 2-hydroxyflavanone a 2-hydroxyflavanone http://purl.obolibrary.org/obo/CHEBI_141992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141994 biolink:ChemicalEntity (2S)-2-hydroxynaringenin A 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one that has (S) configuration. reaxys:2476057 Graph (2S)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-2-hydroxynaringenin|(S)-2-hydroxynaringenin (2S)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one (2S)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-2-hydroxynaringenin|(S)-2-hydroxynaringenin http://purl.obolibrary.org/obo/CHEBI_141994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:141997 biolink:ChemicalEntity hydroxy-L-argininium residue An L-α-argininium residue that is substituted by at least one hydroxy group. Graph hydroxy-L-arginine residue hydroxy-L-arginine residue http://purl.obolibrary.org/obo/CHEBI_141997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142054 biolink:ChemicalEntity 3-hydroxyaspartic acid residue An α-amino-acid residue derived from 3-hydroxyaspartic acid. Graph http://purl.obolibrary.org/obo/CHEBI_142054 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142057 biolink:ChemicalEntity 3-hydroxy-L-aspartic acid residue A 3-hydroxyaspartic acid residue in which the carbon at position 2 has S configuration. Graph http://purl.obolibrary.org/obo/CHEBI_142057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142058 biolink:ChemicalEntity F2-isoprostane Any isoprostane derived from the non-enzymatic, free radical oxidation of arachidonic acid. pubmed:27318521|pubmed:27720037|pubmed:27725001|pubmed:28391180|pubmed:28558917|pubmed:28623974|pubmed:28747487|pubmed:28782688|pubmed:29034829|pubmed:29118462|pubmed:29371434|pubmed:29424490|pubmed:29482768|pubmed:29682163|pubmed:29761879|pubmed:29927677|pubmed:30096434|pubmed:30103922 Graph F2 isoprostane|F2 isoprostanes|F2-isoprostanes F2 isoprostane|F2 isoprostanes|F2-isoprostanes http://purl.obolibrary.org/obo/CHEBI_142058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142077 biolink:ChemicalEntity abediterol A quinolone that is 8-hydroxyquinolin-2(1H)-one which carries a 2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl group at position 5. It is a long acting β2-adrenoceptor agonist currently in development for the treatment of chronic obstructive pulmonary disease (COPD) and asthma. cas:915133-65-2|drugbank:DB12100|kegg.drug:D10219|patent:WO2006122788|pubmed:22588259|pubmed:24989946|pubmed:25256258|pubmed:25398689|pubmed:26656755|pubmed:27439370|pubmed:28971615|pubmed:29183838|reaxys:12781197|wikipedia.en:Abediterol Graph 5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxy-1,2-dihydroquinolin-2-one|5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxyquinolin-2(1H)-one|LAS100977|abediterol|abediterolum 5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxyquinolin-2(1H)-one 5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxy-1,2-dihydroquinolin-2-one|5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxyquinolin-2(1H)-one|LAS100977|abediterol|abediterolum http://purl.obolibrary.org/obo/CHEBI_142077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142094 biolink:ChemicalEntity (S)-S-adenosyl-L-methionine zwitterion An S-adenosyl-L-methionine zwitterion that has S-configuration; major species at pH 7.3. pubmed:3530324 Graph (S)-S-adenosyl-L-methionine|(S,S)-AdoMet|(S,S)-AdoMet zwitterion|(S,S)-S-adenosyl-L-methionine zwitterion (S)-S-adenosyl-L-methionine|(S,S)-AdoMet|(S,S)-AdoMet zwitterion|(S,S)-S-adenosyl-L-methionine zwitterion http://purl.obolibrary.org/obo/CHEBI_142094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142095 biolink:ChemicalEntity sideretin (reduced form) A hydroxycoumarin that is fraxetin which has been substituted by an additional hydroxy group at positions 5. It is the primary molecule exuded by Arabidopsis thaliana roots in response to iron deficiency. pubmed:29581584|reaxys:32703925 Graph 5,7,8-trihydroxy-6-methoxy-2-benzopyrone|5,7,8-trihydroxy-6-methoxy-2H-chromen-2-one|5,7,8-trihydroxy-6-methoxycoumarin|sideretin (reduced form) 5,7,8-trihydroxy-6-methoxy-2H-chromen-2-one 5,7,8-trihydroxy-6-methoxy-2-benzopyrone|5,7,8-trihydroxy-6-methoxy-2H-chromen-2-one|5,7,8-trihydroxy-6-methoxycoumarin|sideretin (reduced form) http://purl.obolibrary.org/obo/CHEBI_142095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142106 biolink:ChemicalEntity 5,6-dihydrouridine 5'-monophosphate(2-) A uridine 5'-phosphate that is the 5,6-dihydro derivative of uridine 5'-monophosphate; major microspecies at pH 7.3 metacyc.compound:A-24-DIOXOTETRAHYDROPYRIMIDINE-D-RIBONU|pubmed:14235538 Graph 5,6-dihydrouridine 5'-phosphate 5,6-dihydrouridine 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_142106 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142118 biolink:ChemicalEntity imidazobenzodiazepine Any organic heterotricyclic compound that is any benzodiazepine which is ortho-fused with a imidazole. Graph imidazobenzodiazepines imidazobenzodiazepines http://purl.obolibrary.org/obo/CHEBI_142118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142138 biolink:ChemicalEntity 4-hydroxy-indole-3-carbonyl nitrile A member of the class of hydroxyindoles that is 1H-indol-4-ol which is substituted by a nitriloacetyl group at the 3 position. Graph 2-(4-hydroxy-1H-indol-3-yl)-2-keto-acetonitrile|2-(4-hydroxy-1H-indol-3-yl)-2-oxoacetonitrile|4-OH-ICN|4-hydroxy-1H-indole-3-carbonyl cyanide|4-hydroxy-alpha-oxo-1H-indole-3-acetonitrile|4-hydroxy-indole-3-carbonyl nitrile 4-hydroxy-1H-indole-3-carbonyl cyanide 2-(4-hydroxy-1H-indol-3-yl)-2-keto-acetonitrile|2-(4-hydroxy-1H-indol-3-yl)-2-oxoacetonitrile|4-OH-ICN|4-hydroxy-1H-indole-3-carbonyl cyanide|4-hydroxy-alpha-oxo-1H-indole-3-acetonitrile|4-hydroxy-indole-3-carbonyl nitrile http://purl.obolibrary.org/obo/CHEBI_142138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142139 biolink:ChemicalEntity indole-3-carbonyl nitrile A member of the class of indoles that is 1H-indole which is substituted by a nitriloacetyl group at the 3 position. pubmed:26352477|pubmed:29576661|reaxys:4988806 Graph 1H-indol-3-yl(oxo)acetonitrile|1H-indole-3-carbonyl cyanide|ICN|indole-3-carbonyl nitrile|indolyl-3-carbonyl nitrile 1H-indole-3-carbonyl cyanide 1H-indol-3-yl(oxo)acetonitrile|1H-indole-3-carbonyl cyanide|ICN|indole-3-carbonyl nitrile|indolyl-3-carbonyl nitrile http://purl.obolibrary.org/obo/CHEBI_142139 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14216 biolink:ChemicalEntity erythrulose 1-phosphate kegg.compound:C03394 Graph 3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|erythrulose 1-(dihydrogen phosphate) 3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|erythrulose 1-(dihydrogen phosphate) 3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|erythrulose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_14216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142163 biolink:ChemicalEntity 24G7 epitope An antigenic epitope recognized by an anti-bilirubin monoclonal antibody designated 24G7. A substructure of bilirubin IXα, it is the region containing the oxo group at C-1, the methyl group at C-2, C-(4, 5, 6, 9), and N-21 and -22. Graph http://purl.obolibrary.org/obo/CHEBI_142163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142183 biolink:ChemicalEntity (2S)-1-(6-chloro-5-fluoroindol-1-yl)-propan-2-amine A 1-(6-chloro-5-fluoroindol-1-yl)-propan-2-amine that has S configuration. A selective agonist for both the 5-hydroxytryptamine 2B (5-HT2B) and 5-hydroxytryptamine 2C (5-HT2C)serotonin receptor subtypes, commonly used as fumarate salt. lincs.smallmolecule:LSM-1601|patent:EP655440|pubmed:10219979|pubmed:10498829|pubmed:10814735|pubmed:10903970|pubmed:11105935|pubmed:11399662|pubmed:12604698|pubmed:14666118|pubmed:17473916|pubmed:17653111|pubmed:22342986|pubmed:23201361|pubmed:23535834|pubmed:28583411|pubmed:9225301|pubmed:9694950|reaxys:7795121|wikipedia.en:Ro60-0175 Graph (1S)-2-(6-chloro-5-fluoroindol-1-yl)-1-methylethylamine|(2S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine|(S)-2-(6-chloro-5-fluoro-indol-1-yl)-1-methyl-ethylamine|(S)-2-(6-chloro-5-fluoroindol-1-yl)-1-methylethylamine|(S)-6-chloro-5-fluoro-alpha-methyl-1H-indole-1-ethanamine|ORG 35030|Ro 60-0175|Ro-60-0175|Ro60-0175 (2S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine (1S)-2-(6-chloro-5-fluoroindol-1-yl)-1-methylethylamine|(2S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine|(S)-2-(6-chloro-5-fluoro-indol-1-yl)-1-methyl-ethylamine|(S)-2-(6-chloro-5-fluoroindol-1-yl)-1-methylethylamine|(S)-6-chloro-5-fluoro-alpha-methyl-1H-indole-1-ethanamine|ORG 35030|Ro 60-0175|Ro-60-0175|Ro60-0175 http://purl.obolibrary.org/obo/CHEBI_142183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142184 biolink:ChemicalEntity 5-hydroxytryptamine 2B receptor agonist An agonist at the 5-hydroxytryptamine 2B (5-HT2B) receptor. Graph 5-HT2B agonist|5-HT2B agonists|5-HT2B receptor agonist|5-HT2B receptor agonists|5-hydroxytryptamine 2B receptor agonists|5-hydroxytryptamine receptor 2B agonist|5-hydroxytryptamine receptor 2B agonists|serotonin receptor 2B agonist|serotonin receptor 2B agonists 5-HT2B agonist|5-HT2B agonists|5-HT2B receptor agonist|5-HT2B receptor agonists|5-hydroxytryptamine 2B receptor agonists|5-hydroxytryptamine receptor 2B agonist|5-hydroxytryptamine receptor 2B agonists|serotonin receptor 2B agonist|serotonin receptor 2B agonists http://purl.obolibrary.org/obo/CHEBI_142184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142185 biolink:ChemicalEntity 5-hydroxytryptamine 2C receptor agonist An agonist at the 5-hydroxytryptamine 2B (5-HT2C) receptor. Graph 5-HT2C receptor agonist|5-HT2C receptor agonists|5-HT2c agonist|5-HT2c agonists|5-hydroxytryptamine 2C receptor agonists|5-hydroxytryptamine receptor 2C agonist|5-hydroxytryptamine receptor 2C agonists|serotonin receptor 2C agonist|serotonin receptor 2C agonists 5-HT2C receptor agonist|5-HT2C receptor agonists|5-HT2c agonist|5-HT2c agonists|5-hydroxytryptamine 2C receptor agonists|5-hydroxytryptamine receptor 2C agonist|5-hydroxytryptamine receptor 2C agonists|serotonin receptor 2C agonist|serotonin receptor 2C agonists http://purl.obolibrary.org/obo/CHEBI_142185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142198 biolink:ChemicalEntity purine 2'-deoxyribonucleoside 5'-phosphate(2-) A 2'-deoxynucleoside 5'-monophosphate(2−) obtained by deprotonation of the phosphate OH groups of 2'-deoxy-purine ribonucleoside 5'-monophosphate; major microspecies at pH 7.3. Graph 2'-deoxy-purine ribonucleoside 5'-phosphate(2-)|2'-deoxypurine ribonucleoside 5'-phosphate(2-)|a purine 2'-deoxyribonucleoside 5'-phosphate 2'-deoxy-purine ribonucleoside 5'-phosphate(2-)|2'-deoxypurine ribonucleoside 5'-phosphate(2-)|a purine 2'-deoxyribonucleoside 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_142198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142209 biolink:ChemicalEntity pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2-) A pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2−) obtained by deprotonation of the phosphate OH groups of pyrimidine 2'-deoxyribonucleoside 5'-phosphate; major microspecies at pH 7.3. Graph a pyrimidine 2'-deoxyribonucleoside 5'-phosphate a pyrimidine 2'-deoxyribonucleoside 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_142209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142229 biolink:ChemicalEntity (2R)-2-hydroxynaringenin A 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one that has (R) configuration. reaxys:33237761 Graph (2R)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2R)-2-hydroxynaringenin|(R)-2-hydroxynaringenin (2R)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one (2R)-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2R)-2-hydroxynaringenin|(R)-2-hydroxynaringenin http://purl.obolibrary.org/obo/CHEBI_142229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142230 biolink:ChemicalEntity 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one A tetrahydroxyflavanone carrying the hydroxy groups at positions 2, 4', 5 and 7. hmdb:HMDB0040314|metacyc.compound:CPD-15074|pubmed:17661332|pubmed:20007684|pubmed:21139272|pubmed:22822204|pubmed:24859082|pubmed:28370711|reaxys:7254315 Graph 2,3-dihydro-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|2,4',5,7-tetrahydroxyflavanone|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-3H-1-benzopyran-4-one|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-3H-chromen-4-one|2-hydroxynaringenin 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one 2,3-dihydro-2,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|2,4',5,7-tetrahydroxyflavanone|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-3H-1-benzopyran-4-one|2,5,7-trihydroxy-2-(4-hydroxyphenyl)-3H-chromen-4-one|2-hydroxynaringenin http://purl.obolibrary.org/obo/CHEBI_142230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142235 biolink:ChemicalEntity Se-L-selenocysteine-S-L-cysteine residue metacyc.compound:Oxidized-PrdC-Proteins Graph Se-L-selenocysteine-S-L-cysteine residue Se-L-selenocysteine-S-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_142235 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142261 biolink:ChemicalEntity ganoderol B A tetracyclic triterpenoid that is lanosta-7,9(11),24-triene which is substituted by hydroxy groups at positions 3 and 27. It has been isolated from several Ganoderma species. cas:104700-96-1|foodb.food:FDB013983|hmdb:HMDB0035314|knapsack:C00023868|pubmed:11908995|pubmed:12628419|pubmed:17313101|pubmed:17499997|pubmed:21596546|pubmed:23790868|pubmed:28875673|pubmed:28912878|pubmed:29748985 Graph (+)-ganoderol B|(3beta,24E)-lanosta-7,9(11),24-triene-3,26-diol|ganodermadiol|ganoderol B (3beta,24E)-lanosta-7,9(11),24-triene-3,26-diol (+)-ganoderol B|(3beta,24E)-lanosta-7,9(11),24-triene-3,26-diol|ganodermadiol|ganoderol B http://purl.obolibrary.org/obo/CHEBI_142261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142279 biolink:ChemicalEntity sesquiterpene phytoalexin A class of sesquterpenoids formed in plants in response to fungal infection, physical damage, chemical injury, or a pathogenic process. Graph sesquiterpene phytoalexins sesquiterpene phytoalexins http://purl.obolibrary.org/obo/CHEBI_142279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142348 biolink:ChemicalEntity hexahydronaphthalenes Any carbobycyclic compound that is an hexahydronaphthalene or a compound obtained from an hexahydronaphthalene by formal substitution of one or more hydrogens. Graph http://purl.obolibrary.org/obo/CHEBI_142348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142355 biolink:ChemicalEntity purines D-ribonucleoside A purine ribonucleoside that is a purine derivative attached to a β-D-ribofuranosyl residue at position 9 via a glycosidic (N-glycosyl) linkage. Graph a purine D-ribonucleoside a purine D-ribonucleoside http://purl.obolibrary.org/obo/CHEBI_142355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142361 biolink:ChemicalEntity purines 2'-deoxy-D-ribonucleoside A purine derivative attached to a β-D-2'-deoxy-ribofuranosyl residue at position 9 via a glycosidic (N-glycosyl) linkage. Graph a purine 2'-deoxy-D-ribonucleoside a purine 2'-deoxy-D-ribonucleoside http://purl.obolibrary.org/obo/CHEBI_142361 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142379 biolink:ChemicalEntity Cer(d37:1) Graph Cer d37:1 Cer d37:1 http://purl.obolibrary.org/obo/CHEBI_142379 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142389 biolink:ChemicalEntity trans-feruloylacetyl-CoA(4-) A feruloylacetyl-CoA(4−) in which the C=C double bond of the feruloyl group has trans configuration. metacyc.compound:CPD-12180 Graph (E)-feruloylacetyl-CoA (E)-feruloylacetyl-CoA http://purl.obolibrary.org/obo/CHEBI_142389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142398 biolink:ChemicalEntity trans-2,4-dihydroxy-cinnamoyl-CoA(4-) metacyc.compound:CPD-14010 Graph (E)-2,4-dihydroxycinnamoyl-CoA (E)-2,4-dihydroxycinnamoyl-CoA http://purl.obolibrary.org/obo/CHEBI_142398 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142406 biolink:ChemicalEntity omega-conotoxin MVIIA A heterodetic cyclic polypeptide consisting of the linear sequence Cys-Lys-Gly-Lys-Gly-Ala-Lys-Cys-Ser-Arg-Leu-Met-Tyr-Asp-Cys-Cys-Thr-Gly-Ser-Cys-Arg-Ser-Gly-Lys-Cys-NH2 with three disulfide bridges between cysteine residues 1-16, 8-20 and 15-25. A neuronal N-type Ca2+ channel blocker in mammalian and amphibian brain, it blocks release of GABA and glutamate at neuronal synapses. Used as a probe for calcium channel receptors, it is selective for different receptor subtypes. A synthetic form, named ziconotide, is an atypical analgesic agent for the amelioration of severe and chronic pain. cas:107452-89-1|drugcentral:2878|pubmed:16503054|pubmed:17207931|pubmed:24397285|pubmed:26662374|pubmed:26861472|pubmed:28648727|pubmed:29440821|pubmed:29635804|pubmed:30137539|pubmed:30206508 Graph SNX-111|omega-Conopeptide MVIIA (Conus)|ziconotide SNX-111|omega-Conopeptide MVIIA (Conus)|ziconotide http://purl.obolibrary.org/obo/CHEBI_142406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142409 biolink:ChemicalEntity S-alkyl-L-cysteine S-oxide zwitterion An amino acid zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of any S-alkyl-L-cysteine S-oxide; major microspecies at pH 7.3. kegg.compound:C03726|metacyc.compound:S-Alkyl-L-Cysteine-S-Oxides Graph an S-alkyl-L-cysteine S-oxide an S-alkyl-L-cysteine S-oxide http://purl.obolibrary.org/obo/CHEBI_142409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142410 biolink:ChemicalEntity guanosine 3'-diphosphate 5'-triphosphate hexaanion A ribonucleoside triphosphate oxoanion that is the hexaanion of guanosine 3'-diphosphate 5'-triphosphate; major species at pH 7.3. Graph 3'-O-{[(hydroxyphosphinato)oxy]phosphinato}-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)guanosine|guanosine 3'-diphosphate 5'-triphosphate|guanosine 3'-diphosphate 5'-triphosphate hexaanion|guanosine 3'-diphosphate 5'-triphosphate(6-) 3'-O-{[(hydroxyphosphinato)oxy]phosphinato}-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)guanosine 3'-O-{[(hydroxyphosphinato)oxy]phosphinato}-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)guanosine|guanosine 3'-diphosphate 5'-triphosphate|guanosine 3'-diphosphate 5'-triphosphate hexaanion|guanosine 3'-diphosphate 5'-triphosphate(6-) http://purl.obolibrary.org/obo/CHEBI_142410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142418 biolink:ChemicalEntity vibegron A pyrrolopyrimidine obtained by formal condensation of the carboxy group of (6S)-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid with the amino group of (R)-[(2R,5S)-5-(4-aminobenzyl)pyrrolidin-2-yl](phenyl)methanol. It is a β3-adrenergic receptor agonist currently in clinical development for the treatment of patients with overactive bladder. cas:1190389-15-1|kegg.drug:D10433|pubmed:26709102|pubmed:27965369|pubmed:29366513|pubmed:29752752|reaxys:19541234 Graph (6S)-N-[4-({(2S,5R)-5-[(R)-hydroxy(phenyl)methyl]pyrrolidin-2-yl}methyl)phenyl]-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxamide|Beova|MK-4618|vibegron|vibegronum (6S)-N-[4-({(2S,5R)-5-[(R)-hydroxy(phenyl)methyl]pyrrolidin-2-yl}methyl)phenyl]-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxamide (6S)-N-[4-({(2S,5R)-5-[(R)-hydroxy(phenyl)methyl]pyrrolidin-2-yl}methyl)phenyl]-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxamide|Beova|MK-4618|vibegron|vibegronum http://purl.obolibrary.org/obo/CHEBI_142418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142422 biolink:ChemicalEntity gamma-carboxy-L-glutamate(3-) A tricarboxylic acid trianion obtained by the deprotonation of the three carboxy groups of γ-carboxy-L-glutamic acid. Graph (3S)-3-aminopropane-1,1,3-tricarboxylate (3S)-3-aminopropane-1,1,3-tricarboxylate (3S)-3-aminopropane-1,1,3-tricarboxylate http://purl.obolibrary.org/obo/CHEBI_142422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142430 biolink:ChemicalEntity lificiguat A member of the class of indazoles that is 1H-indazole which is substituted by a benzyl group at position 1 and a 5-(hydroxymethyl)-2-furyl group at position 3. It is an activator of soluble guanylate cyclase and inhibits platelet aggregation. cas:170632-47-0|pubmed:10369473|pubmed:11687640|pubmed:20513359|pubmed:21665942|pubmed:24265542|pubmed:27498367|pubmed:27938560|pubmed:28978999|pubmed:28983668|pubmed:29156788|pubmed:29441848|pubmed:29512783|pubmed:30250592|pubmed:7527671|pubmed:9059849|pubmed:9443939|reaxys:8006642 Graph 1-benzyl-3-(5-hydroxymethyl-2-furyl)indazole|3-(5'-hydroxymethyl-2'-furyl)-1-benzylindazole|YC-1|[5-(1-benzyl-1H-indazol-3-yl)-2-furyl]methanol|lificiguat|lificiguatum [5-(1-benzyl-1H-indazol-3-yl)-2-furyl]methanol 1-benzyl-3-(5-hydroxymethyl-2-furyl)indazole|3-(5'-hydroxymethyl-2'-furyl)-1-benzylindazole|YC-1|[5-(1-benzyl-1H-indazol-3-yl)-2-furyl]methanol|lificiguat|lificiguatum http://purl.obolibrary.org/obo/CHEBI_142430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142431 biolink:ChemicalEntity praliciguat A member of the class of pyrazoles that is 5-fluoro-2-(1H-pyrazol-3-yl)pyrimidine which is substituted by a 2-fluorobenzyl group at position 1, 1,2-oxazol-3-yl group at position 5, and by a [3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]nitrilo group at position 4. It is a soluble guanylate cyclase stimulator under clinical development for the treatment of heart failure with preserved ejection fraction. cas:1628730-49-3|patent:WO2014144100|patent:WO2017095697|pubmed:29281143|pubmed:29643251|reaxys:27468841 Graph 1,1,1,3,3,3-hexafluoro-2-[({5-fluoro-2-[1-(2-fluorobenzyl)-5-(1,2-oxazol-3-yl)-1H-pyrazol-3-yl]pyrimidin-4-yl}amino)methyl]propan-2-ol|IW-1973|praliciguat|praliciguatum 1,1,1,3,3,3-hexafluoro-2-[({5-fluoro-2-[1-(2-fluorobenzyl)-5-(1,2-oxazol-3-yl)-1H-pyrazol-3-yl]pyrimidin-4-yl}amino)methyl]propan-2-ol 1,1,1,3,3,3-hexafluoro-2-[({5-fluoro-2-[1-(2-fluorobenzyl)-5-(1,2-oxazol-3-yl)-1H-pyrazol-3-yl]pyrimidin-4-yl}amino)methyl]propan-2-ol|IW-1973|praliciguat|praliciguatum http://purl.obolibrary.org/obo/CHEBI_142431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142432 biolink:ChemicalEntity vericiguat A pyrazolopyridine that is 5-fluoro-1H-pyrazolo[3,4-b]pyridine in which the amino hydrogen at position 1 has been substituted by a 2-fluorobenzyl group and the hydrogen at position 3 has been substituted by a 4,6-diamino-5-[(methoxycarbonyl)amino]pyrimidin-2-yl group. It is a soluble guanylate cyclase stimulator which is used for treatment of chronic heart failure. cas:1350653-20-1|kegg.drug:D11051|patent:US2012022084|pmc:PMC4565100|pubmed:24092345|pubmed:25056511|pubmed:25737289|pubmed:26547357|pubmed:28369340|pubmed:28557445|pubmed:29032136|reaxys:22098890 Graph BAY-1021189|BAY1021189|MK-1242|methyl N-[4,6-diamino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl]carbamate|methyl {4,6-diamino-2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}carbamate|vericiguat|vericiguatum methyl {4,6-diamino-2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}carbamate BAY-1021189|BAY1021189|MK-1242|methyl N-[4,6-diamino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl]carbamate|methyl {4,6-diamino-2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}carbamate|vericiguat|vericiguatum http://purl.obolibrary.org/obo/CHEBI_142432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142433 biolink:ChemicalEntity cinaciguat A benzoic acid that is 4-(aminomethyl)benzoic acid in which the amino group is substituted by 4-carboxybutyl and 2-(2-{[4-(2-phenylethyl)benzyl]oxy}phenyl)ethyl groups. It is a soluble guanylate cyclase activator, used for the treatment of acute decompensated heart failure. cas:329773-35-5|kegg.drug:D07577|patent:US2012010292|pdb-ccd:Z90|pubmed:18779378|pubmed:20067336|pubmed:20463019|pubmed:20730699|pubmed:21856817|pubmed:21868716|pubmed:22474005|pubmed:22713287|pubmed:23144773|pubmed:24090476|pubmed:25200007|pubmed:26520063|pubmed:27122537|pubmed:27853261|pubmed:28894114|pubmed:29138269|pubmed:29653192|reaxys:9676935|wikipedia.en:Cinaciguat Graph 4-({(4-carboxybutyl)[2-(2-{[4-(2-phenylethyl)benzyl]oxy}phenyl)ethyl]amino}methyl)benzoic acid|BAY 58-2667|BAY582667|cinaciguat|cinaciguatum 4-({(4-carboxybutyl)[2-(2-{[4-(2-phenylethyl)benzyl]oxy}phenyl)ethyl]amino}methyl)benzoic acid 4-({(4-carboxybutyl)[2-(2-{[4-(2-phenylethyl)benzyl]oxy}phenyl)ethyl]amino}methyl)benzoic acid|BAY 58-2667|BAY582667|cinaciguat|cinaciguatum http://purl.obolibrary.org/obo/CHEBI_142433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142435 biolink:ChemicalEntity BAY 41-2272 A pyrazolopyridine that is 1H-pyrazolo[3,4-b]pyridine which is substituted by a 2-fluorobenzyl group at position 1 and by a 4-amino-5-cyclopropylpyrimidin-2-yl group at position 3. It is an activator of soluble guanylate cyclase. cas:256376-24-6|patent:US6833364|pubmed:11242081|pubmed:19188837|pubmed:20828552|pubmed:20977455|pubmed:21825001|pubmed:22044316|pubmed:22575520|pubmed:22634166|pubmed:24231204|pubmed:25230878|pubmed:25740897|pubmed:25742266|pubmed:26760319|pubmed:26873974|pubmed:27131967|pubmed:27895434|pubmed:29461815|reaxys:8867995 Graph 5-cyclopropyl-2-(1-((2-fluorophenyl)methyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)-4-pyrimidinamine|5-cyclopropyl-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-4-amine|BAY 41-2272|BAY-41-2272|BAY-412272 5-cyclopropyl-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-4-amine 5-cyclopropyl-2-(1-((2-fluorophenyl)methyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)-4-pyrimidinamine|5-cyclopropyl-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-4-amine|BAY 41-2272|BAY-41-2272|BAY-412272 http://purl.obolibrary.org/obo/CHEBI_142435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142437 biolink:ChemicalEntity lepirudin A heterodetic cyclic peptide composed of 65 amino acids joined in sequence and cyclised by three disulfide bridges between cysteine residues 6-14, 16-28 and 22-39. It is a highly specific inhibitor of thrombin and used as an anticoagulant in patients with heparin-induced thrombocytopenia. cas:138068-37-8|drugbank:DB00001|drugcentral:2995|kegg.drug:D06880|pubmed:15280202|pubmed:19707378|pubmed:22234363|pubmed:28600720|pubmed:29426286|pubmed:8211886|wikipedia.en:Lepirudin Graph 1-Leu-2-Thr-63-desulfohirudin|H-Leu-Thr-Tyr-Thr-Asp-Cys(1)-Thr-Glu-Ser-Gly-Gln-Asn-Leu-Cys(1)-Leu-Cys(2)-Glu-Gly-Ser-Asn-Val-Cys(3)-Gly-Gln-Gly-Asn-Lys-Cys(2)-Ile-Leu-Gly-Ser-Asp-Gly-Glu-Lys-Asn-Gln-Cys(3)-Val-Thr-Gly-Glu-Gly-Thr-Pro-Lys-Pro-Gln-Ser-His-Asn-Asp-Gly-Asp-Phe-Glu-Glu-Ile-Pro-Glu-Glu-Tyr-Leu-Gln-OH|Hbw 023|Hbw-023|L-leucyl-L-threonyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide)|LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ|LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ (disulfide bridge: 6->14; 16->28; 22->39)|NH2-LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ-OH|Refludan|[Leu1, Thr2]-63-desulfohirudin|hirudin variant-1|lepirudin|lepirudin (rDNA)|lepirudin recombinant L-leucyl-L-threonyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide) 1-Leu-2-Thr-63-desulfohirudin|H-Leu-Thr-Tyr-Thr-Asp-Cys(1)-Thr-Glu-Ser-Gly-Gln-Asn-Leu-Cys(1)-Leu-Cys(2)-Glu-Gly-Ser-Asn-Val-Cys(3)-Gly-Gln-Gly-Asn-Lys-Cys(2)-Ile-Leu-Gly-Ser-Asp-Gly-Glu-Lys-Asn-Gln-Cys(3)-Val-Thr-Gly-Glu-Gly-Thr-Pro-Lys-Pro-Gln-Ser-His-Asn-Asp-Gly-Asp-Phe-Glu-Glu-Ile-Pro-Glu-Glu-Tyr-Leu-Gln-OH|Hbw 023|Hbw-023|L-leucyl-L-threonyl-L-tyrosyl-L-threonyl-L-alpha-aspartyl-L-cysteinyl-L-threonyl-L-alpha-glutamyl-L-seryl-glycyl-L-glutaminyl-L-asparagyl-L-leucyl-L-cysteinyl-L-leucyl-L-cysteinyl-L-alpha-glutamyl-glycyl-L-seryl-L-asparagyl-L-valyl-L-cysteinyl-glycyl-L-glutaminyl-glycyl-L-asparagyl-L-lysyl-L-cysteinyl-L-isoleucyl-L-leucyl-glycyl-L-seryl-L-alpha-aspartyl-glycyl-L-alpha-glutamyl-L-lysyl-L-asparagyl-L-glutaminyl-L-cysteinyl-L-valyl-L-threonyl-glycyl-L-alpha-glutamyl-glycyl-L-threonyl-L-prolyl-L-lysyl-L-prolyl-L-glutaminyl-L-seryl-L-histidyl-L-asparagyl-L-alpha-aspartyl-glycyl-L-alpha-aspartyl-L-phenylalanyl-L-alpha-glutamyl-L-alpha-glutamyl-L-isoleucyl-L-prolyl-L-alpha-glutamyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-glutamine (6->14),(16->28),(22->39)-tris(disulfide)|LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ|LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ (disulfide bridge: 6->14; 16->28; 22->39)|NH2-LTYTDCTESGQNLCLCEGSNVCGQGNKCILGSDGEKNQCVTGEGTPKPQSHNDGDFEEIPEEYLQ-OH|Refludan|[Leu1, Thr2]-63-desulfohirudin|hirudin variant-1|lepirudin|lepirudin (rDNA)|lepirudin recombinant http://purl.obolibrary.org/obo/CHEBI_142437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142452 biolink:ChemicalEntity dabuzalgron A sulfonamide that is N-phenylmethanesulfonamide which carries a chloro group at position 2, 4,5-dihydro-1H-imidazol-2-ylmethoxy group at position 5, and a methyl group at position 6. Its is a selective α-adrenoceptor agonist that is used in the treatment of urinary incontinence. cas:219311-44-1|patent:EP0887346|pubmed:14678373|pubmed:14678390|pubmed:15142177|pubmed:15180647|pubmed:24024968|pubmed:28286875|reaxys:13257747 Graph N-[6-chloro-3-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-2-methylphenyl]methanesulfonamide|Ro 115-1240|dabuzalgron|dabuzalgronum N-[6-chloro-3-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-2-methylphenyl]methanesulfonamide N-[6-chloro-3-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-2-methylphenyl]methanesulfonamide|Ro 115-1240|dabuzalgron|dabuzalgronum http://purl.obolibrary.org/obo/CHEBI_142452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142460 biolink:ChemicalEntity alpha-D-Glcp-(1->2)-D-Glcp A glycosylglucose in which an α-D-glucopyranose residue is linked to a D-glucopyranose residue by a (1→2) glycosidic bond. glytoucan:G20742IJ|kegg.compound:C15548|metacyc.compound:CPD-16569|pubmed:24391053|pubmed:26344377|pubmed:28664731|pubmed:29448943|pubmed:29684280|pubmed:30807133 Graph 2-O-alpha-D-glucopyranosyl-D-glucopyranose|alpha-D-Glc-(1->2)-D-Glc|alpha-D-glucopyranosyl-(1->2)-D-glucopyranose|alpha-D-glucosyl-(1->2)-D-glucose|kojibiose 2-O-alpha-D-glucopyranosyl-D-glucopyranose|alpha-D-Glc-(1->2)-D-Glc|alpha-D-glucopyranosyl-(1->2)-D-glucopyranose|alpha-D-glucosyl-(1->2)-D-glucose|kojibiose http://purl.obolibrary.org/obo/CHEBI_142460 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142464 biolink:ChemicalEntity 8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate metacyc.compound:CPD-16701|pubmed:29086444|pubmed:29758164 Graph 8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate 8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate http://purl.obolibrary.org/obo/CHEBI_142464 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142482 biolink:ChemicalEntity 3'-hydro-2'-hydroxy-beta-oxodihydrochalcone The closest compound in MetaCyc is Open-tautomer-2-hydroxyflavanones, but this compound includes two additional OH groups Graph a 3'-hydro-2'-hydroxy-beta-oxodihydrochalcone a 3'-hydro-2'-hydroxy-beta-oxodihydrochalcone http://purl.obolibrary.org/obo/CHEBI_142482 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142483 biolink:ChemicalEntity 3'-(beta-D-glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone The closest compound in MetaCyc is '3-C-gluc-tautomer-2-hydroxyflavanones', but this compound includes two additional OH groups Graph a 3'-(beta-D-glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone a 3'-(beta-D-glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone http://purl.obolibrary.org/obo/CHEBI_142483 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142508 biolink:ChemicalEntity beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group A tetrasaccharide β-D-glucosyl group obtained by removal of the hydroxy group from the hemiacetal function of β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucose. pubmed:7691279 Graph Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta-R|beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta-R|beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl http://purl.obolibrary.org/obo/CHEBI_142508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142510 biolink:ChemicalEntity isonocardicin A zwitterion An L-α-amino acid zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of isonocardicin A. Graph (2S)-2-ammonio-4-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenoxy}butanoate (2S)-2-ammonio-4-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenoxy}butanoate (2S)-2-ammonio-4-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenoxy}butanoate http://purl.obolibrary.org/obo/CHEBI_142510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142512 biolink:ChemicalEntity poly[(1''->2')-ADP-alpha-D-ribose] pubmed:21498885 Graph [(1''->2')-ADP-alpha-D-ribose]n [(1''->2')-ADP-alpha-D-ribose]n http://purl.obolibrary.org/obo/CHEBI_142512 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142513 biolink:ChemicalEntity oxime anion A organic ion resulting from the deprotonation of the hydroxy group of any oxime. Graph oximate|oximates|oxime anion|oxime anions oximate|oximates|oxime anion|oxime anions http://purl.obolibrary.org/obo/CHEBI_142513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142514 biolink:ChemicalEntity ->8)-alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-yl group An organic group forming part of, and a proposed epitope within, ganglioside GM1. The →8) linkage to Neu5Ac may represent an additional α2→8-linked sialic acid residue, while the -(1→4)-yl may represent -(1→4)-glucosyl. pubmed:7691279 Graph "->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-glycosyl|->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosyl-(1->4)]-beta-D-galactosyl-(1->4)-yl|Galbeta1-3GalNAcbeta1-4(R'-NeuAcalpha2-3)Galbeta1-4-R""|R'-alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-R""" ->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-glycosyl "->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-glycosyl|->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosyl-(1->4)]-beta-D-galactosyl-(1->4)-yl|Galbeta1-3GalNAcbeta1-4(R'-NeuAcalpha2-3)Galbeta1-4-R""|R'-alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-R""" http://purl.obolibrary.org/obo/CHEBI_142514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142515 biolink:ChemicalEntity 6-N-(ADP-D-ribosyl)-L-lysinium(1-) residue An organic anionic group derived from 6-N-(ADP-D-ribosyl)-L-lysine residue. pubmed:25043379 Graph N(6)-(ADP-D-ribosyl)-L-lysine residue N(6)-(ADP-D-ribosyl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_142515 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142517 biolink:ChemicalEntity tschimganine A benzoate ester resulting from the formal condensation of the carboxy group of vanillic acid with the hydroxy group of (−)-borneol. A metabolite isolated from Ferula dissecta. pubmed:20350297|pubmed:21589808|pubmed:23521895|pubmed:29900664|pubmed:29912155|pubmed:35416247|reaxys:26876325 Graph (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 4-hydroxy-3-methoxybenzoate|chimganin|tschimganin|tschimganine (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 4-hydroxy-3-methoxybenzoate (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 4-hydroxy-3-methoxybenzoate|chimganin|tschimganin|tschimganine http://purl.obolibrary.org/obo/CHEBI_142517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142518 biolink:ChemicalEntity beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group A trisaccharide β-D-glucosyl group consisting of N-acetyl-β-D-galactosaminyl, β-D-galactosyl, and (at the reducing end) β-D-glucosyl residues connected via (1→4) linkages. pubmed:7691279 Graph 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|GalNAcbeta1-4Galbeta1-4Glcbeta-R|N-acetyl-beta-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|GalNAcbeta1-4Galbeta1-4Glcbeta-R|N-acetyl-beta-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl http://purl.obolibrary.org/obo/CHEBI_142518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142522 biolink:ChemicalEntity beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-R group An organic group forming part of, and a proposed epitope within, ganglioside GD2. The -(1→4)-R in the name may represent -(1→4)-glucosyl. pubmed:7691279 Graph 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)]-beta-D-galactopyranosyl-(1->4)-R|GalNacbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4-R|GalNacbeta1->-4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4-R|N-acetyl-beta-D-galactosaminyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)]-beta-D-galactosyl-(1->4)-R|N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-R|beta-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)]-beta-Galp-(1->4)-R 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)]-beta-D-galactopyranosyl-(1->4)-R 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)]-beta-D-galactopyranosyl-(1->4)-R|GalNacbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4-R|GalNacbeta1->-4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4-R|N-acetyl-beta-D-galactosaminyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulosyl-(2->3)]-beta-D-galactosyl-(1->4)-R|N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-R|beta-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)]-beta-Galp-(1->4)-R http://purl.obolibrary.org/obo/CHEBI_142522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142525 biolink:ChemicalEntity 3-hydroxybutane-1,2,3-tricarboxylic acid A tricarboxylic acid that is butan-2-ol in which a hydrogen from each of positions 2, 3, and 4 has been replaced by carboxy groups. reaxys:1712822 Graph 3-carboxy-2,3-dideoxy-4-C-methylpentaric acid|3-hydroxybutane-1,2,3-tricarboxylic acid|alpha-methylisocitric acid 3-hydroxybutane-1,2,3-tricarboxylic acid 3-carboxy-2,3-dideoxy-4-C-methylpentaric acid|3-hydroxybutane-1,2,3-tricarboxylic acid|alpha-methylisocitric acid http://purl.obolibrary.org/obo/CHEBI_142525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142527 biolink:ChemicalEntity ajmalicine(1+) An ammonium ion resulting from the protonation of the tertiary amino group of ajmalicine. The major species at pH 7.3. Graph (19alpha)-16-(methoxycarbonyl)-19-methyl-16,17-didehydro-18-oxayohimban-4-ium|ajmalicine (19alpha)-16-(methoxycarbonyl)-19-methyl-16,17-didehydro-18-oxayohimban-4-ium (19alpha)-16-(methoxycarbonyl)-19-methyl-16,17-didehydro-18-oxayohimban-4-ium|ajmalicine http://purl.obolibrary.org/obo/CHEBI_142527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142531 biolink:ChemicalEntity serpentine(1+) An organic cation that is the conjugate acid of serpentine. It is the major species at pH 7.3. Graph serpentine serpentine http://purl.obolibrary.org/obo/CHEBI_142531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142532 biolink:ChemicalEntity alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group A tetrasaccharide β-D-glucosyl group obtained by removing the hydroxy group from the hemiacetal function of α-N-acetylneuraminyl-(2→8)-α-N-acetylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucose. Part of (and a proposed epitope within) gangliosides GD1b, GD2, GD3, GT1band GQ1b. pubmed:7691279 Graph 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta-R|alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|N-acetyl-alpha-neuraminyl-(2->8)-N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta-R|alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-yl http://purl.obolibrary.org/obo/CHEBI_142532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142533 biolink:ChemicalEntity ->4)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group An organic group forming part of, and a proposed epitope within, globoside GM1. pubmed:7691279 Graph ->4)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl|->4)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group|->4)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosylp-(1->4)-beta-D-glucopyranosyl|->4)-alpha-D-galactosyl-(1->4)-beta-D-galactosylp-(1->4)-beta-D-glucosyl ->4)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosylp-(1->4)-beta-D-glucopyranosyl ->4)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl|->4)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group|->4)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosylp-(1->4)-beta-D-glucopyranosyl|->4)-alpha-D-galactosyl-(1->4)-beta-D-galactosylp-(1->4)-beta-D-glucosyl http://purl.obolibrary.org/obo/CHEBI_142533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142540 biolink:ChemicalEntity 5-O-(ADP-D-ribosyl)-L-glutamate(2-) residue An organic anionic group derived from 5-O-(ADP-D-ribosyl)-L-glutamate residue pubmed:25043379 Graph 5-O-(ADP-D-ribosyl)-L-glutamate residue 5-O-(ADP-D-ribosyl)-L-glutamate residue http://purl.obolibrary.org/obo/CHEBI_142540 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142544 biolink:ChemicalEntity tamsulosin(1+) A secondary ammonium ion resulting from the protonation of the secondary amino group of tamsulosin. The major species at pH 7.3. Graph (2R)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium (2R)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium (2R)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium http://purl.obolibrary.org/obo/CHEBI_142544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142546 biolink:ChemicalEntity 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide A secondary amino compound that is ammonia in which nitrogen is substituted by a 1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl group and a 2-(2-ethoxyphenoxy)ethyl group. pubmed:2891044 Graph 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide|5-(2-{[2-(o-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide|5-(2-{[2-(o-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide http://purl.obolibrary.org/obo/CHEBI_142546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142548 biolink:ChemicalEntity ent-tamsulosin A 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide that has (S)-configuration. The enantiomer of tamsulosin. cas:106138-88-9|pubmed:2891044|reaxys:6896058 Graph (+)-tamsulosin|(S)-(+)-tamsulosin|(S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide|(S)-tamsulosin (+)-tamsulosin|(S)-(+)-tamsulosin|(S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide|(S)-tamsulosin http://purl.obolibrary.org/obo/CHEBI_142548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142549 biolink:ChemicalEntity ent-tamsulosin(1+) A secondary ammonium ion resulting from the secondary amino group of ent-tamsulosin. The major species at pH 7.3. Graph (+)-tamsulosin(1+)|(2S)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium|(S)-(+)-tamsulosin(1+)|(S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide(1+)|(S)-tamsulosin(1+) (2S)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium (+)-tamsulosin(1+)|(2S)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium|(S)-(+)-tamsulosin(1+)|(S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide(1+)|(S)-tamsulosin(1+) http://purl.obolibrary.org/obo/CHEBI_142549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142554 biolink:ChemicalEntity N(omega)-(ADP-D-ribosyl)-L-argininium(1-) residue An L-α-amino acid residue derived from Nω-(ADP-D-ribosyl)-L-arginine. metacyc.compound:CPD-557 Graph N(omega)-(ADP-D-ribosyl)-L-arginine residue N(omega)-(ADP-D-ribosyl)-L-arginine residue http://purl.obolibrary.org/obo/CHEBI_142554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142556 biolink:ChemicalEntity O-(ADP-D-ribosyl)-L-serine(2-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of O-(ADP-D-ribosyl)-L-serine residue. pubmed:27067600 Graph O-(ADP-D-ribosyl)-L-serine residue O-(ADP-D-ribosyl)-L-serine residue http://purl.obolibrary.org/obo/CHEBI_142556 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142557 biolink:ChemicalEntity O-(ADP-D-ribosyl)-L-tyrosine(2-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of O-(ADP-D-ribosyl)-L-tyrosine residue. pubmed:30257210 Graph O-(ADP-D-ribosyl)-L-tyrosine residue O-(ADP-D-ribosyl)-L-tyrosine residue http://purl.obolibrary.org/obo/CHEBI_142557 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142558 biolink:ChemicalEntity C-terminal O-(ADP-D-ribosyl)-glycine(2-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of C-terminal O-(ADP-D-ribosyl)-glycine residue. Graph C-terminal O-(ADP-D-ribosyl)-glycine residue C-terminal O-(ADP-D-ribosyl)-glycine residue http://purl.obolibrary.org/obo/CHEBI_142558 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142567 biolink:ChemicalEntity alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group A trisaccharide β-D-glucosyl group obtained by removal of the hydroxy group from the hemiacetal function of α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucose. Part of, and the proposed epitope from, α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-ceramide (globoside Gb3Cer; globotriosylceramide; CTH). pubmed:33643275|pubmed:7691279 Graph Gala1-4Galb1-4Glcb-yl|Galalpha1-4Galbeta1-4Glcbeta-R|Galalpha1-4Galbeta1-4Glcbeta-yl|alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-D-Glc-yl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl Gala1-4Galb1-4Glcb-yl|Galalpha1-4Galbeta1-4Glcbeta-R|Galalpha1-4Galbeta1-4Glcbeta-yl|alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-D-Glc-yl|alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl http://purl.obolibrary.org/obo/CHEBI_142567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142571 biolink:ChemicalEntity alpha-D-GalpNAc-(1->3)-[alpha-L-Fucp-(1->2)]-beta-D-Galp-yl group A branched trisaccharide β-D-galactosyl group obtained by removal of the hydroxy group from the hemiacetal function of N-acetyl-α-D-galactosaminyl-(1→3)-[α-L-fucosyl-(1→2)]-β-D-galactose. Part of, and the proposed epitope of, blood group A antigen. pubmed:7691279 Graph 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactosyl-(1->3)-[6-deoxy-alpha-L-galactosyl-(1->2)]-beta-D-galactosyl|GalNAcalpha1-3(Fucalpha1-2)Gal-R|GalNAcalpha1-3(Fucalpha1-2)Galbeta-R|alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-yl|alpha-D-N-acetylgalactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl|alpha-L-Fuc-(1->2)-[alpha-D-GalNAc-(1->3)]-beta-D-Gal-yl|alpha-L-Fucp-(1->2)-[alpha-D-GalpNAc-(1->3)]-beta-D-Galp-yl|alpha-L-fucosyl-(1->2)-[alpha-D-N-acetylgalactosaminyl-(1->3)]-beta-D-galactosyl|alphaGalNAc1->3(alphaFuc1->2)betaGal-yl 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl 2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)]-beta-D-galactopyranosyl|2-acetamido-2-deoxy-alpha-D-galactosyl-(1->3)-[6-deoxy-alpha-L-galactosyl-(1->2)]-beta-D-galactosyl|GalNAcalpha1-3(Fucalpha1-2)Gal-R|GalNAcalpha1-3(Fucalpha1-2)Galbeta-R|alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-yl|alpha-D-N-acetylgalactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl|alpha-L-Fuc-(1->2)-[alpha-D-GalNAc-(1->3)]-beta-D-Gal-yl|alpha-L-Fucp-(1->2)-[alpha-D-GalpNAc-(1->3)]-beta-D-Galp-yl|alpha-L-fucosyl-(1->2)-[alpha-D-N-acetylgalactosaminyl-(1->3)]-beta-D-galactosyl|alphaGalNAc1->3(alphaFuc1->2)betaGal-yl http://purl.obolibrary.org/obo/CHEBI_142571 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142573 biolink:ChemicalEntity alpha-L-Fucp-(1->2)-(1->3)-[alpha-D-Galp]-beta-D-Galp-yl group A branched trisaccharide β-D-galactosyl group obtained by removal of the hydroxy group from the hemiacetal function of α-L-fucosyl-(1→2)-[α-D-galactosyl-(1→3)]-β-D-galactose. Part of, and the proposed epitope of, blood group B antigen. pubmed:7691279 Graph Galalpha1-3(Fucalpha1-2)Gal-R|Galalpha1-3(Fucalpha1-2)Galbeta-R|alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-yl|alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl|alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl|alpha-D-galactosyl-(1->3)-[6-deoxy-alpha-L-galactosyl-(1->2)]-beta-D-galactosyl|alpha-L-Fuc-(1->2)-[alpha-D-Gal-(1->3)]-beta-D-Gal-yl|alpha-L-Fucp-(1->2)-[alpha-D-Galp-(1->3)]-beta-D-Galp-yl|alpha-L-fucopyranosyl-(1->2)-[alpha-D-galactopyranosyl-(1->3)]-beta-D-galactopyranosyl|alpha-L-fucosyl-(1->2)-[alpha-D-galactosyl-(1->3)]-beta-D-galactosyl|alphaGal1->3(alphaFuc1->2)betaGal-yl alpha-L-fucopyranosyl-(1->2)-[alpha-D-galactopyranosyl-(1->3)]-beta-D-galactopyranosyl Galalpha1-3(Fucalpha1-2)Gal-R|Galalpha1-3(Fucalpha1-2)Galbeta-R|alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-yl|alpha-D-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)]-beta-D-galactopyranosyl|alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl|alpha-D-galactosyl-(1->3)-[6-deoxy-alpha-L-galactosyl-(1->2)]-beta-D-galactosyl|alpha-L-Fuc-(1->2)-[alpha-D-Gal-(1->3)]-beta-D-Gal-yl|alpha-L-Fucp-(1->2)-[alpha-D-Galp-(1->3)]-beta-D-Galp-yl|alpha-L-fucopyranosyl-(1->2)-[alpha-D-galactopyranosyl-(1->3)]-beta-D-galactopyranosyl|alpha-L-fucosyl-(1->2)-[alpha-D-galactosyl-(1->3)]-beta-D-galactosyl|alphaGal1->3(alphaFuc1->2)betaGal-yl http://purl.obolibrary.org/obo/CHEBI_142573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142587 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide Graph beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-ceramide beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-ceramide http://purl.obolibrary.org/obo/CHEBI_142587 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142590 biolink:ChemicalEntity 3-aminoisobutanoic acid zwitterion Zwitterionic form of 3-aminoisobutyric acid arising from migration of a proton from the carboxy group to the amino group; major species at pH 7.3. Graph 3-aminoisobutanoate|3-ammonio-2-methylpropanoate|3-azaniumyl-2-methylpropanoate 3-azaniumyl-2-methylpropanoate 3-aminoisobutanoate|3-ammonio-2-methylpropanoate|3-azaniumyl-2-methylpropanoate http://purl.obolibrary.org/obo/CHEBI_142590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142593 biolink:ChemicalEntity 4-hydroxynonenal A monounsaturated fatty aldehyde that is nonanal that has undergone dehydrogenation to introduce a double bond at any position in the aliphatic chain and in which a hydrogen at position 4 has been replaced by a hydroxy group. pubmed:15865448 Graph a 4-hydroxynonenal a 4-hydroxynonenal http://purl.obolibrary.org/obo/CHEBI_142593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14261 biolink:ChemicalEntity feruloyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of ferulic acid. pubmed:11038271|pubmed:19258320|reaxys:7683383 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-hydroxy-3-methoxycinnamoyl-CoA|4-hydroxy-3-methoxycinnamoyl-coenzyme A|feruloyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-hydroxy-3-methoxycinnamoyl-CoA|4-hydroxy-3-methoxycinnamoyl-coenzyme A|feruloyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_14261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142614 biolink:ChemicalEntity 5-guanidinohydantoin An imidazolidine-2,4-dione substituted by a guanidino group at position 5. cas:104184-01-2|pubmed:26582419|pubmed:26733197|pubmed:27818219|pubmed:28514164|pubmed:28845978|pubmed:29185758|pubmed:29490132|pubmed:30688445 Graph (2,5-dioxo-4-imidazolidinyl)guanidine|1-(2,5-dioxoimidazolidin-4-yl)guanidine|5-(amidinoamino)imidazolidine-2,4-dione|5-guanidinoimidazolidine-2,4-dione|N-(2,5-dioxoimidazolidin-4-yl)guanidine|guanidinohydantoin 1-(2,5-dioxoimidazolidin-4-yl)guanidine|N-(2,5-dioxoimidazolidin-4-yl)guanidine (2,5-dioxo-4-imidazolidinyl)guanidine|1-(2,5-dioxoimidazolidin-4-yl)guanidine|5-(amidinoamino)imidazolidine-2,4-dione|5-guanidinoimidazolidine-2,4-dione|N-(2,5-dioxoimidazolidin-4-yl)guanidine|guanidinohydantoin http://purl.obolibrary.org/obo/CHEBI_142614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142621 biolink:ChemicalEntity medium-chain fatty aldehyde Any fatty aldehyde with a chain length between C6 and C12. metacyc.compound:Medium-Chain-Aldehydes Graph a medium-chain fatty aldehyde|medium-chain fatty aldehydes a medium-chain fatty aldehyde|medium-chain fatty aldehydes http://purl.obolibrary.org/obo/CHEBI_142621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142622 biolink:ChemicalEntity primary fatty alcohol Any fatty alcohol in which the hydroxy group is attached to a methylene (CH2) group. Graph a primary fatty alcohol|primary fatty alcohol|primary fatty alcohols a primary fatty alcohol|primary fatty alcohol|primary fatty alcohols http://purl.obolibrary.org/obo/CHEBI_142622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142623 biolink:ChemicalEntity spiroiminodihydantoin An azaspiro compound that is 1,3,6,8-tetraazaspiro[4.4]non-6-ene which is substituted by oxo groups at positions 2, 4, and 9. Both enantiomers are highly mutagenic products resulting from the oxidation of guanine and 8-oxo-7,8-dihydroguanine in DNA by reactive oxygen species. pubmed:15540949|pubmed:17915881|pubmed:19146379|pubmed:19485408|pubmed:20014751|pubmed:23360616|pubmed:24649945|pubmed:26572218|pubmed:26807878|pubmed:27074396|pubmed:28230976|pubmed:28514164|pubmed:28845978|pubmed:30592213 Graph 7-amino-1,3,6,8-tetraazaspiro[4.4]non-6-ene-2,4,9-trione 7-amino-1,3,6,8-tetraazaspiro[4.4]non-6-ene-2,4,9-trione 7-amino-1,3,6,8-tetraazaspiro[4.4]non-6-ene-2,4,9-trione http://purl.obolibrary.org/obo/CHEBI_142623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142638 biolink:ChemicalEntity nectriapyrones Any member of the class of 2-pyranones that is nectriapyrone and its derivatives. They are produced mainly by symbiotic fungi, including endophytes and plant pathogens. pubmed:26001271|pubmed:29621598|pubmed:30443971 Graph http://purl.obolibrary.org/obo/CHEBI_142638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142676 biolink:ChemicalEntity ribozinoindole-1 A triazinoindole that is 5H-[1,2,4]triazino[5,6-b]indole which is substituted at position 3 by a (2-methylprop-2-en-1-yl)thio group. A potent inhibitor of midasin which is an essential protein for eukaryotic ribosome biogenesis. cas:328023-11-6|pubmed:27667686|pubmed:30318141 Graph 3-((2-methylallyl)thio)-5H-[1,2,4]triazino[5,6-b]indole|3-(2-methylprop-2-enylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole|3-[(2-methyl-2-propenyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole|3-[(2-methylprop-2-en-1-yl)thio]-5H-[1,2,4]triazino[5,6-b]indole|Rbin-1|ribozinoindole-1 3-[(2-methylprop-2-en-1-yl)thio]-5H-[1,2,4]triazino[5,6-b]indole 3-((2-methylallyl)thio)-5H-[1,2,4]triazino[5,6-b]indole|3-(2-methylprop-2-enylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indole|3-[(2-methyl-2-propenyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole|3-[(2-methylprop-2-en-1-yl)thio]-5H-[1,2,4]triazino[5,6-b]indole|Rbin-1|ribozinoindole-1 http://purl.obolibrary.org/obo/CHEBI_142676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142677 biolink:ChemicalEntity triazinoindole Any heterotricyclic compound whose skeleton consists of an indole fused to a triazine ring. Graph triazinoindole|triazinoindoles triazinoindole|triazinoindoles http://purl.obolibrary.org/obo/CHEBI_142677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14268 biolink:ChemicalEntity flavonol 3-O-glycoside Any glycosyloxyflavone that consists of a flavonol attached to a glycosyl residue at position 3 via a glycosidic linkage. Graph a flavonol 3-O-glycoside|flavonol 3-O-glycoside|flavonol 3-O-glycosides a flavonol 3-O-glycoside|flavonol 3-O-glycoside|flavonol 3-O-glycosides http://purl.obolibrary.org/obo/CHEBI_14268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142686 biolink:ChemicalEntity aldehydo-D-glucuronate A D-glucuronate resulting from the deprotonation of the carboxy group of aldehydo-D-glucuronic acid; the major species at pH 7.3. Graph aldehydo-D-glucuronate aldehydo-D-glucuronate aldehydo-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_142686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1427 biolink:ChemicalEntity 3-(3-hydroxyphenyl)propanoic acid A monocarboxylic acid that is propionic acid carrying a 3-hydroxyphenyl substituent at C-3. cas:621-54-5|hmdb:HMDB0000375|kegg.compound:C11457|metacyc.compound:3-HYDROXYPHENYL-PROPIONATE|pubmed:19537710|reaxys:1947445 Graph 3-(3-Hydroxy-phenyl)-propanoic acid|3-(3-hydroxyphenyl)propanoic acid|3-(3-hydroxyphenyl)propionic acid|3-(m-hydroxyphenyl)propionic acid|Dihydro-3-coumaric acid|beta-(m-hydroxyphenyl)propionic acid 3-(3-hydroxyphenyl)propanoic acid 3-(3-Hydroxy-phenyl)-propanoic acid|3-(3-hydroxyphenyl)propanoic acid|3-(3-hydroxyphenyl)propionic acid|3-(m-hydroxyphenyl)propionic acid|Dihydro-3-coumaric acid|beta-(m-hydroxyphenyl)propionic acid http://purl.obolibrary.org/obo/CHEBI_1427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142708 biolink:ChemicalEntity tigecycline(1+) An ammonium ion that is the conjugate acid of tigecycline; major species at pH 7.3. metacyc.compound:CPD-19260|pubmed:16128584 Graph (1S,4aS,11aR,12aS)-8-[2-(tert-butylammonio)acetamido]-3-carbamoyl-10-(dimethylamino)-1-(dimethylammonio)-4a,5,7-trihydroxy-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate|tigecycline (1S,4aS,11aR,12aS)-8-[2-(tert-butylammonio)acetamido]-3-carbamoyl-10-(dimethylamino)-1-(dimethylammonio)-4a,5,7-trihydroxy-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate (1S,4aS,11aR,12aS)-8-[2-(tert-butylammonio)acetamido]-3-carbamoyl-10-(dimethylamino)-1-(dimethylammonio)-4a,5,7-trihydroxy-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-2-olate|tigecycline http://purl.obolibrary.org/obo/CHEBI_142708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14272 biolink:ChemicalEntity fluoroacetaldehyde An aldehyde that is acetaldehyde in which one of the hydrogens of the methyl group is replaced by fluorine. cas:1544-46-3|kegg.compound:C15488|metacyc.compound:CPD-12708|pubmed:11571203|pubmed:12738270|pubmed:1637660|pubmed:1671927|pubmed:7742593|reaxys:1734626 Graph fluoroacetaldehyde fluoroacetaldehyde fluoroacetaldehyde http://purl.obolibrary.org/obo/CHEBI_14272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142734 biolink:ChemicalEntity N-acyl hemiaminal An organic hydroxy compound resulting from the formal addition of the amino group of a carboxamide to the carbonyl group of an aldehyde or ketone. Graph N-acyl hemiaminals N-acyl hemiaminals http://purl.obolibrary.org/obo/CHEBI_142734 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142738 biolink:ChemicalEntity tau aggregation inhibitor A chemical that inhibits the aggregation of the tau protein (HGNC:MAPT) and its distinct morphological forms (e.g. paired helical fragments (PHFs), straight filaments (SFs), oligomers, or larger aggregates). pubmed:19164903|pubmed:19189357|pubmed:20149808|pubmed:23484434|pubmed:24072703|pubmed:25387336|pubmed:26809554|pubmed:27975248|wikipedia.en:Tau_protein Graph TAI|tau aggregation inhibitor|tau aggregation inhibitors|tau protein aggregation inhibitor|tau protein aggregation inhibitors|tau-aggregation inhibitor|tau-aggregation inhibitors TAI|tau aggregation inhibitor|tau aggregation inhibitors|tau protein aggregation inhibitor|tau protein aggregation inhibitors|tau-aggregation inhibitor|tau-aggregation inhibitors http://purl.obolibrary.org/obo/CHEBI_142738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142767 biolink:ChemicalEntity alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-yl group A β-D-glucosyl group derived from the trisaccharide N-acetyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-glucose. Implied reactive epitope within ganglioside GM3. pubmed:7534889 Graph 3'-sialyllactosyl|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|Neu5Acalpha2-3Galbeta1-4Glcbeta-yl|alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl 3'-sialyllactosyl|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl|Neu5Acalpha2-3Galbeta1-4Glcbeta-yl|alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl http://purl.obolibrary.org/obo/CHEBI_142767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142768 biolink:ChemicalEntity C-terminal Xaa-(2S)-hydroxyglycino(1-) residue A C-terminal Xaa-hydroxyglycino(1−) residue in which the 2-hydroxy group has S stereochemistry. pubmed:10504734|pubmed:19604476 Graph C-terminal Xaa-(2S)-2-hydroxyglycine residue|C-terminal Xaa-(2S)-hydroxyglycino residue C-terminal Xaa-(2S)-2-hydroxyglycine residue|C-terminal Xaa-(2S)-hydroxyglycino residue http://purl.obolibrary.org/obo/CHEBI_142768 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142773 biolink:ChemicalEntity estetrol A 3-hydroxy steroid that is 17β-estradiol which has been substituted at the 15α and 16α positions by two additional hydroxy groups. It is a natural estrogen produced exclusively during pregnancy by the fetal liver. cas:15183-37-6|drugbank:DB12235|patent:EP2383279|pdb-ccd:4OH|pubmed:1222727|pubmed:18462934|pubmed:18464016|pubmed:18464023|pubmed:19167495|pubmed:23992378|pubmed:25079370|pubmed:25961355|pubmed:26212489|pubmed:27799463|pubmed:28267365|pubmed:28364860|pubmed:28371720|pubmed:28641030|pubmed:28827141|pubmed:29928930|pubmed:29931320|pubmed:30308312|pubmed:4003113|pubmed:545977|wikipedia.en:Estetrol Graph (15alpha,16alpha,17beta)-estra-1(10),2,4-triene-3,15,16,17-tetrol|(8R,9S,13S,14S,15R,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,15,16,17-tetrol|15alpha-hydroxyestriol|3,15alpha,16alpha,17beta-tetrahydroxyestra-1,3,5(10)-triene|Donesta|estetrol|estetrolum|estra-1(10),2,4-triene-3,15alpha,16alpha,17beta-tetrol|estra-1,3,5(10)-triene-3,15alpha,16alpha,17beta-tetrol|oestetrol estra-1(10),2,4-triene-3,15alpha,16alpha,17beta-tetrol (15alpha,16alpha,17beta)-estra-1(10),2,4-triene-3,15,16,17-tetrol|(8R,9S,13S,14S,15R,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,15,16,17-tetrol|15alpha-hydroxyestriol|3,15alpha,16alpha,17beta-tetrahydroxyestra-1,3,5(10)-triene|Donesta|estetrol|estetrolum|estra-1(10),2,4-triene-3,15alpha,16alpha,17beta-tetrol|estra-1,3,5(10)-triene-3,15alpha,16alpha,17beta-tetrol|oestetrol http://purl.obolibrary.org/obo/CHEBI_142773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142774 biolink:ChemicalEntity nitryl chloride A nitro compound in which the nitrogen of the nitro group is bonded to a chlorine. It is used as a nitrating and chlorinating agent in organic synthesis. cas:13444-90-1|pubmed:11368552|pubmed:11690564|pubmed:12475975|pubmed:21391546|pubmed:21936506|pubmed:22443276|pubmed:26140681|pubmed:26153795|pubmed:28646605|pubmed:28806070|pubmed:29376646|pubmed:29406712|pubmed:29929221 Graph ClNO2|chloro(oxo)azane oxide|nitryl chloride chloro(oxo)azane oxide ClNO2|chloro(oxo)azane oxide|nitryl chloride http://purl.obolibrary.org/obo/CHEBI_142774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142783 biolink:ChemicalEntity TRP channel modulator An agent that modulates the passage of cations through the transient receptor potential (TRP) channels. Graph TRP channel modulators TRP channel modulators http://purl.obolibrary.org/obo/CHEBI_142783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142797 biolink:ChemicalEntity TMP(2-) A pyrimidine ribonucleoside 5'-monophosphate in which the pyrimidine element is 5-methyluracil; major species at pH 7.3. pubmed:24210219 Graph 5-methyl-5'-O-phosphonatouridine|5-methyl-UMP|m(5)UMP 5-methyl-5'-O-phosphonatouridine 5-methyl-5'-O-phosphonatouridine|5-methyl-UMP|m(5)UMP http://purl.obolibrary.org/obo/CHEBI_142797 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14280 biolink:ChemicalEntity formyl phosphate(1-) Graph formyl hydrogen phosphate formyl hydrogen phosphate formyl hydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_14280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142821 biolink:ChemicalEntity andrastin C(1-) An enolate anion resulting from the deprotonation of the enol group of andrastin C. Major species at pH 7.3. Published in http://dx.doi.org/10.1016/j.tet.2013.07.029 Graph (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-dien-15-olate|3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin C 3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-dien-15-olate|3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin C http://purl.obolibrary.org/obo/CHEBI_142821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142822 biolink:ChemicalEntity andrastin B(1-) An enolate anion resulting from the deprotonation of the enol group of andrastin B. Major species at pH 7.3. Published in Tetrahedron, 2013, 69(38), 8199-8204. http://dx.doi.org/10.1016/j.tet.2013.07.029 Graph (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-dien-15-olate|3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin B 3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-dien-15-olate|3beta-(acetyloxy)-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin B http://purl.obolibrary.org/obo/CHEBI_142822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142823 biolink:ChemicalEntity andrastin A(1-) An enolate anion resulting from the deprotonation of the enol group of andrastin A. Major species at pH 7.3. Published in Tetrahedron, 2013, 69(38), 8199-8204. http://dx.doi.org/10.1016/j.tet.2013.07.029 Graph (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-acetoxy-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-dien-15-olate|3beta-acetoxy-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin A 3beta-acetoxy-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-acetoxy-14-(methoxycarbonyl)-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-dien-15-olate|3beta-acetoxy-14-(methoxycarbonyl)-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-dien-15-olate|andrastin A http://purl.obolibrary.org/obo/CHEBI_142823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142839 biolink:ChemicalEntity enolate An organic anion arising from deprotonation of the hydroxy group of an enol. Graph enolate anion|enolate anions|enolates enolate anion|enolate anions|enolates http://purl.obolibrary.org/obo/CHEBI_142839 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142842 biolink:ChemicalEntity andrastin A A 19-oxo steroid that is that is andrastin B in which the hydroxy group at position 19 has been oxidised to give the corresponding aldehyde. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses. cas:174232-42-9|pubmed:16279417|pubmed:19837474|pubmed:26731665|pubmed:28529508|pubmed:28799296|pubmed:29270163|pubmed:29853169|pubmed:8682716|pubmed:8682717|pubmed:9531989|wikipedia.en:Andrastin_A Graph methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-acetoxy-15-hydroxy-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-acetoxy-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl 3beta-acetoxy-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-acetoxy-15-hydroxy-4,4,8,12,16-pentamethyl-17,19-dioxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-acetoxy-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate http://purl.obolibrary.org/obo/CHEBI_142842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142848 biolink:ChemicalEntity 4alpha-hydroxymethyl-5alpha-ergosta-7,24(28)-dien-3beta-ol A 3β-sterol that is 24-methylidenelophenol in which the methyl group at position 4 has been oxidised to the corresponding hydroxymethyl group. metacyc.compound:CPD-12907|pubmed:14653780|pubmed:8505296 Graph 4alpha-(hydroxymethyl)-5alpha-ergosta-7,24(28)-dien-3beta-ol|4alpha-hydroxymethyl-ergosta-7,24(24(1))-dien-3beta-ol 4alpha-(hydroxymethyl)-5alpha-ergosta-7,24(28)-dien-3beta-ol 4alpha-(hydroxymethyl)-5alpha-ergosta-7,24(28)-dien-3beta-ol|4alpha-hydroxymethyl-ergosta-7,24(24(1))-dien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142849 biolink:ChemicalEntity 4alpha-formyl-ergosta-7,24(28)-dien-3beta-ol A 3β-sterol that is 5α-ergosta-7,24(28)-diene which is substituted at the 3β and 4α positions by hydroxy and formyl groups, respectively. metacyc.compound:CPD-12908|pubmed:14653780|pubmed:8505296 Graph (3beta,4alpha,5alpha)-3-hydroxyergosta-7,24(28)-diene-4-carbaldehyde|3beta-hydroxy-5alpha-ergosta-7,24(28)-diene-4alpha-carbaldehyde|4alpha-formyl-ergosta-7,24(24(1))-dien-3beta-ol 3beta-hydroxy-5alpha-ergosta-7,24(28)-diene-4alpha-carbaldehyde (3beta,4alpha,5alpha)-3-hydroxyergosta-7,24(28)-diene-4-carbaldehyde|3beta-hydroxy-5alpha-ergosta-7,24(28)-diene-4alpha-carbaldehyde|4alpha-formyl-ergosta-7,24(24(1))-dien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142851 biolink:ChemicalEntity 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid A non-proteinogenic alpha-amino acid that is 2-aminobutanoic acid which is substituted at position 4 by a hydroxy(methyl)phosphoryl group. Graph 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|2-amino-4-[hydroxy(methyl)phosphoryl]butyric acid|phosphinothricin 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|2-amino-4-[hydroxy(methyl)phosphoryl]butyric acid 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|2-amino-4-[hydroxy(methyl)phosphoryl]butyric acid|phosphinothricin http://purl.obolibrary.org/obo/CHEBI_142851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142852 biolink:ChemicalEntity glufosinate-P A 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid that has S configuration at position 2. A glutamine synthetase inhibitor, it is used (generally as the corresponding ammonium or sodium salts, known as glufosinate-P-ammonium and glufosinate-P-sodium, respectively) as a herbicide to control annual weeds and grasses. cas:35597-44-5|kegg.compound:C04650|pdb-ccd:PPQ|pesticides:glufosinate-p|ppdb:1667|reaxys:4668102 Graph (+)-glufosinate|(2S)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid|(2S)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2S)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|(2S)-glufosinate|(S)-glufosinate|(S)-phosphinothricin|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine|L-glufosinate|phosphinothricin-P (2S)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2S)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid (+)-glufosinate|(2S)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid|(2S)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2S)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|(2S)-glufosinate|(S)-glufosinate|(S)-phosphinothricin|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine|L-glufosinate|phosphinothricin-P http://purl.obolibrary.org/obo/CHEBI_142852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142853 biolink:ChemicalEntity (2R)-glufosinate A 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid that has R configuration at position 2. The enantiomer of glufosinate-P. Graph (-)-glufosinate|(2R)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid|(2R)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2R)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|(R)-glufosinate|4-[hydroxy(methyl)phosphinoyl]-D-homoalanine|D-glufosinate (2R)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2R)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid (-)-glufosinate|(2R)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid|(2R)-2-amino-4-[hydroxy(methyl)phosphinoyl]butyric acid|(2R)-2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid|(R)-glufosinate|4-[hydroxy(methyl)phosphinoyl]-D-homoalanine|D-glufosinate http://purl.obolibrary.org/obo/CHEBI_142853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142854 biolink:ChemicalEntity (2R)-glufosinate zwitterion An amino acid zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of (2R)-glufosinate. Graph (-)-glufosinate zwitterion|(2R)-2-azaniumyl-4-(hydroxymethylphosphinyl)butanoate|(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate|(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butyrate|(R)-glufosinate zwitterion|4-[hydroxy(methyl)phosphinoyl]-D-homoalanine zwitterion (2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate|(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butyrate (-)-glufosinate zwitterion|(2R)-2-azaniumyl-4-(hydroxymethylphosphinyl)butanoate|(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate|(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butyrate|(R)-glufosinate zwitterion|4-[hydroxy(methyl)phosphinoyl]-D-homoalanine zwitterion http://purl.obolibrary.org/obo/CHEBI_142854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142856 biolink:ChemicalEntity glufosinate-P zwitterion An amino acid zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of glufosinate-P. Graph (+)-glufosinate zwitterion|(2S)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid zwitterion|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinoyl]butyrate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate|(2S)-glufosinate zwitterion|(S)-glufosinate zwitterion|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine zwitterion (2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinoyl]butyrate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate (+)-glufosinate zwitterion|(2S)-2-amino-4-(hydroxymethylphosphinyl)butanoic acid zwitterion|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinoyl]butyrate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate|(2S)-glufosinate zwitterion|(S)-glufosinate zwitterion|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine zwitterion http://purl.obolibrary.org/obo/CHEBI_142856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142858 biolink:ChemicalEntity (2R)-glufosinate zwitterion(1-) An organic anion resulting from the deprotonation of the phosphinic acid group of (2R)-glufosinate zwitterion. pubmed:38289384 Graph (-)-glufosinate zwitterion(1-)|(2R)-2-azaniumyl-4-(methylphosphinato)butanoate|(2R)-2-azaniumyl-4-(methylphosphinato)butyrate|(R)-glufosinate zwitterion(1-)|4-(methylphosphinato)-D-homoalanine zwitterion|D-phosphinothricin (2R)-2-azaniumyl-4-(methylphosphinato)butanoate|(2R)-2-azaniumyl-4-(methylphosphinato)butyrate (-)-glufosinate zwitterion(1-)|(2R)-2-azaniumyl-4-(methylphosphinato)butanoate|(2R)-2-azaniumyl-4-(methylphosphinato)butyrate|(R)-glufosinate zwitterion(1-)|4-(methylphosphinato)-D-homoalanine zwitterion|D-phosphinothricin http://purl.obolibrary.org/obo/CHEBI_142858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142859 biolink:ChemicalEntity glufosinate-P zwitterion(1-) An organic anion resulting from the deprotonation of the phosphinic acid group of (2R)-glufosinate-P zwitterion. metacyc.compound:L-PHOSPHINOTHRICIN|pubmed:32815302|pubmed:38289384 Graph (+)-glufosinate zwitterion(1-)|(2S)-2-amino-4-(hydroxymethylphosphinato)butanoic acid zwitterion|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butanoate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butyrate|(2S)-glufosinate zwitterion(1-)|(S)-glufosinate zwitterion(1-)|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine zwitterion(1-)|L-phosphinothricin (2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butanoate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butyrate (+)-glufosinate zwitterion(1-)|(2S)-2-amino-4-(hydroxymethylphosphinato)butanoic acid zwitterion|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butanoate|(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinato]butyrate|(2S)-glufosinate zwitterion(1-)|(S)-glufosinate zwitterion(1-)|4-[hydroxy(methyl)phosphinoyl]-L-homoalanine zwitterion(1-)|L-phosphinothricin http://purl.obolibrary.org/obo/CHEBI_142859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142862 biolink:ChemicalEntity andrastin B A 17-oxo steroid that is andrastin C in which a hydrogen of the methyl group at position 19 has been replaced by a hydroxy group. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses. pubmed:15826038|pubmed:8682716|pubmed:8682717 Graph methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-15,19-dihydroxy-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-(acetyloxy)-15,19-dihydroxy-4,4,8,12,16-pentamethyl-17-oxo-5beta,8alpha,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl 3beta-(acetyloxy)-15,19-dihydroxy-4,4,8,12,16-pentamethyl-17-oxo-5beta,8alpha,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-15,19-dihydroxy-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-(acetyloxy)-15,19-dihydroxy-4,4,8,12,16-pentamethyl-17-oxo-5beta,8alpha,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate http://purl.obolibrary.org/obo/CHEBI_142862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142864 biolink:ChemicalEntity 1-carboxybiuret(1-) An organic anion resulting from the deprotonation of the carbamic acid group of 1-carboxybiuret. metacyc.compound:CPD-21687|pubmed:29523689 Graph (carbamoylcarbamoyl)carbamate|1-carboxybiuret|N-[(carbamoylamino)carbonyl]carbamate (carbamoylcarbamoyl)carbamate (carbamoylcarbamoyl)carbamate|1-carboxybiuret|N-[(carbamoylamino)carbonyl]carbamate http://purl.obolibrary.org/obo/CHEBI_142864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142867 biolink:ChemicalEntity andrastin C A 17-oxosteroid that is 17-oxo-5β,9β,10α,13α-androsta-11,15-dieneandroxta-11,15-diene which is substituted by an acetoxy group at the 3β position, methyl groups at the 4, 4, 8, 12, and 16 positions, a methoxycarbonyl group at position 14, and a hydroxy group at position 15. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses. pubmed:15826038|pubmed:23106671|pubmed:26863302|pubmed:8682716|pubmed:8682717 Graph methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-15-hydroxy-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-(acetyloxy)-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl 3beta-(acetyloxy)-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-(acetyloxy)-15-hydroxy-4,4,8,12,16-pentamethyl-17-oxoandrosta-11,15-diene-14-carboxylate|methyl 3beta-(acetyloxy)-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17-oxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate http://purl.obolibrary.org/obo/CHEBI_142867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142880 biolink:ChemicalEntity 7,2'-dihydroxy-4'-methoxyisoflavanol A member of the class of isoflavans that is isoflavan-4-ol substituted at positions 7 and 2' by hydroxy groups and at position 4' by a methoxy group. pubmed:20522996|pubmed:8071365 Graph 3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,7-diol|3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol|4'-methoxyisoflavan-2',4,7-triol 3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol 3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,7-diol|3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol|4'-methoxyisoflavan-2',4,7-triol http://purl.obolibrary.org/obo/CHEBI_142880 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142917 biolink:ChemicalEntity 24-methylene-9beta-9,19-cyclolanostane-3beta,28-diol A 3β-hydroxy-4α-formyl-4β-methylsteroid that is 24-methylenecycloartanol in which the alpha-methyl substituent at position 4 has been substituted by a hydroxy group. metacyc.compound:CPD-12865|pubmed:17337022|pubmed:8505296 Graph 24-methylene-9beta-9,19-cyclolanostane-3beta,28-diol|24-methylenecycloartane-3,28-diol|4alpha-hydroxymethyl,4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol 24-methylene-9beta-9,19-cyclolanostane-3beta,28-diol 24-methylene-9beta-9,19-cyclolanostane-3beta,28-diol|24-methylenecycloartane-3,28-diol|4alpha-hydroxymethyl,4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142918 biolink:ChemicalEntity 3beta-hydroxy-24-methylene-9beta-9,19-cyclolanostan-28-al A 3β-hydroxy-4α-formyl-4β-methylsteroid that is 24-methylene-9β-9,19-cyclolanostane-3β,28-diol in which the hydroxy group at position 28 has been oxidised to give the corresponding aldehyde. metacyc.compound:CPD-12866 Graph (3beta,4alpha)-3-hydroxy-24-methylene-9,19-cycloanostan-28-one|3beta-hydroxy-24-methylene-9beta-9,19-cyclolanostan-28-al|4alpha-formyl,4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol 3beta-hydroxy-24-methylene-9beta-9,19-cyclolanostan-28-al (3beta,4alpha)-3-hydroxy-24-methylene-9,19-cycloanostan-28-one|3beta-hydroxy-24-methylene-9beta-9,19-cyclolanostan-28-al|4alpha-formyl,4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142921 biolink:ChemicalEntity 3-phenylprop-2-enal "A member of the class of cinnamaldehydes that is prop-2-enal in which a hydrogen at position 3 has been replaced by a phenyl group. The configuration of the double bond is not specified; the name ""cinnamaldehyde"" is widely used to refer to the E (trans) isomer." cas:104-55-2 Graph 3-phenylacrylaldehyde|3-phenylpropenal|cinnamaldehyde 3-phenylacrylaldehyde|3-phenylpropenal|cinnamaldehyde http://purl.obolibrary.org/obo/CHEBI_142921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142928 biolink:ChemicalEntity 4alpha-hydroxymethyl-stigmasta-7,24(24(1))-dien-3beta-ol A 3β-sterol that is 5α-stigmasta-7,24(28)-dien-3β-ol which is substituted at the 4α position by a hydroxymethyl group and in which the 24(28) double bond has Z configuration. metacyc.compound:CPD-12911 Graph (24Z)-4alpha-(hydroxymethyl)-5alpha-stigmasta-7,24(28)-dien-3beta-ol|(3beta,4alpha,5alpha,24Z)-4-(hydroxymethyl)stigmasta-7,24(28)-dien-3-ol|4alpha-hydroxymethyl-stigmasta-7,24(24(1))-dien-3beta-ol (24Z)-4alpha-(hydroxymethyl)-5alpha-stigmasta-7,24(28)-dien-3beta-ol (24Z)-4alpha-(hydroxymethyl)-5alpha-stigmasta-7,24(28)-dien-3beta-ol|(3beta,4alpha,5alpha,24Z)-4-(hydroxymethyl)stigmasta-7,24(28)-dien-3-ol|4alpha-hydroxymethyl-stigmasta-7,24(24(1))-dien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142929 biolink:ChemicalEntity (24Z)-4alpha-formyl-stigmasta-7,24(24(1))-dien-3beta-ol A 3β-sterol that is (24Z)-stigmasta-7,24(28)-diene which is substituted at the 3β and 4α positions by hydroxy and formyl groups, respectively. metacyc.compound:CPD-12912 Graph (24Z)-3beta-hydroxy-5alpha-stigmasta-7,24(28)-diene-4alpha-carbaldehyde|(3beta,4alpha,5alpha,24Z)-3-hydroxystigmasta-7,24(28)-diene-4-carbaldehyde|4alpha-formyl-stigmasta-7,24(24(1))-dien-3beta-ol (24Z)-3beta-hydroxy-5alpha-stigmasta-7,24(28)-diene-4alpha-carbaldehyde (24Z)-3beta-hydroxy-5alpha-stigmasta-7,24(28)-diene-4alpha-carbaldehyde|(3beta,4alpha,5alpha,24Z)-3-hydroxystigmasta-7,24(28)-diene-4-carbaldehyde|4alpha-formyl-stigmasta-7,24(24(1))-dien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_142929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142939 biolink:ChemicalEntity 5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate(11-) Fully deprotonated form of 5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate; major species at pH 7.3 pubmed:10777568 Graph 5-PP-InsP4|5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate 5-PP-InsP4|5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate http://purl.obolibrary.org/obo/CHEBI_142939 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142940 biolink:ChemicalEntity dihexadecanoylglycerol A diglyceride that is glycerol in which any two of the hydroxy groups have undergone formal esterification by condensation with hexadecanoic (palmitic) acid. Formula C35H68O5. For the structure shown, either R1 = H and R2 = hexadecanoyl or R1 = hexadecanoyl and R2 = H. Graph DG 16:0_16:0|dihexadecanoylglycerol|dipalmitoylglycerol|glycerol dihexadecanoate|glycerol dipalmitate DG 16:0_16:0|dihexadecanoylglycerol|dipalmitoylglycerol|glycerol dihexadecanoate|glycerol dipalmitate http://purl.obolibrary.org/obo/CHEBI_142940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142957 biolink:ChemicalEntity 6-sulfo-beta-D-quinovose(1-) A 6-sulfo-D-quinovose(1−) that has β configuration at the anomeric centre. metacyc.compound:CPD-21686|pubmed:29535276 Graph 6-deoxy-6-sulfonato-beta-D-glucopyranose|6-sulfo-beta-D-quinovose|6-sulfo-beta-quinovose(1-)|6-sulfonato-beta-quinovose 6-deoxy-6-sulfonato-beta-D-glucopyranose 6-deoxy-6-sulfonato-beta-D-glucopyranose|6-sulfo-beta-D-quinovose|6-sulfo-beta-quinovose(1-)|6-sulfonato-beta-quinovose http://purl.obolibrary.org/obo/CHEBI_142957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142967 biolink:ChemicalEntity D-histidine zwitterion A polar amino acid zwitterion restulting from the transfer of a proton from the carboxy group to the α-amino group of D-histidine. The major species at pH 7.3. metacyc.compound:CPD-12151|pubmed:27230378 Graph (2R)-2-ammonio-3-(1H-imidazol-4-yl)propanoate|(2R)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoate|D-histidine (2R)-2-ammonio-3-(1H-imidazol-4-yl)propanoate|(2R)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoate (2R)-2-ammonio-3-(1H-imidazol-4-yl)propanoate|(2R)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoate|D-histidine http://purl.obolibrary.org/obo/CHEBI_142967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:142968 biolink:ChemicalEntity Lipomannan Lipomannan is a mycobacterium immune agonist and a major constituent of the mycobacterium cell wall Graph http://purl.obolibrary.org/obo/CHEBI_142968 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:142990 biolink:ChemicalEntity cyclolaudenol A pentacyclic triterpenoid that is (24S)-methyl-9β,19-cyclolanost-25-ene which carries a hydroxy group at position 3β. It is isolated from several plant species inclduing Turraeanthus and Tillandsia. cas:511-61-5|foodb.food:FDB014700|hmdb:HMDB0035911|knapsack:C00045816|metacyc.compound:CPD-22096|pubmed:10882005|pubmed:11473433|pubmed:12807886|pubmed:6986865 Graph (24S)-24-methylcycloart-25-en-3beta-ol|(3beta,9beta,24S)-24-methyl-9,19-cyclolanost-25-en-3-ol|24(S)-methyl-9beta,19-cyclolanost-25-en-3beta-ol|cyclolaudenol 24(S)-methyl-9beta,19-cyclolanost-25-en-3beta-ol (24S)-24-methylcycloart-25-en-3beta-ol|(3beta,9beta,24S)-24-methyl-9,19-cyclolanost-25-en-3-ol|24(S)-methyl-9beta,19-cyclolanost-25-en-3beta-ol|cyclolaudenol http://purl.obolibrary.org/obo/CHEBI_142990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143001 biolink:ChemicalEntity GABAB receptor agonist A GABA receptor agonist specific for GABAB receptors. Graph GABAB receptor agonists GABAB receptor agonists http://purl.obolibrary.org/obo/CHEBI_143001 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:143004 biolink:ChemicalEntity ultra-long-chain fatty acid Any very long-chain fatty acid which has a chain length greater than C27. pubmed:27257090 Graph ULCFA|ULCFAs|ultra long-chain fatty acid|ultra long-chain fatty acids|ultra-long-chain fatty acids ULCFA|ULCFAs|ultra long-chain fatty acid|ultra long-chain fatty acids|ultra-long-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_143004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143005 biolink:ChemicalEntity ultra-long-chain fatty acid anion Any very long-chain fatty acid anion with a chain length greater than C27. Graph a ultra-long-chain fatty acid|ultra long-chain fatty acid anion|ultra long-chain fatty acid anions a ultra-long-chain fatty acid|ultra long-chain fatty acid anion|ultra long-chain fatty acid anions http://purl.obolibrary.org/obo/CHEBI_143005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143006 biolink:ChemicalEntity L-homoarginine(1+) A guanidinium ion that is the conjugate acid of L-homoarginine; major species at pH 7.3. metacyc.compound:HOMOARGININE|pubmed:11310742 Graph (2S)-6-{[amino(iminio)methyl]amino}-2-azaniumylhexanoate|L-homoarginine (2S)-6-{[amino(iminio)methyl]amino}-2-azaniumylhexanoate (2S)-6-{[amino(iminio)methyl]amino}-2-azaniumylhexanoate|L-homoarginine http://purl.obolibrary.org/obo/CHEBI_143006 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143024 biolink:ChemicalEntity 1-carboxybiuret A member of the class of condensed ureas that is urea in which one of the amino groups has had one of the attached hydrogens replaced by a carbamoyl group and the second amino group has had one of its hydrogens replaced by a carboxy group. pubmed:22730121|pubmed:24039269|pubmed:29523689 Graph (carbamoylcarbamoyl)carbamic acid|1-carboxybiuret|carboxybiuret (carbamoylcarbamoyl)carbamic acid (carbamoylcarbamoyl)carbamic acid|1-carboxybiuret|carboxybiuret http://purl.obolibrary.org/obo/CHEBI_143024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143076 biolink:ChemicalEntity N(pros)-methyl-L-histidine zwitterion A L-histidine derivative that is L-histidine substituted by a methyl group at position 3 on the imidazole ring; major species at pH 7.3. metacyc.compound:CPD-1823 Graph 1-methyl-L-histidine zwitterion|N(pros)-methyl-L-histidine 1-methyl-L-histidine zwitterion|N(pros)-methyl-L-histidine http://purl.obolibrary.org/obo/CHEBI_143076 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143079 biolink:ChemicalEntity D-leucine zwitterion A D-α-amino acid zwitterion arising from the transfer of a proton from the carboxy to the amino group of D-leucine; major species at pH 7.3. metacyc.compound:CPD-12150|pubmed:24419381 Graph (2R)-2-azaniumyl-4-methylpentanoate|D-leu|D-leucine (2R)-2-azaniumyl-4-methylpentanoate (2R)-2-azaniumyl-4-methylpentanoate|D-leu|D-leucine http://purl.obolibrary.org/obo/CHEBI_143079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143080 biolink:ChemicalEntity D-norleucine zwitterion A D-α-amino acid zwitterion arising from the transfer of a proton from the carboxy to the amino group of D-norleucine; major species at pH 7.3. pubmed:24419381 Graph (2R)-2-azaniumylhexanoate|D-2-aminohexanoate|D-2-aminohexanoic acid zwitterion|D-norleucine zwitterion (2R)-2-azaniumylhexanoate (2R)-2-azaniumylhexanoate|D-2-aminohexanoate|D-2-aminohexanoic acid zwitterion|D-norleucine zwitterion http://purl.obolibrary.org/obo/CHEBI_143080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143081 biolink:ChemicalEntity D-homoserine zwitterion A D-α-amino acid zwitterion arising from transfer of a proton from the carboxy to the amino group of D-homoserine; major species at pH 7.3. metacyc.compound:CPD-12255|pubmed:24419381 Graph (2R)-2-azaniumyl-4-hydroxybutanoate|D-homoserine (2R)-2-azaniumyl-4-hydroxybutanoate (2R)-2-azaniumyl-4-hydroxybutanoate|D-homoserine http://purl.obolibrary.org/obo/CHEBI_143081 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143084 biolink:ChemicalEntity organometalloidal compound A compound having bonds between one or more metalloid atoms and one or more carbon atoms of an organyl group. pubmed:15246002|pubmed:17741021|pubmed:8403081|pubmed:908316 Graph organometalloidal|organometalloidal compounds|organometalloidals organometalloidal|organometalloidal compounds|organometalloidals http://purl.obolibrary.org/obo/CHEBI_143084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143089 biolink:ChemicalEntity 10-hydroxyoctadecanoate A hydroxy saturated fatty acid anion resulting from the deprotonation of the carboxy group of 10-hydroxyoctadecanoic acid. pubmed:30643283 Graph 10-OH-C18:0(1-)|10-hydroxyoctadecanoate|10-hydroxyoctadecanoic acid(1-)|10-hydroxystearate|10-hydroxystearic acid(1-) 10-hydroxyoctadecanoate 10-OH-C18:0(1-)|10-hydroxyoctadecanoate|10-hydroxyoctadecanoic acid(1-)|10-hydroxystearate|10-hydroxystearic acid(1-) http://purl.obolibrary.org/obo/CHEBI_143089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143093 biolink:ChemicalEntity 2'-3'-cGAMP(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of 2'-3'-cGAMP; major species at pH 7.3. metacyc.compound:CPD-15224|pubmed:23722158|pubmed:23910378|pubmed:30728498 Graph 2',3'-cGAMP|2'-3'-cyclic GMP-AMP(2-)|cyclic G(2'-5')pA(3'-5')p(2-) 2',3'-cGAMP|2'-3'-cyclic GMP-AMP(2-)|cyclic G(2'-5')pA(3'-5')p(2-) http://purl.obolibrary.org/obo/CHEBI_143093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143095 biolink:ChemicalEntity 10-hydroxyoctadecanoic acid A hydroxy fatty acid that is octadecanoic acid carrying a hydroxy group at position 10. agr:IND44573045|cas:638-26-6|foodb.food:FDB016439|hmdb:HMDB0037396|lipidmaps:LMFA02000128|pubmed:21207107|pubmed:30506254 Graph 10-hydroxy stearic acid|10-hydroxy-octadecanoic acid|10-hydroxyoctadecanoic acid|10-hydroxystearic acid 10-hydroxyoctadecanoic acid 10-hydroxy stearic acid|10-hydroxy-octadecanoic acid|10-hydroxyoctadecanoic acid|10-hydroxystearic acid http://purl.obolibrary.org/obo/CHEBI_143095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143097 biolink:ChemicalEntity Gp[2'-5']Ap[3'] A (2'→5')-dinucleotide comprising guanosine and adenosine connected by a 2'→5' linkage and with a phosphate group at the 3'-terminus. pubmed:30728498 Graph http://purl.obolibrary.org/obo/CHEBI_143097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143098 biolink:ChemicalEntity Gp[2'-5']Ap[3'](3-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of Gp[2'-5']Ap[3']; major species at pH 7.3. pubmed:30728498 Graph G-P(2'-5')A-P(3') G-P(2'-5')A-P(3') http://purl.obolibrary.org/obo/CHEBI_143098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143117 biolink:ChemicalEntity lorlatinib A cyclic ether that is 16,17-dihydro-2H-8,4-(metheno)pyrazolo[4,3-h][2,5,11]benzoxadiazacyclotetradecin-15(10H)-one substituted by methyl groups at positions 2 and 10R, and by cyano, amino and fluoro groups at positions 3, 7 and 12 respectively. It is a small molecule inhibitor of ALK and ROS1 kinase developed by Pfizer for the treatment of ALK-positive non-small cell lung cancer. cas:1454846-35-5|drugbank:DB12130|kegg.drug:D11012|pdb-ccd:5P8|pubmed:24819116|pubmed:25073473|pubmed:25349124|pubmed:25733882|pubmed:26698910|pubmed:26880581|pubmed:27413712|pubmed:28594000|pubmed:29744867|pubmed:30413378|pubmed:30478428|pubmed:30604291|pubmed:30816885|wikipedia.en:Lorlatinib Graph (10R)-7-amino-12-fluoro-2,10,16-trimethyl-15-oxo-10,15,16,17-tetrahydro-2H-8,4-(metheno)pyrazolo[4,3-h][2,5,11]benzoxadiazacyclotetradecine-3-carbonitrile|Lorbrena|PF-06463922|PF06463922|PFE-PKIS 10|loratinib|lorlatinib|lorlatinibum (10R)-7-amino-12-fluoro-2,10,16-trimethyl-15-oxo-10,15,16,17-tetrahydro-2H-8,4-(metheno)pyrazolo[4,3-h][2,5,11]benzoxadiazacyclotetradecine-3-carbonitrile (10R)-7-amino-12-fluoro-2,10,16-trimethyl-15-oxo-10,15,16,17-tetrahydro-2H-8,4-(metheno)pyrazolo[4,3-h][2,5,11]benzoxadiazacyclotetradecine-3-carbonitrile|Lorbrena|PF-06463922|PF06463922|PFE-PKIS 10|loratinib|lorlatinib|lorlatinibum http://purl.obolibrary.org/obo/CHEBI_143117 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143129 biolink:ChemicalEntity primary fatty amide A primary carboxamide RC(=O)NH2 resultng from the formal condensation of the carboxy group of a fatty acid with ammonia. Graph a fatty acylamide|primary fatty amides|primary fatty carboxamide|primary fatty carboxamides a fatty acylamide|primary fatty amides|primary fatty carboxamide|primary fatty carboxamides http://purl.obolibrary.org/obo/CHEBI_143129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143130 biolink:ChemicalEntity impurity A chemical role played by any unwanted chemical substance inside a confined amount of liquid, gas, or solid, which differs from the chemical composition of the material or compound. For example, an impurity can be an undesired by-product of a chemical reaction or manufacturing process, a drug contaminant, or can be created upon degradation during storage. wikipedia.en:Impurity Graph contaminant|contaminants|impurities|impurity contaminant|contaminants|impurities|impurity http://purl.obolibrary.org/obo/CHEBI_143130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143135 biolink:ChemicalEntity Glycino 3beta-cholesterol ester group pubmed:11111088|pubmed:8824192 Graph C-terminal glycine 3beta-cholesterol ester residue|Gly-cholesterol ester group|glycino cholesterol ester group C-terminal glycine 3beta-cholesterol ester residue|Gly-cholesterol ester group|glycino cholesterol ester group http://purl.obolibrary.org/obo/CHEBI_143135 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143136 biolink:ChemicalEntity succinamate A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of succinamic acid; major species at pH 7.3. metacyc.compound:CPD-8979|pubmed:16332014|pubmed:16332015 Graph 4-amino-4-oxobutanoate|succanimate|succinamate|succinamic acid(1-) 4-amino-4-oxobutanoate 4-amino-4-oxobutanoate|succanimate|succinamate|succinamic acid(1-) http://purl.obolibrary.org/obo/CHEBI_143136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14314 biolink:ChemicalEntity D-glucose 6-phosphate A D-glucose monophosphate in which the phosphate group is attached to position 6. Graph 6-O-phosphono-D-glucose|D-glucose 6-(dihydrogen phosphate) 6-O-phosphono-D-glucose|D-glucose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_14314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143140 biolink:ChemicalEntity glycyl-L-cysteine residue An L-α-amino acid residue derived from glycyl-L-cysteine. Graph GC residue|Gly-L-Cys residue|glycyl-L-cysteine residue GC residue|Gly-L-Cys residue|glycyl-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_143140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143141 biolink:ChemicalEntity N,N',N''-triacetylchitotriose metacyc.compound:CPD-13227|pubmed:10842338|pubmed:10866795|pubmed:17900572|pubmed:33794535|pubmed:434472|pubmed:6525655 Graph 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|N,N',N''-triacetylchitotriose 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|N,N',N''-triacetylchitotriose http://purl.obolibrary.org/obo/CHEBI_143141 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143197 biolink:ChemicalEntity culmorin A sesquiterpenoid fungal metabolite isolated from Fusarium culmorum. cas:18374-83-9|knapsack:C00021971|pubmed:1034641|pubmed:10866628|pubmed:11122521|pubmed:11694092|pubmed:11761144|pubmed:16746350|pubmed:19880637|pubmed:20740541|pubmed:26673640|pubmed:27690101|pubmed:29465119|pubmed:31049613|pubmed:31126504|pubmed:31547160 Graph (-)-culmorin|(1S,3R,3aS,4R,8aR,9R)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulene-3,9-diol|culmorin (1S,3R,3aS,4R,8aR,9R)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulene-3,9-diol (-)-culmorin|(1S,3R,3aS,4R,8aR,9R)-1,5,5,8a-tetramethyldecahydro-1,4-methanoazulene-3,9-diol|culmorin http://purl.obolibrary.org/obo/CHEBI_143197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143199 biolink:ChemicalEntity S-myristoyl-L-cysteine group pubmed:22247542 Graph S-tetradecanoyl-L-cysteinyl group|S-tetradecanoyl-L-cysteinyl residue S-tetradecanoyl-L-cysteinyl group|S-tetradecanoyl-L-cysteinyl residue http://purl.obolibrary.org/obo/CHEBI_143199 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143200 biolink:ChemicalEntity S-stearoyl-L-cysteine group pubmed:22247542 Graph S-octadecanoyl-L-cysteinyl group|S-octadecanoyl-L-cysteinyl residue S-octadecanoyl-L-cysteinyl group|S-octadecanoyl-L-cysteinyl residue http://purl.obolibrary.org/obo/CHEBI_143200 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143201 biolink:ChemicalEntity S-oleoyl-L-cysteine group Graph S-(9Z-octadecenoyl)-L-cysteinyl group|S-(9Z-octadecenoyl)-L-cysteinyl residue S-(9Z-octadecenoyl)-L-cysteinyl group|S-(9Z-octadecenoyl)-L-cysteinyl residue http://purl.obolibrary.org/obo/CHEBI_143201 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143202 biolink:ChemicalEntity S-arachidonoyl-L-cysteine group pubmed:22247542 Graph S-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-L-cysteinyl residue|S-(5Z,8Z,11Z,14Z-icosatetraenoyl)-L-cysteinyl group S-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-L-cysteinyl residue|S-(5Z,8Z,11Z,14Z-icosatetraenoyl)-L-cysteinyl group http://purl.obolibrary.org/obo/CHEBI_143202 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14321 biolink:ChemicalEntity glutamate(1-) An α-amino-acid anion that is the conjugate base of glutamic acid, having anionic carboxy groups and a cationic amino group gmelin:327908 Graph 2-ammoniopentanedioate|glutamate|glutamate(1-)|glutamic acid monoanion|hydrogen glutamate hydrogen glutamate 2-ammoniopentanedioate|glutamate|glutamate(1-)|glutamic acid monoanion|hydrogen glutamate http://purl.obolibrary.org/obo/CHEBI_14321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143212 biolink:ChemicalEntity thienopyrimidine A class of aromatic heterobicyclic compounds each of which contains a pyrimidine ring ortho fused to a 5-membered thiophene ring. Graph thienopyrimidine|thienopyrimidines thienopyrimidine|thienopyrimidines http://purl.obolibrary.org/obo/CHEBI_143212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143231 biolink:ChemicalEntity carbohydrate allergen Any carbohydrate, carbohydrate derivative or derived substituent group which causes the onset of an allergic reaction. pubmed:9788708 Graph allergenic carbohydrate|allergenic carbohydrate derivative allergenic carbohydrate|allergenic carbohydrate derivative http://purl.obolibrary.org/obo/CHEBI_143231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143253 biolink:ChemicalEntity N(6)-(D-fructosyl)-L-lysinium residue metacyc.compound:Protein-fructosamines|pubmed:11522682 Graph N(6)-(D-fructosyl)-L-lysine(1+) residue N(6)-(D-fructosyl)-L-lysine(1+) residue http://purl.obolibrary.org/obo/CHEBI_143253 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143254 biolink:ChemicalEntity N(6)-(3-O-phospho-D-fructosyl)-L-lysinium(1-) residue metacyc.compound:Protein-phospho-fructosamines|pubchem.compound:11522682 Graph N(6)-(3-O-phospho-D-fructosyl)-L-lysine residue N(6)-(3-O-phospho-D-fructosyl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_143254 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143274 biolink:ChemicalEntity indole-3-butyrate An indol-3-yl carboxylic acid anion that is the conjugate base of indole-3-butyric acid, arising from the deprotonation of the carboxy group. chemspider:2934315|metacyc.compound:CPD-10507 Graph (indol-3-yl)butanoate|1H-indole-3-butanoate|1H-indole-3-butyrate|3-indolebutyrate|4-(1H-indol-3-yl)butanoate|4-(indol-3-yl)butanoate|indole-3-butanoate|indole-3-butyrate|indole-3-butyric acid(1-) 4-(1H-indol-3-yl)butanoate (indol-3-yl)butanoate|1H-indole-3-butanoate|1H-indole-3-butyrate|3-indolebutyrate|4-(1H-indol-3-yl)butanoate|4-(indol-3-yl)butanoate|indole-3-butanoate|indole-3-butyrate|indole-3-butyric acid(1-) http://purl.obolibrary.org/obo/CHEBI_143274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143276 biolink:ChemicalEntity 4-chloro-L-lysinium An α-amino-acid cation that is the conjugate acid of 4-chloro-L-lysine zwitterion; major species at pH 7.3. pubmed:30867596 Graph (2S)-2,6-bis(azaniumyl)-4-chlorohexanoate|4-chloro-L-lysine|4-chloro-L-lysine(1+)|4-chloro-L-lysinium|gamma-chloro-L-lysinium (2S)-2,6-bis(azaniumyl)-4-chlorohexanoate (2S)-2,6-bis(azaniumyl)-4-chlorohexanoate|4-chloro-L-lysine|4-chloro-L-lysine(1+)|4-chloro-L-lysinium|gamma-chloro-L-lysinium http://purl.obolibrary.org/obo/CHEBI_143276 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143285 biolink:ChemicalEntity L-propargylglycine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy group to the amino group of L-propargylglycine. The major species at pH 7.3. pubmed:23772385|pubmed:30867596|pubmed:387077|pubmed:3994731|pubmed:7094918|pubmed:7364752|pubmed:944577 Graph L-propargylglycine L-propargylglycine http://purl.obolibrary.org/obo/CHEBI_143285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143286 biolink:ChemicalEntity L-gamma-glutamyl-L-propargylglycine(1-) A non-proteinogenic dipeptide anion formed from L-glutamate and L-propargylglycine residues. Major species at pH 7.3. pubmed:30867596 Graph L-gamma-glutamyl-L-propargylglycine L-gamma-glutamyl-L-propargylglycine http://purl.obolibrary.org/obo/CHEBI_143286 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143287 biolink:ChemicalEntity L-gamma-glutamyl-(3R)-L-beta-ethynylserine(1-) A non-proteinogenic dipeptide anion formed from the (3R)-hydroxylation of L-γ-glutamyl-L-propargylglycine(1−). Major species at pH 7.3. pubmed:30867596 Graph L-gamma-glutamyl-(3R)-L-beta-ethynylserine L-gamma-glutamyl-(3R)-L-beta-ethynylserine http://purl.obolibrary.org/obo/CHEBI_143287 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143310 biolink:ChemicalEntity 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid A carboxylic acid that is 3-phenylpropanoic acid substituted at position 4 by a 2-hydroxy-3-(propan-2-ylamino)propoxy group. cas:81148-15-4|reaxys:5284008 Graph 3-{4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl}propionic acid|3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid 3-{4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl}propionic acid|3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid http://purl.obolibrary.org/obo/CHEBI_143310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14336 biolink:ChemicalEntity glycerol 1-phosphate A glycerol monophosphate having the phosphate group located at position 1. cas:57-03-4|hmdb:HMDB0000126|kegg.compound:C03189|metacyc.compound:Glycerol-1-phosphate|pubmed:1694860|pubmed:22770225|pubmed:29438107|pubmed:6083437|reaxys:1723974|wikipedia.en:Glycerol_1-phosphate Graph 1,2,3-propanetriol, 1-(dihydrogen phosphate)|1-glycerophosphate|1-glycerophosphoric acid|1-phosphoglycerol|2,3-dihydroxypropyl dihydrogen phosphate|2,3-hydroxy-1-propyl dihydrogen phosphate|3-glycerophosphate|D,L-alpha-glycerol-phosphate|DL-Glycerol 3-phosphate|DL-Glyceryl 1-phosphate|DL-glycerol 1-phosphate|Glycerol 1-phosphate|PG|alpha-glycerophosphoric acid|alpha-phosphoglycerol|glycerol 1-(dihydrogen phosphate)|glycerol alpha-phosphate|rac-Glycerol 1-phosphate 2,3-dihydroxypropyl dihydrogen phosphate|glycerol 1-(dihydrogen phosphate) 1,2,3-propanetriol, 1-(dihydrogen phosphate)|1-glycerophosphate|1-glycerophosphoric acid|1-phosphoglycerol|2,3-dihydroxypropyl dihydrogen phosphate|2,3-hydroxy-1-propyl dihydrogen phosphate|3-glycerophosphate|D,L-alpha-glycerol-phosphate|DL-Glycerol 3-phosphate|DL-Glyceryl 1-phosphate|DL-glycerol 1-phosphate|Glycerol 1-phosphate|PG|alpha-glycerophosphoric acid|alpha-phosphoglycerol|glycerol 1-(dihydrogen phosphate)|glycerol alpha-phosphate|rac-Glycerol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_14336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143529 biolink:ChemicalEntity (2E)-decenoate An unsaturated fatty acid anion resulting from the deprotonation of the carboxy group of trans-2-decenoic acid. The major species at pH 7.3. pubmed:11673457 Graph (2E)-dec-2-enoate|(2E)-decenoate|(2E)-decenoate(1-)|trans-2-decenoate|trans-dec-2-enoate (2E)-dec-2-enoate (2E)-dec-2-enoate|(2E)-decenoate|(2E)-decenoate(1-)|trans-2-decenoate|trans-dec-2-enoate http://purl.obolibrary.org/obo/CHEBI_143529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143532 biolink:ChemicalEntity prostaglandin F2alpha-CoA(4-) pubmed:11673457 Graph prostaglandin F2alpha-CoA prostaglandin F2alpha-CoA http://purl.obolibrary.org/obo/CHEBI_143532 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143535 biolink:ChemicalEntity S-acyl-L-cysteine residue An L-α-amino acid residue obtained from the formal condensation of the thiol group of L-cysteine residue with the carboxy group of any carboxylic acid. metacyc.compound:Protein-S-Acyl-Cysteines Graph S-acyl-L-cysteine residue S-acyl-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_143535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143553 biolink:ChemicalEntity 8-oxo-GTP(4-) metacyc.compound:CPD-12366|pubmed:23463507 Graph 8-oxo-GTP 8-oxo-GTP http://purl.obolibrary.org/obo/CHEBI_143553 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143554 biolink:ChemicalEntity 8-oxo-GDP(3-) metacyc.compound:CPD-14101|pubmed:23463507 Graph 8-oxo-GDP 8-oxo-GDP http://purl.obolibrary.org/obo/CHEBI_143554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143563 biolink:ChemicalEntity 3beta-hydroxy-4,4-dimethylsteroid Any 3β-hydroxy steroid which is substituted by two methyl groups at position 4. metacyc.compound:3beta-OH-44-dimethyl-sterols Graph a 3beta-hydroxy-4,4-dimethylsteroid a 3beta-hydroxy-4,4-dimethylsteroid http://purl.obolibrary.org/obo/CHEBI_143563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143576 biolink:ChemicalEntity anthocyanidin betaine Major species at pH 7.3. The structure is based on the fact that all (except one; see Wikipedia page for anthocyanidin) anthocyanidins have OH groups at positions 3,5,7,4' and can be substituted at positions 3' and 5' Graph an anthocyanidin an anthocyanidin http://purl.obolibrary.org/obo/CHEBI_143576 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143593 biolink:ChemicalEntity beta-galactosylceramide pubmed:10748143|pubmed:3921539 Graph a beta-D-Gal-(1<->1')-ceramide|beta-D-GalCer|beta-D-galactosyl-N-acyl sphingoid base|beta-galactocerebroside a beta-D-Gal-(1<->1')-ceramide|beta-D-GalCer|beta-D-galactosyl-N-acyl sphingoid base|beta-galactocerebroside http://purl.obolibrary.org/obo/CHEBI_143593 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143594 biolink:ChemicalEntity alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1<->1')-ceramide pubmed:10748143|pubmed:3921539 Graph (alpha,beta)-digalactosylceramide|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-Cer|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-N-acyl sphingoid base|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-ceramide (alpha,beta)-digalactosylceramide|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-Cer|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-N-acyl sphingoid base|alpha-D-Gal-(1->4)-beta-D-Gal-(1<->1')-ceramide http://purl.obolibrary.org/obo/CHEBI_143594 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143597 biolink:ChemicalEntity pentanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of five carbon atoms. cas:30899-19-5 Graph http://purl.obolibrary.org/obo/CHEBI_143597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143622 biolink:ChemicalEntity gamma-L-glutamyl-L-glutamate(2-) residue pubmed:1720781 Graph gamma-L-glutamyl-L-glutamate residue gamma-L-glutamyl-L-glutamate residue http://purl.obolibrary.org/obo/CHEBI_143622 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143623 biolink:ChemicalEntity poly(L-glutamyl)-L-gamma-glutamyl-L-glutamate residue pubmed:1720781 Graph (L-glutamyl)(n)-gamma-L-glutamyl-L-glutamate residue (L-glutamyl)(n)-gamma-L-glutamyl-L-glutamate residue http://purl.obolibrary.org/obo/CHEBI_143623 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143624 biolink:ChemicalEntity D-galactofuranose The furanose form of D-galactose. glygen:G38028NH|glytoucan:G38028NH|kegg.compound:C21066|pubmed:24420700|pubmed:3109899 Graph D-Galf|D-GalfOH|D-galacto-hexofuranose|D-galactofuranose D-galactofuranose D-Galf|D-GalfOH|D-galacto-hexofuranose|D-galactofuranose http://purl.obolibrary.org/obo/CHEBI_143624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143658 biolink:ChemicalEntity vincristine(2+) A vinca alkaloid cation resulting from the protonation of the two tertiary amino groups of vincristine. Major species at pH 7.3. Graph vincristine vincristine http://purl.obolibrary.org/obo/CHEBI_143658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143701 biolink:ChemicalEntity enolpyruvoyl-2-diphospho-5'-guanosine(3-) metacyc.compound:CPD-22326|pubmed:30952857 Graph enolpyruvoyl-2-diphospho-5'-guanosine enolpyruvoyl-2-diphospho-5'-guanosine http://purl.obolibrary.org/obo/CHEBI_143701 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143703 biolink:ChemicalEntity thiogeraniol A thiol that is geraniol in which the hydroxy group has been replaced by a thiol group. cas:39067-80-6|foodb.food:FDB014950|hmdb:HMDB0036106|metacyc.compound:CPD-22373|pubmed:29862510 Graph (2E)-3,7-dimethylocta-2,6-diene-1-thiol|(2E)-thiogeraniol|(E)-3,7-dimethylocta-2,6-diene-1-thiol|geranyl mercaptan|thiogeraniol (2E)-3,7-dimethylocta-2,6-diene-1-thiol (2E)-3,7-dimethylocta-2,6-diene-1-thiol|(2E)-thiogeraniol|(E)-3,7-dimethylocta-2,6-diene-1-thiol|geranyl mercaptan|thiogeraniol http://purl.obolibrary.org/obo/CHEBI_143703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143705 biolink:ChemicalEntity dehydro coenzyme F420-0(3-) metacyc.compound:CPD-22327|pubmed:30952857 Graph dehydro coenzyme F420-0 dehydro coenzyme F420-0 http://purl.obolibrary.org/obo/CHEBI_143705 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143780 biolink:ChemicalEntity (R)-bopindolol A 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate that has R-configuration. cas:62697-43-2 Graph (2R)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate|(R)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]-2-benzoyloxypropane (2R)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate (2R)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate|(R)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]-2-benzoyloxypropane http://purl.obolibrary.org/obo/CHEBI_143780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143781 biolink:ChemicalEntity (S)-bopindolol A 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate that has S-configuration. cas:62697-41-0 Graph (2S)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate|(S)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]-2-benzoyloxypropane (2S)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate (2S)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate|(S)-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]-2-benzoyloxypropane http://purl.obolibrary.org/obo/CHEBI_143781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143782 biolink:ChemicalEntity 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate A methylindole that is 2-methyl-1H-indol-4-ol in which the hydrogen of the hydroxy group is replaced by a 2-(benzoyloxy)-3-(tert-butylamino)propyl group. Graph 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate 1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate http://purl.obolibrary.org/obo/CHEBI_143782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143788 biolink:ChemicalEntity N(1)-(5-phospho-beta-D-ribosyl)glycinamide(1-) Graph N(1)-(5-phospho-beta-D-ribosyl)glycinamide N(1)-(5-phospho-beta-D-ribosyl)glycinamide http://purl.obolibrary.org/obo/CHEBI_143788 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143789 biolink:ChemicalEntity S-substituted gamma-glutamyl-L-cysteine(1-) metacyc.compound:S-Substituted-Glutamyl-Cysteine|pubmed:14975765|pubmed:15561184|pubmed:19897216 Graph S-substituted gamma-glutamyl-L-cysteine S-substituted gamma-glutamyl-L-cysteine http://purl.obolibrary.org/obo/CHEBI_143789 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1438 biolink:ChemicalEntity 3-(methylthio)propionic acid A thia fatty acid acid consisting of propionic acid with a methylthio substituent at the 3-position; an intermediate in mammalian methionine metabolism in vitro. The simplest known phytotoxin, it is a blight-inducing toxin produced by the cassava pathogen Xanthomonas campestris manihotis. cas:646-01-5|hmdb:HMDB0001527|kegg.compound:C08276|knapsack:C00001194|pubmed:100496|reaxys:1743054 Graph 3-(Methylthio)propionic acid|3-(methylsulfanyl)propanoic acid|3-methylthiopropanoic acid 3-(methylsulfanyl)propanoic acid 3-(Methylthio)propionic acid|3-(methylsulfanyl)propanoic acid|3-methylthiopropanoic acid http://purl.obolibrary.org/obo/CHEBI_1438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143813 biolink:ChemicalEntity 1-radyl,2-acyl-sn-glycero-3-phospho-(1D-myo-inositol)(1-) A phosphatidylinositol where R1 can be an alkyl or an acyl chain and 2R2 is an acyl chain. pubmed:9463366 Graph 1-radyl,2-acyl-sn-glycero-3-phospho-(1D-myo-inositol) 1-radyl,2-acyl-sn-glycero-3-phospho-(1D-myo-inositol) http://purl.obolibrary.org/obo/CHEBI_143813 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143815 biolink:ChemicalEntity 6-N-acetyl-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol(1-) It is a GlcNAc-PI where R1 can be an alkyl or an acyl chain. pubmed:9188481 Graph 6-alpha-D-GlcNAc-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol(1-)|GlcNAc-PI(1-)|a 6-N-acetyl-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol 6-alpha-D-GlcNAc-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol(1-)|GlcNAc-PI(1-)|a 6-N-acetyl-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_143815 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143816 biolink:ChemicalEntity 6-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion A GlcN-PI where R1 can be an alkyl or an acyl chain and R2 is an acyl chain. pubmed:9188481 Graph 6-alpha-D-GlcN-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion|GlcN-PI zwitterion|a 6-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol 6-alpha-D-GlcN-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion|GlcN-PI zwitterion|a 6-alpha-D-glucosaminyl-1-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_143816 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143817 biolink:ChemicalEntity Graph http://purl.obolibrary.org/obo/CHEBI_143817
CHEBI:143818 biolink:ChemicalEntity Graph http://purl.obolibrary.org/obo/CHEBI_143818
CHEBI:143819 biolink:ChemicalEntity C-terminal amino acid residue(1-) Graph C-terminal amino acid residue|amino acid carboxylate group(1-) C-terminal amino acid residue|amino acid carboxylate group(1-) http://purl.obolibrary.org/obo/CHEBI_143819 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143825 biolink:ChemicalEntity ravuconazole A member of the class of triazoles that is 1-butyl-1H-1,2,4-triazole in which the butyl group is substituted at positions 2, 2, and 3 by hydroxy, 2,4-difluorophenyl, and 4-(p-cyanophenyl)-1,3-thiazol-2-yl groups, respectively (the R,R stereoisomer). It exhibits antifungal activity by inhibition of 14α demethylase, an enzyme involved in sterol synthesis, resulting in lysis of the fungal cell wall and fungal cell death. (NCIO4) cas:182760-06-1|drugbank:DB06440|hmdb:HMDB0257114|kegg.drug:D02556|patent:US2011087030|patent:WO2011042827|pmc:PMC105592|pubmed:10566016|pubmed:11709320|pubmed:18548464|pubmed:20112166|pubmed:20404124|pubmed:22652223|pubmed:22935068|pubmed:24071640|pubmed:24945848|pubmed:25742996|pubmed:27904057|pubmed:28553114|pubmed:29768713|pubmed:29982734|pubmed:31769120|pubmed:31773164|pubmed:31875604|pubmed:32115444|pubmed:32423960|pubmed:32571811|pubmed:33609301|pubmed:34075394|pubmed:34375652|pubmed:35120131|pubmed:35398930|pubmed:8891121|pubmed:9527778|wikipedia.en:Ravuconazole Graph 4-[2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile|BMS 207147|BMS-20714|ER 30346|ER-30346|ravuconazol|ravuconazole|ravuconazolum 4-[2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile 4-[2-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile|BMS 207147|BMS-20714|ER 30346|ER-30346|ravuconazol|ravuconazole|ravuconazolum http://purl.obolibrary.org/obo/CHEBI_143825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143828 biolink:ChemicalEntity EC 1.14.14.154 (sterol 14alpha-demethylase) inhibitor Any EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor that interferes with the action of sterol 14α-demethylase (EC 1.14.14.154). Graph CYP51 inhibitor|CYP51 inhibitors|EC 1.14.14.154 (sterol 14alpha-demethylase) inhibitors|EC 1.14.14.154 inhibitor|EC 1.14.14.154 inhibitors|ERG11 inhibitor|ERG11 inhibitors|cytochrome P450 51 inhibitor|cytochrome P450 51 inhibitors|lanosterol 14-demethylase inhibitor|lanosterol 14-demethylase inhibitors|lanosterol 14alpha-demethylase inhibitor|lanosterol 14alpha-demethylase inhibitors|obtusufoliol 14-demethylase inhibitor|obtusufoliol 14-demethylase inhibitors|oxidoreductase (14-methyl cleaving) inhibitors|sterol 14-demethylase inhibitor|sterol 14-demethylase inhibitors|sterol 14alpha-demethylase (EC 1.14.14.154) inhibitor|sterol 14alpha-demethylase (EC 1.14.14.154) inhibitors|sterol 14alpha-demethylase inhibitor|sterol 14alpha-demethylase inhibitors|sterol,[reduced NADPH--hemoprotein reductase]:oxygen inhibitor|sterol,[reduced NADPH--hemoprotein reductase]:oxygen oxidoreductase (14-methyl cleaving) inhibitor CYP51 inhibitor|CYP51 inhibitors|EC 1.14.14.154 (sterol 14alpha-demethylase) inhibitors|EC 1.14.14.154 inhibitor|EC 1.14.14.154 inhibitors|ERG11 inhibitor|ERG11 inhibitors|cytochrome P450 51 inhibitor|cytochrome P450 51 inhibitors|lanosterol 14-demethylase inhibitor|lanosterol 14-demethylase inhibitors|lanosterol 14alpha-demethylase inhibitor|lanosterol 14alpha-demethylase inhibitors|obtusufoliol 14-demethylase inhibitor|obtusufoliol 14-demethylase inhibitors|oxidoreductase (14-methyl cleaving) inhibitors|sterol 14-demethylase inhibitor|sterol 14-demethylase inhibitors|sterol 14alpha-demethylase (EC 1.14.14.154) inhibitor|sterol 14alpha-demethylase (EC 1.14.14.154) inhibitors|sterol 14alpha-demethylase inhibitor|sterol 14alpha-demethylase inhibitors|sterol,[reduced NADPH--hemoprotein reductase]:oxygen inhibitor|sterol,[reduced NADPH--hemoprotein reductase]:oxygen oxidoreductase (14-methyl cleaving) inhibitor http://purl.obolibrary.org/obo/CHEBI_143828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143829 biolink:ChemicalEntity 4-chloro-L-lysine An L-lysine derivative that is L-lysine substituted by a chloro group at position 4. Graph 4-Cl-L-lysine|4-chloro-L-lysine 4-chloro-L-lysine 4-Cl-L-lysine|4-chloro-L-lysine http://purl.obolibrary.org/obo/CHEBI_143829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143830 biolink:ChemicalEntity 4-chloro-L-lysine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of 4-chloro-L-lysine Graph (2S)-6-amino-2-azaniumyl-4-chlorohexanoate (2S)-6-amino-2-azaniumyl-4-chlorohexanoate (2S)-6-amino-2-azaniumyl-4-chlorohexanoate http://purl.obolibrary.org/obo/CHEBI_143830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143877 biolink:ChemicalEntity N-acetyl-L-tryptophanate A monocarboxylic acid anion that is the conjugate base of N-acetyl-L-tryptophan, obtained by the deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:N-ACETYL-TRYPTOPHAN|pubmed:15313614 Graph (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate|N-acetyl-L-tryptophan (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate|N-acetyl-L-tryptophan http://purl.obolibrary.org/obo/CHEBI_143877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143878 biolink:ChemicalEntity N-acetyl-D-phenylalaninate An N-acyl-D-α-amino acid anion that is the conjugate base of N-acetyl-D-phenylalanine, arising from the deprotonation of the carboxy group; major species at pH 7.3. pubmed:15313614 Graph (2R)-2-acetamido-3-phenylpropanoate|N-acetyl-D-phenylalanine (2R)-2-acetamido-3-phenylpropanoate (2R)-2-acetamido-3-phenylpropanoate|N-acetyl-D-phenylalanine http://purl.obolibrary.org/obo/CHEBI_143878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143890 biolink:ChemicalEntity 2-ammonioethyl (2R)-2,3-dihydroxypropyl phosphate zwitterion metacyc.compound:L-1-GLYCEROPHOSPHORYLETHANOL-AMINE Graph sn-glycero-3-phosphoethanolamine sn-glycero-3-phosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_143890 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143898 biolink:ChemicalEntity (R,R)-chrysanthemol A chrysanthemol in which both chiral centres have R configuration. pubmed:25378387 Graph (R,R)-chrysanthemol|[(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanol [(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanol (R,R)-chrysanthemol|[(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanol http://purl.obolibrary.org/obo/CHEBI_143898 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143899 biolink:ChemicalEntity (R,R)-chrysanthemal An aldehyde resulting from the formal oxidation of the hydroxy group of (R,R)-chrysanthemol. pubmed:29122986 Graph (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarbaldehyde|(1R,3R)-chrysanthemal (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarbaldehyde (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarbaldehyde|(1R,3R)-chrysanthemal http://purl.obolibrary.org/obo/CHEBI_143899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143900 biolink:ChemicalEntity (R,R)-chrysanthemate A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of (+)-trans-chrysanthemic acid. The major species at pH 7.3. metacyc.compound:CPD-13662|pubmed:29122986 Graph (+)-trans-chrysanthemate|(1R)-trans-chrysanthemate|(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate|(1R,3R)-chrysanthemate (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate (+)-trans-chrysanthemate|(1R)-trans-chrysanthemate|(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate|(1R,3R)-chrysanthemate http://purl.obolibrary.org/obo/CHEBI_143900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143911 biolink:ChemicalEntity (-)-antofine An organic heteropentacyclic compound that is (13aR)-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline substituted at positions 2, 3 and 6 by methoxy groups. It is an alkaloid produced by relatives of the milkweed family and exhibits antiviral, anti-inflammatory, antiadipogenic and antitumorigenic activities. cas:32671-82-2|knapsack:C00035244|pubmed:12350151|pubmed:12868894|pubmed:17049857|pubmed:20151387|pubmed:21739223|pubmed:22753104|pubmed:22880628|pubmed:24934681|pubmed:28666888|pubmed:28805975|pubmed:30691129|pubmed:31186319 Graph (-)-antofine|(13aR)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|(13aR)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine|(R)-(-)-antofine|(R)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|(R)-antofine|2,3,6-trimethoxy-9,10,11,12,12a,13-hexahydro-9a-aza-cyclopenta[b]triphenylene|2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|7-demethoxytylophorine|9,11,12,13,13a,14-hexahydro-2,3,6-trimethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline|antofine (13aR)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline (-)-antofine|(13aR)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|(13aR)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine|(R)-(-)-antofine|(R)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|(R)-antofine|2,3,6-trimethoxy-9,10,11,12,12a,13-hexahydro-9a-aza-cyclopenta[b]triphenylene|2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinoline|7-demethoxytylophorine|9,11,12,13,13a,14-hexahydro-2,3,6-trimethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline|antofine http://purl.obolibrary.org/obo/CHEBI_143911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143915 biolink:ChemicalEntity N(6)-(pyridoxal phosphate)-L-lysine(2-) residue Graph N(6)-(pyridoxal phosphate)-L-lysine residue N(6)-(pyridoxal phosphate)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_143915 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143949 biolink:ChemicalEntity (R)-lavandulyl diphosphate(3-) Trianion of (R)-lavandulyl diphosphate; major species at pH 7.3. metacyc.compound:CPD-9443|pubmed:12783539 Graph (R)-lavandulyl diphosphate (R)-lavandulyl diphosphate http://purl.obolibrary.org/obo/CHEBI_143949 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143966 biolink:ChemicalEntity (2S)-homocitric acid The (S)-enantiomer of homocitric acid. cas:210713-60-3 Graph (2S)-2-hydroxybutane-1,2,4-tricarboxylic acid|(S)-2-hydroxybutane-1,2,4-tricarboxylic acid|(S)-homocitric acid (2S)-2-hydroxybutane-1,2,4-tricarboxylic acid (2S)-2-hydroxybutane-1,2,4-tricarboxylic acid|(S)-2-hydroxybutane-1,2,4-tricarboxylic acid|(S)-homocitric acid http://purl.obolibrary.org/obo/CHEBI_143966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:143976 biolink:ChemicalEntity 5'-end (N(7)-methyl 5'-triphospho-guanosine)-(2'-O-methyl-adenosine)(2-) residue A 7-methyl guanosine (m7G) linked via an inverted 5'-5' triphosphate bridge to an initiating 2'-O-methyl-adenosine-ribonucleotide; major species at pH 7.3. Graph a 5'-end (N(7)-methyl 5'-triphospho-guanosine)-(2'-O-methyl-adenosine) residue a 5'-end (N(7)-methyl 5'-triphospho-guanosine)-(2'-O-methyl-adenosine) residue http://purl.obolibrary.org/obo/CHEBI_143976 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:143978 biolink:ChemicalEntity 5'-end phospho-adenosine(2-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of a 5'-end phospho-adenosine residue; major species at pH 7.3. Graph a 5'-end phospho-adenosine residue a 5'-end phospho-adenosine residue http://purl.obolibrary.org/obo/CHEBI_143978 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144019 biolink:ChemicalEntity 5'-end phospho-(purine-ribonucleoside)(2-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of a 5'-end phospho-purine ribonucleoside residue; major species at pH 7.3. Graph a 5'-phospho-(purine-ribonucleoside) residue a 5'-phospho-(purine-ribonucleoside) residue http://purl.obolibrary.org/obo/CHEBI_144019 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144029 biolink:ChemicalEntity 5'-end NAD-phospho-ribonucleoside residue An organic anionic group obtained by deprotonation of the phosphate OH groups of a 5'-end NAD+-phospho-ribonucleoside residue; major species at pH 7.3. Graph a 5'-end NAD(+)-phospho-ribonucleoside residue a 5'-end NAD(+)-phospho-ribonucleoside residue http://purl.obolibrary.org/obo/CHEBI_144029 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144033 biolink:ChemicalEntity Graph http://purl.obolibrary.org/obo/CHEBI_144033
CHEBI:144045 biolink:ChemicalEntity (omega-1)-hydroxy-long-chain fatty acid anion Any long-chain fatty acid anion resulting from the deprotonatnion of an (ω−1)-hydroxy-long-chain fatty acid. Graph (omega-1)-hydroxy-long-chain fatty acid anions|an (omega-1)-hydroxy-long-chain fatty acid|long-chain (omega-1)-hydroxy fatty acid anion|long-chain (omega-1)-hydroxy fatty acid anions (omega-1)-hydroxy-long-chain fatty acid anions|an (omega-1)-hydroxy-long-chain fatty acid|long-chain (omega-1)-hydroxy fatty acid anion|long-chain (omega-1)-hydroxy fatty acid anions http://purl.obolibrary.org/obo/CHEBI_144045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144051 biolink:ChemicalEntity 5'-end phospho-adenosine-phospho-ribonucleoside(3-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of a 5'-end phospho-adenosine residue followed by any ribonucleotide; major species at pH 7.3. pubmed:31101919 Graph 5'-end phospho-adenosine-phospho-ribonucleoside residue 5'-end phospho-adenosine-phospho-ribonucleoside residue http://purl.obolibrary.org/obo/CHEBI_144051 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144055 biolink:ChemicalEntity isorhamnetin(1-) A flavonoid oxoanion that is the conjugate base of isorhamnetin, arising from the deprotonation of the 7-hydroxy group; major species at pH 7.3. Graph 3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-olate|3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-7-olate|isorhamnetin 3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-7-olate 3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-olate|3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-7-olate|isorhamnetin http://purl.obolibrary.org/obo/CHEBI_144055 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144093 biolink:ChemicalEntity N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide A member of the class of (trifluoromethyl)benzenes that is 4-amino-2-(trifluoromethyl)benzonitrile in which one of the amino hydrogens is substituted by a 3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanoyl group. Graph N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide http://purl.obolibrary.org/obo/CHEBI_144093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144094 biolink:ChemicalEntity (S)-bicalutamide A N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide that is the (S)-enantiomer of bicalutamide. cas:113299-38-0|pdb-ccd:0U9|pubmed:15509184|pubmed:23288837|pubmed:23527766 Graph (+)-bicalutamide|(2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide|(S)-Casodex (2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide (+)-bicalutamide|(2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide|(S)-Casodex http://purl.obolibrary.org/obo/CHEBI_144094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144097 biolink:ChemicalEntity EC 1.4.3.2 (L-amino-acid oxidase) inhibitor Any EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor that interferes with the action of L-amino-acid oxidase (EC 1.4.3.2). Graph EC 1.4.3.2 (L-amino-acid oxidase) inhibitors|EC 1.4.3.2 inhibitor|EC 1.4.3.2 inhibitors|L-amino-acid oxidase inhibitor|L-amino-acid oxidase inhibitor (EC 1.4.3.2) inhibitor|L-amino-acid oxidase inhibitor (EC 1.4.3.2) inhibitors|L-amino-acid oxidase inhibitors|L-amino-acid:oxygen oxidoreductase (deaminating) inhibitor|L-amino-acid:oxygen oxidoreductase (deaminating) inhibitors|ophio-amino-acid oxidase inhibitor|ophio-amino-acid oxidase inhibitors EC 1.4.3.2 (L-amino-acid oxidase) inhibitors|EC 1.4.3.2 inhibitor|EC 1.4.3.2 inhibitors|L-amino-acid oxidase inhibitor|L-amino-acid oxidase inhibitor (EC 1.4.3.2) inhibitor|L-amino-acid oxidase inhibitor (EC 1.4.3.2) inhibitors|L-amino-acid oxidase inhibitors|L-amino-acid:oxygen oxidoreductase (deaminating) inhibitor|L-amino-acid:oxygen oxidoreductase (deaminating) inhibitors|ophio-amino-acid oxidase inhibitor|ophio-amino-acid oxidase inhibitors http://purl.obolibrary.org/obo/CHEBI_144097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144099 biolink:ChemicalEntity EC 2.6.1.2 (alanine transaminase) inhibitor An EC 2.6.1.* (transaminases) inhibitor that inhibits the action of any alanine transaminase (EC 2.6.1.2). Graph ALT inhibitor|ALT inhibitors|GPT inhibitor|GPT inhibitors|L-alanine aminotransferase inhibitor|L-alanine aminotransferase inhibitors|L-alanine transaminase inhibitor|L-alanine transaminase inhibitors|L-alanine-alpha-ketoglutarate aminotransferase inhibitor|L-alanine-alpha-ketoglutarate aminotransferase inhibitors|L-alanine:2-oxoglutarate aminotransferase inhibitor|L-alanine:2-oxoglutarate aminotransferase inhibitors|alanine aminotransferase inhibitor|alanine aminotransferase inhibitors|alanine transaminase inhibitor|alanine transaminase inhibitors|alanine-alpha-ketoglutarate aminotransferase inhibitor|alanine-alpha-ketoglutarate aminotransferase inhibitors|alanine-pyruvate aminotransferase inhibitor|alanine-pyruvate aminotransferase inhibitors|beta-alanine aminotransferase inhibitor|beta-alanine aminotransferase inhibitors|glutamic acid-pyruvic acid transaminase inhibitor|glutamic acid-pyruvic acid transaminase inhibitors|glutamic-alanine transaminase inhibitor|glutamic-alanine transaminase inhibitors|glutamic-pyruvic aminotransferase inhibitor|glutamic-pyruvic aminotransferase inhibitors|glutamic-pyruvic transaminase inhibitor|glutamic-pyruvic transaminase inhibitors|pyruvate transaminase inhibitor|pyruvate transaminase inhibitors|pyruvate-alanine aminotransferase inhibitor|pyruvate-alanine aminotransferase inhibitors|pyruvate-glutamate transaminase inhibitor|pyruvate-glutamate transaminase inhibitors ALT inhibitor|ALT inhibitors|GPT inhibitor|GPT inhibitors|L-alanine aminotransferase inhibitor|L-alanine aminotransferase inhibitors|L-alanine transaminase inhibitor|L-alanine transaminase inhibitors|L-alanine-alpha-ketoglutarate aminotransferase inhibitor|L-alanine-alpha-ketoglutarate aminotransferase inhibitors|L-alanine:2-oxoglutarate aminotransferase inhibitor|L-alanine:2-oxoglutarate aminotransferase inhibitors|alanine aminotransferase inhibitor|alanine aminotransferase inhibitors|alanine transaminase inhibitor|alanine transaminase inhibitors|alanine-alpha-ketoglutarate aminotransferase inhibitor|alanine-alpha-ketoglutarate aminotransferase inhibitors|alanine-pyruvate aminotransferase inhibitor|alanine-pyruvate aminotransferase inhibitors|beta-alanine aminotransferase inhibitor|beta-alanine aminotransferase inhibitors|glutamic acid-pyruvic acid transaminase inhibitor|glutamic acid-pyruvic acid transaminase inhibitors|glutamic-alanine transaminase inhibitor|glutamic-alanine transaminase inhibitors|glutamic-pyruvic aminotransferase inhibitor|glutamic-pyruvic aminotransferase inhibitors|glutamic-pyruvic transaminase inhibitor|glutamic-pyruvic transaminase inhibitors|pyruvate transaminase inhibitor|pyruvate transaminase inhibitors|pyruvate-alanine aminotransferase inhibitor|pyruvate-alanine aminotransferase inhibitors|pyruvate-glutamate transaminase inhibitor|pyruvate-glutamate transaminase inhibitors http://purl.obolibrary.org/obo/CHEBI_144099 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:144119 biolink:ChemicalEntity Atranorin Graph atranorin atranorin http://purl.obolibrary.org/obo/CHEBI_144119 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144205 biolink:ChemicalEntity Protolichesterinic acid Graph http://purl.obolibrary.org/obo/CHEBI_144205 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14428 biolink:ChemicalEntity hyponitrous acid cas:14448-38-5|gmelin:141300|kegg.compound:C01818 Graph 1,4-dihydrido-2,3-diazy-1,4-dioxy-[4]catena|H2N2O2|Hyponitrous acid|[HON=NOH]|diazenediol|dihydroxido-1kappaO,2kappaO-dinitrogen(N--N)|hyponitrous acid 1,4-dihydrido-2,3-diazy-1,4-dioxy-[4]catena|diazenediol|dihydroxido-1kappaO,2kappaO-dinitrogen(N--N) 1,4-dihydrido-2,3-diazy-1,4-dioxy-[4]catena|H2N2O2|Hyponitrous acid|[HON=NOH]|diazenediol|dihydroxido-1kappaO,2kappaO-dinitrogen(N--N)|hyponitrous acid http://purl.obolibrary.org/obo/CHEBI_14428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144315 biolink:ChemicalEntity 1-radyl-2-acyl-sn-glycerolipid A glycerolipid where R1 is an alkyl or an acyl group, R2 is an acyl chain and R3 can be an H, a phosphate or a phospholipid group. pubmed:19815513 Graph a 1-radyl-2-acyl-sn-glycerolipid|diradylglycerolipid a 1-radyl-2-acyl-sn-glycerolipid|diradylglycerolipid http://purl.obolibrary.org/obo/CHEBI_144315 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14434 biolink:ChemicalEntity imidazole wikipedia.en:Imidazole Graph imidazole imidazole imidazole http://purl.obolibrary.org/obo/CHEBI_14434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144353 biolink:ChemicalEntity diethyldithiocarbamic acid A member of the class of dithiocarbamic acids that is diethylcarbamic acid in which both of the oxygens are replaced by sulfur. cas:147-84-2|drugbank:DB02520|kegg.compound:C19150|pubmed:1848982|pubmed:1851986|pubmed:2902461|pubmed:31465063|reaxys:1747741 Graph Ditiocarb|N,N-diethylcarbamodithioic acid|N,N-diethyldithiocarbamic acid|diethylcarbamodithioic acid diethylcarbamodithioic acid Ditiocarb|N,N-diethylcarbamodithioic acid|N,N-diethyldithiocarbamic acid|diethylcarbamodithioic acid http://purl.obolibrary.org/obo/CHEBI_144353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144359 biolink:ChemicalEntity diethyldithiocarbamate A member of the class of dithiocarbamate anions resulting from the removal of the proton from the dithiocarbamic acid moiety of diethyldithiocarbamic acid. metacyc.compound:DIETHYLDITHIOCARBAMATE Graph N,N-diethyldithiocarbamate N,N-diethyldithiocarbamate http://purl.obolibrary.org/obo/CHEBI_144359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144367 biolink:ChemicalEntity 3PO A member of the class of pyridines that is pyridine substituted by a 3-oxo-3-(pyridin-4-yl)prop-1-en-1-yl group at position 3. An inhibitor of PFKFB3 kinase, an enzyme with a key role in glycolysis. cas:18550-98-6|pubmed:18202014|pubmed:22591674|pubmed:24332967|pubmed:24451478|pubmed:25849762|pubmed:26504012|pubmed:30996799 Graph (2E)-3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-one|(2E)-3-(pyridin-3-yl)-1-(pyridin-4-yl)prop-2-en-1-one|3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-one|3PO (2E)-3-(pyridin-3-yl)-1-(pyridin-4-yl)prop-2-en-1-one (2E)-3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-one|(2E)-3-(pyridin-3-yl)-1-(pyridin-4-yl)prop-2-en-1-one|3-(3-pyridinyl)-1-(4-pyridinyl)-2-propen-1-one|3PO http://purl.obolibrary.org/obo/CHEBI_144367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144368 biolink:ChemicalEntity 1,2-diacyl-sn-glycerolipid A diradylglycerolipid where R1 and R2 are acyl chains and R3 can be an H, a phosphate or a phospholipid group. pubmed:19815513 Graph a 1,2-diacyl-sn-glycerolipid a 1,2-diacyl-sn-glycerolipid http://purl.obolibrary.org/obo/CHEBI_144368 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144387 biolink:ChemicalEntity EC 2.7.1.105 (6-phosphofructo-2-kinase) inhibitor An EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor that interferes with the action of 6-phosphofructo-2-kinase (EC 2.7.1.105). Graph (6-phosphofructo-2-kinase) inhibitors|6-phosphofructo-2-kinase (phosphorylating) inhibitor|6-phosphofructo-2-kinase (phosphorylating) inhibitors|6-phosphofructo-2-kinase inhibitor|6-phosphofructo-2-kinase inhibitors|6-phosphofructose 2-kinase inhibitor|6-phosphofructose 2-kinase inhibitors|EC 2.7.1.105 inhibitor|EC 2.7.1.105 inhibitors|fructose 6-phosphate 2-kinase inhibitor|fructose 6-phosphate 2-kinase inhibitors|phosphofructokinase 2 inhibitor|phosphofructokinase 2 inhibitors (6-phosphofructo-2-kinase) inhibitors|6-phosphofructo-2-kinase (phosphorylating) inhibitor|6-phosphofructo-2-kinase (phosphorylating) inhibitors|6-phosphofructo-2-kinase inhibitor|6-phosphofructo-2-kinase inhibitors|6-phosphofructose 2-kinase inhibitor|6-phosphofructose 2-kinase inhibitors|EC 2.7.1.105 inhibitor|EC 2.7.1.105 inhibitors|fructose 6-phosphate 2-kinase inhibitor|fructose 6-phosphate 2-kinase inhibitors|phosphofructokinase 2 inhibitor|phosphofructokinase 2 inhibitors http://purl.obolibrary.org/obo/CHEBI_144387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144432 biolink:ChemicalEntity myricitrin(1-) A flavonoid oxoanion that is the conjugate base of myricitrin arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3. pubmed:18534639|pubmed:29967287 Graph myricetin 3-O-alpha-L-rhamnoside|myricitrin anion myricetin 3-O-alpha-L-rhamnoside|myricitrin anion http://purl.obolibrary.org/obo/CHEBI_144432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144490 biolink:ChemicalEntity (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate A 2-hydroxy-6-oxo-2,4-heptadienoate which has 2Z,4E configuration. Obtained by deprotonation of the carboxy group of (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid, it is the major species at pH 7.3. metacyc.compound:CPD-8782|pubmed:1916282 Graph (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate http://purl.obolibrary.org/obo/CHEBI_144490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144513 biolink:ChemicalEntity (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid A 2-hydroxy-6-oxohepta-2,4-dienoic acid which has 2Z,4E configuration. metacyc.compound:CPD-8782|pubmed:1916282 Graph (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid http://purl.obolibrary.org/obo/CHEBI_144513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144550 biolink:ChemicalEntity alpha-D-mannosyl-4''-O-queuosine 5'-phosphate zwitterion residue A zwitterionic group obtained by transfer of a proton from the phosphate to the amino group of α-D-mannosyl-4''-O-queuosine 5'-phosphate residue; major species at pH 7.3. metacyc.compound:CPD-8536|pubmed:20603|pubmed:25884661|pubmed:34880214 Graph alpha-D-allyl-mannosyl-O-queuosine 5'-phosphate zwitterion residue alpha-D-allyl-mannosyl-O-queuosine 5'-phosphate zwitterion residue http://purl.obolibrary.org/obo/CHEBI_144550 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144551 biolink:ChemicalEntity 4-(diethylamino)but-2-yn-1-ol A carboxylic ester resulting from the formal condensation of the carboxy group of cyclohexyl(hydroxy)phenylacetic acid with the hydroxy group of 4-(diethylamino)but-2-yn-1-ol. Graph 4-(diethylamino)but-2-yn-1-ol|alpha-cyclohexyl-alpha-hydroxybenzeneacetic acid 4-(diethylamino)-2-butynyl ester 4-(diethylamino)but-2-yn-1-ol 4-(diethylamino)but-2-yn-1-ol|alpha-cyclohexyl-alpha-hydroxybenzeneacetic acid 4-(diethylamino)-2-butynyl ester http://purl.obolibrary.org/obo/CHEBI_144551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144552 biolink:ChemicalEntity (R)-oxybutynin A 4-(diethylamino)but-2-yn-1-ol that has R configuration. It is responsible for virtually all of the antimuscarinic activity of (racemic) oxybutynin. cas:119618-21-2|patent:EP1286591|patent:US6123961|patent:WO0193683|pubmed:17473442|pubmed:24036364|pubmed:25215879 Graph 4-(diethylamino)but-2-yn-1-yl (2R)-cyclohexyl(hydroxy)phenylacetate 4-(diethylamino)but-2-yn-1-yl (2R)-cyclohexyl(hydroxy)phenylacetate 4-(diethylamino)but-2-yn-1-yl (2R)-cyclohexyl(hydroxy)phenylacetate http://purl.obolibrary.org/obo/CHEBI_144552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144554 biolink:ChemicalEntity 5'-phosphonucleoside 3'-diphosphate(5-) metacyc.compound:5-PHOSPHONUCLEOSIDE-3-DIPHOSPHATE Graph a 5'-phosphonucleoside 3'-diphosphate a 5'-phosphonucleoside 3'-diphosphate http://purl.obolibrary.org/obo/CHEBI_144554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144561 biolink:ChemicalEntity 3beta-hydroxyparthenolide Compound 524 in Scheme 3 from pmid:30468448. Produced by the same enzyme that produces CHEBI:144560 metacyc.compound:CPD-16767|pubmed:30468448 Graph 3beta-hydroxyparthenolide 3beta-hydroxyparthenolide http://purl.obolibrary.org/obo/CHEBI_144561 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144635 biolink:ChemicalEntity D-2,4-diaminobutyric acid A 2,4-diaminobutyric acid that has R-configuration. cas:26908-94-1|pdb-ccd:4FO|pubmed:11192081|pubmed:29710894|pubmed:30387709|pubmed:5074579 Graph (2R)-2,4-diaminobutanoic acid|(2R)-2,4-diaminobutyric acid|(R)-2,4-diaminobutanoic acid|(R)-2,4-diaminobutyric acid|D-DAB (2R)-2,4-diaminobutanoic acid (2R)-2,4-diaminobutanoic acid|(2R)-2,4-diaminobutyric acid|(R)-2,4-diaminobutanoic acid|(R)-2,4-diaminobutyric acid|D-DAB http://purl.obolibrary.org/obo/CHEBI_144635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144637 biolink:ChemicalEntity 4-hydroxy-D-proline The D-stereoisomer of 4-hydroxyproline. Graph (2R)-4-hydroxypyrrolidine-2-carboxylic acid|4-OH-D-Pro|4-hydroxy-D-Pro|4-hydroxy-D-proline 4-hydroxy-D-proline (2R)-4-hydroxypyrrolidine-2-carboxylic acid|4-OH-D-Pro|4-hydroxy-D-Pro|4-hydroxy-D-proline http://purl.obolibrary.org/obo/CHEBI_144637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144644 biolink:ChemicalEntity a tetracycline zwitterion Graph a tetracycline a tetracycline http://purl.obolibrary.org/obo/CHEBI_144644 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14469 biolink:ChemicalEntity isomethyleugenol beilstein:880472|cas:93-16-3 Graph 1,2-dimethoxy-4-(prop-1-en-1-yl)benzene|1,3,4-Isoeugenol methyl ether|1-Veratryl-1-propene|4-Propenylveratrole|Isoeugenol methyl ether|Isoeugenyl methyl ether|Isohomogenol|Methylisoeugenol 1,2-dimethoxy-4-(prop-1-en-1-yl)benzene 1,2-dimethoxy-4-(prop-1-en-1-yl)benzene|1,3,4-Isoeugenol methyl ether|1-Veratryl-1-propene|4-Propenylveratrole|Isoeugenol methyl ether|Isoeugenyl methyl ether|Isohomogenol|Methylisoeugenol http://purl.obolibrary.org/obo/CHEBI_14469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144697 biolink:ChemicalEntity N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine(2-) A dicarboxylic acid dianion resulting from the deprotonation of both of the carboxy groups of N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine. The major species at pH 7.3. pubmed:28373563|pubmed:30692244 Graph 5-({(2S)-1-[(carboxylatomethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoate|N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine|N-(4-carboxylato-4-oxobutanoyl)-L-ethylglycylglycinate|N-[(2S)-2-(4-carboxylato-4-oxobutanoylamino)butanoyl]glycinate 5-({(2S)-1-[(carboxylatomethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoate 5-({(2S)-1-[(carboxylatomethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoate|N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine|N-(4-carboxylato-4-oxobutanoyl)-L-ethylglycylglycinate|N-[(2S)-2-(4-carboxylato-4-oxobutanoylamino)butanoyl]glycinate http://purl.obolibrary.org/obo/CHEBI_144697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144699 biolink:ChemicalEntity N-[(2S)-2-ammoniobutanoyl]glycinate A zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of N-[(2S)-2-aminobutanoyl]glycine. The major species at pH 7.3. pubmed:30692244 Graph N-(2-aminobutanoyl)glycine|N-[(2S)-ammoniobutanoyl]glycinate|{[(2S)-2-azaniumylbutanoyl]amino}acetate {[(2S)-2-azaniumylbutanoyl]amino}acetate N-(2-aminobutanoyl)glycine|N-[(2S)-ammoniobutanoyl]glycinate|{[(2S)-2-azaniumylbutanoyl]amino}acetate http://purl.obolibrary.org/obo/CHEBI_144699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1447 biolink:ChemicalEntity 3-acylpyruvic acid A dioxo monocarboxylic acid that is pyruvic acid substituted by an acyl group at position 3. Graph http://purl.obolibrary.org/obo/CHEBI_1447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144703 biolink:ChemicalEntity N-palmitoyl-sphingoid base A ceramide where the N-acyl is a palmitoyl chain but the sphingoid base is not defined Graph an N-hexadecanoyl-sphingoid base|palmitoylceramide an N-hexadecanoyl-sphingoid base|palmitoylceramide http://purl.obolibrary.org/obo/CHEBI_144703 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144711 biolink:ChemicalEntity N-stearoyl-sphingoid base Graph a stearoyl-ceramide|an N-octadecanoyl-sphingoid base a stearoyl-ceramide|an N-octadecanoyl-sphingoid base http://purl.obolibrary.org/obo/CHEBI_144711 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144712 biolink:ChemicalEntity N-(very-long-chain fatty acyl)-sphingoid base A ceramide where the acyl chain chain length is greater than C22 and the sphingoid base is undefined Graph an N-(very-long-chain fatty acyl)-sphingoid base|very-long-chain fatty acyl ceramide an N-(very-long-chain fatty acyl)-sphingoid base|very-long-chain fatty acyl ceramide http://purl.obolibrary.org/obo/CHEBI_144712 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144713 biolink:ChemicalEntity N-(ultra-long-chain-acyl)-sphingoid base A ceramide where the acyl chain chain length is greater than C27 and the sphingoid base is undefined Graph an N-(ultra-long-chain-acyl)-sphingoid base|ultra-long-chain acyl ceramide an N-(ultra-long-chain-acyl)-sphingoid base|ultra-long-chain acyl ceramide http://purl.obolibrary.org/obo/CHEBI_144713 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144720 biolink:ChemicalEntity inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base(1-) An inositol phosphoceramide (1−) in which the acyl chain length is greater than C22 and hydroxylated at position 2 and the ceramide base is hydroxylated at position 4. pubmed:9323360 Graph an inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base|inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base an inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base|inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base http://purl.obolibrary.org/obo/CHEBI_144720 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144728 biolink:ChemicalEntity N-[(2S)-2-aminobutanoyl]glycine A dipeptide resulting from the formal condensation of the carboxy group of L-α-aminobutyric acid [(2S)-2-aminobutanoic acid] with the amino group of glycine. pubmed:30692244 Graph 2-[(2S)-2-aminobutanamido]acetic acid|H-Abu-Gly-OH|N-(L-alpha-aminobutanoyl)glycine|N-[(2S)-2-aminobutanoyl]glycine|{[(2S)-2-aminobutanoyl]amino}acetic acid N-(L-alpha-aminobutanoyl)glycine|N-[(2S)-2-aminobutanoyl]glycine 2-[(2S)-2-aminobutanamido]acetic acid|H-Abu-Gly-OH|N-(L-alpha-aminobutanoyl)glycine|N-[(2S)-2-aminobutanoyl]glycine|{[(2S)-2-aminobutanoyl]amino}acetic acid http://purl.obolibrary.org/obo/CHEBI_144728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144729 biolink:ChemicalEntity L-beta-ethynylserine zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy group to the amino group of L-β-ethynylserine. The major species at pH 7.3. pubmed:3082841|pubmed:30867596 Graph (2S,3R)-2-azaniumyl-3-hydroxypent-4-ynoate|2-azaniumyl-2,4,5-trideoxy-D-threo-pent-4-ynonate|L-beta-ethynylserine zwitterion 2-azaniumyl-2,4,5-trideoxy-D-threo-pent-4-ynonate (2S,3R)-2-azaniumyl-3-hydroxypent-4-ynoate|2-azaniumyl-2,4,5-trideoxy-D-threo-pent-4-ynonate|L-beta-ethynylserine zwitterion http://purl.obolibrary.org/obo/CHEBI_144729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144773 biolink:ChemicalEntity anthocyanidin 3-O-beta-D-glucoside 5-O-beta-D-[(6-O-(E)-4-coumaroyl)glucoside] betaine An oxonium betaine obtained by deprotonation of the 7-hydroxy group of anthocyanidin 3-O-β-D-glucoside 5-O-β-D-[(6-O-4-hydroxycinnamoyl)glucoside]. It is the major microspecies at pH 7.3 Graph an anthocyanidin 3-O-beta-D-glucoside 5-O-beta-D-[(6-O-(E)-4-coumaroyl)glucoside] an anthocyanidin 3-O-beta-D-glucoside 5-O-beta-D-[(6-O-(E)-4-coumaroyl)glucoside] http://purl.obolibrary.org/obo/CHEBI_144773 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144774 biolink:ChemicalEntity linoleoyl containing 1,2,3-triacyl-sn-glycerol A triglyceride where at least one of R1, R2 or R3 is a linoleoyl group. Formula is C23H36O6R2 Graph a (9Z,12Z)-octadecadienoyl-containing triacyl-sn-glycerol a (9Z,12Z)-octadecadienoyl-containing triacyl-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_144774 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144775 biolink:ChemicalEntity delphinidin(1-) An organic anion obtained by selective deprotonation of the 3- and 5-hydroxy groups of delphinidin; major species at pH 7.3. metacyc.compound:CPD-7090 Graph 7-hydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate)|7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-3,5-bis(olate)|delphinidin 7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-3,5-bis(olate) 7-hydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate)|7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-3,5-bis(olate)|delphinidin http://purl.obolibrary.org/obo/CHEBI_144775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144776 biolink:ChemicalEntity delphinidin 3-O-beta-D-glucoside betaine An oxonium betaine obtained by deprotonation of the 5 position of delfinidin 3-O-β-D-glucoside. It is the major microspecies at pH 7.3. Graph 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-5-olate|delphinidin 3-O-beta-D-glucoside 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-5-olate 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-5-olate|delphinidin 3-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_144776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144777 biolink:ChemicalEntity pelargonidin(1-) An organic anion obtained by selective deprotonation of the 3- and 5-hydroxy groups of pelargonidin; major species at pH 7.3. metacyc.compound:PELARGONIDIN-CMPD Graph 7-hydroxy-2-(4-hydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate)|7-hydroxy-2-(4-hydroxyphenyl)chromenium-3,5-bis(olate)|pelargonidin 7-hydroxy-2-(4-hydroxyphenyl)chromenium-3,5-bis(olate) 7-hydroxy-2-(4-hydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate)|7-hydroxy-2-(4-hydroxyphenyl)chromenium-3,5-bis(olate)|pelargonidin http://purl.obolibrary.org/obo/CHEBI_144777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144778 biolink:ChemicalEntity pelargonidin 3-O-beta-D-glucoside betaine An organic betaine obtained by deprotonation of the hydroxy group at the 5 position of pelargonidin 3-O-β-D-glucoside. It is the major microspecies at pH 7.3. Graph 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxyphenyl)chromenium-5-olate|pelargonidin 3-O-beta-D-glucoside 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxyphenyl)chromenium-5-olate 3-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxyphenyl)chromenium-5-olate|pelargonidin 3-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_144778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144784 biolink:ChemicalEntity omega-hydroxy-ultra-long chain fatty acylceramide A ceramide with no defined sphingoid base and an N-omega-hydroxyacyl chain length greater than C27 pubmed:28248318 Graph an N-(omega-hydroxy-ultra-long chain fatty acyl)-sphingoid base an N-(omega-hydroxy-ultra-long chain fatty acyl)-sphingoid base http://purl.obolibrary.org/obo/CHEBI_144784 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144785 biolink:ChemicalEntity omega-linoleoyloxy-O-ultra-long chain acylceramide A ceramide with no defined sphingoid base and a linoleoyl group esterified to a N-omega-hydroxyacyl chain length greater than C27 pubmed:28248318 Graph an N-[omega-(9Z,12Z-octadecadienoyloxy)-O-ultra-long chain fatty acyl]-sphingoid base an N-[omega-(9Z,12Z-octadecadienoyloxy)-O-ultra-long chain fatty acyl]-sphingoid base http://purl.obolibrary.org/obo/CHEBI_144785 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144817 biolink:ChemicalEntity 2-ammonio-2-deoxy-D-galactopyranose A primary ammonium ion resulting from the protonation of the amino group of 2-amino-2-deoxy-D-galactopyranose. Major species at pH 7.3. Graph D-galactosamine D-galactosamine http://purl.obolibrary.org/obo/CHEBI_144817 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144829 biolink:ChemicalEntity tumour antigen An antigenic substance produced in tumour cells, which triggers an immune response in the host. wikipedia.en:Tumor_antigen Graph tumour antigens tumour antigens http://purl.obolibrary.org/obo/CHEBI_144829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144833 biolink:ChemicalEntity L-beta-ethynylserine A non-proteinogenic L-α-amino acid that is L-propargylglycine which is carrying a hydroxy group at the 3R position. cas:64918-85-0|cas:65207-64-9|pubmed:3082841 Graph (2S,3R)-2-amino-3-hydroxy-4-pentynoic acid|(2S,3R)-2-amino-3-hydroxypent-4-ynoic acid|2-amino-2,4,5-trideoxy-D-threo-pent-4-ynonic acid|L-beta-ethynylserine|beta-ethynylserine 2-amino-2,4,5-trideoxy-D-threo-pent-4-ynonic acid (2S,3R)-2-amino-3-hydroxy-4-pentynoic acid|(2S,3R)-2-amino-3-hydroxypent-4-ynoic acid|2-amino-2,4,5-trideoxy-D-threo-pent-4-ynonic acid|L-beta-ethynylserine|beta-ethynylserine http://purl.obolibrary.org/obo/CHEBI_144833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144842 biolink:ChemicalEntity N(6)-methyl-AMP(2-) A nucleoside 5'-monophosphate(2−) that results from the removal of two protons from the phosphate group of N6-methyl-AMP. pubmed:29884623 Graph N(6)-methyl-AMP|N(6)-methyl-AMP dianion|N(6)-methyladenosine 5'-monophosphate dianion|N(6)-methyladenosine 5'-monophosphate(2-)|N-methyl-5'-O-phosphonatoadenosine N-methyl-5'-O-phosphonatoadenosine N(6)-methyl-AMP|N(6)-methyl-AMP dianion|N(6)-methyladenosine 5'-monophosphate dianion|N(6)-methyladenosine 5'-monophosphate(2-)|N-methyl-5'-O-phosphonatoadenosine http://purl.obolibrary.org/obo/CHEBI_144842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144889 biolink:ChemicalEntity D-xylulofuranose chemspider:388344 Graph http://purl.obolibrary.org/obo/CHEBI_144889 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144897 biolink:ChemicalEntity 1-piperideinium An iminium ion obtained by protonation of the imino group of 1-piperideine; major microspecies at pH 7.3. Graph 1-piperideine|2,3,4,5-tetrahydropyridin-1-ium|2,3,4,5-tetrahydropyridinium 2,3,4,5-tetrahydropyridinium 1-piperideine|2,3,4,5-tetrahydropyridin-1-ium|2,3,4,5-tetrahydropyridinium http://purl.obolibrary.org/obo/CHEBI_144897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1449 biolink:ChemicalEntity 3-amino-2-oxopropyl phosphate A oxoalkyl phosphate having 3-amino-2-oxopropyl as the oxoalkyl group. kegg.compound:C11638 Graph 1-Amino-3-(phosphohydroxy)propan-2-one|3-Amino-2-oxopropyl phosphate|3-amino-2-oxopropyl dihydrogen phosphate 3-amino-2-oxopropyl dihydrogen phosphate 1-Amino-3-(phosphohydroxy)propan-2-one|3-Amino-2-oxopropyl phosphate|3-amino-2-oxopropyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_1449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144968 biolink:ChemicalEntity N(6)-(2-hydroxyisobutanoyl)-L-lysine residue An N6-acyl-L-lysine residue derived from N6-(2-hydroxyisobutanoyl)-L-lysine. pubmed:24681537|pubmed:27924077|pubmed:28768809|pubmed:29775581 Graph Khib residue|N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine residue|N(6)-(2-hydroxyisobutanoyl)-L-lysine residue|N(6)-(2-hydroxyisobutyryl)-L-lysine residue N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine residue Khib residue|N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine residue|N(6)-(2-hydroxyisobutanoyl)-L-lysine residue|N(6)-(2-hydroxyisobutyryl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_144968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144969 biolink:ChemicalEntity 2''-O-(2-hydroxyisobutanoyl)-ADP-D-ribose(2-) A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups of 2''-O-(2-hydroxyisobutanoyl)-ADP-D-ribose; major species at pH 7.3. Graph 2''-O-(2-hydroxyisobutanoyl)-ADP-D-ribose 2''-O-(2-hydroxyisobutanoyl)-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_144969 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:144981 biolink:ChemicalEntity EC 3.6.5.2 (small monomeric GTPase) inhibitor "Any EC 3.6.5.* (hydrolases acting on GTP; involved in cellular and subcellular movement) inhibitor that interferes with the action of small monomeric GTPase (EC 3.6.5.2)." Graph EC 3.6.5.2 (small monomeric GTPase) inhibitors|EC 3.6.5.2 inhibitor|EC 3.6.5.2 inhibitors|GTP phosphohydrolase (cell-regulating) inhibitor|GTP phosphohydrolase (cell-regulating) inhibitors|small monomeric GTPase (EC 3.6.5.2) inhibitor|small monomeric GTPase (EC 3.6.5.2) inhibitors|small monomeric GTPase inhibitor|small monomeric GTPase inhibitors EC 3.6.5.2 (small monomeric GTPase) inhibitors|EC 3.6.5.2 inhibitor|EC 3.6.5.2 inhibitors|GTP phosphohydrolase (cell-regulating) inhibitor|GTP phosphohydrolase (cell-regulating) inhibitors|small monomeric GTPase (EC 3.6.5.2) inhibitor|small monomeric GTPase (EC 3.6.5.2) inhibitors|small monomeric GTPase inhibitor|small monomeric GTPase inhibitors http://purl.obolibrary.org/obo/CHEBI_144981 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:144984 biolink:ChemicalEntity NSC 23766 "An aminopyrimidine that is 6-methylpyrimidine-2,4-diamine in which the amino groups at positions 2 and 4 are substituted by 5-(diethylamino)pentan-2-yl and 4-amino-2-methylquinolin-6-yl groups respectively. An inhibitor of the signalling G-protein known as RAC1 (Ras-related C3 botulinum toxin substrate 1)." lincs.smallmolecule:LSM-1818|pubmed:15128949|pubmed:18183417|pubmed:19052208|pubmed:19491337|pubmed:20515940|pubmed:21511011|pubmed:23887096|pubmed:24257023|pubmed:24523909|pubmed:24953831|pubmed:25154784|pubmed:25319697|pubmed:25628054|pubmed:25631101|pubmed:27467102|pubmed:29050986|pubmed:30871916 Graph N(6)-(2-{[5-(diethylamino)pentan-2-yl]amino}-6-methylpyrimidin-4-yl)-2-methylquinoline-4,6-diamine|N6-[2-[5-(diethylamino)pentan-2-ylamino]-6-methyl-4-pyrimidinyl]-2-methylquinoline-4,6-diamine|NSC-23766|NSC23766 N(6)-(2-{[5-(diethylamino)pentan-2-yl]amino}-6-methylpyrimidin-4-yl)-2-methylquinoline-4,6-diamine N(6)-(2-{[5-(diethylamino)pentan-2-yl]amino}-6-methylpyrimidin-4-yl)-2-methylquinoline-4,6-diamine|N6-[2-[5-(diethylamino)pentan-2-ylamino]-6-methyl-4-pyrimidinyl]-2-methylquinoline-4,6-diamine|NSC-23766|NSC23766 http://purl.obolibrary.org/obo/CHEBI_144984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:144987 biolink:ChemicalEntity sphingosine-1-phosphate receptor antagonist An antagonist that binds to and blocks sphingosine 1-phosphate receptors, a class of G protein-coupled receptors that are targets of the lipid signalling molecule sphingosine-1-phosphate (S1P). Graph EDG receptor antagonist|S1P receptor antagonist|S1P receptor antagonists|SIP antagonist|SIP antagonists|sphingosine 1-phosphate receptor antagonist|sphingosine 1-phosphate receptor antagonists|sphingosine-1-phosphate receptor antagonists EDG receptor antagonist|S1P receptor antagonist|S1P receptor antagonists|SIP antagonist|SIP antagonists|sphingosine 1-phosphate receptor antagonist|sphingosine 1-phosphate receptor antagonists|sphingosine-1-phosphate receptor antagonists http://purl.obolibrary.org/obo/CHEBI_144987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145009 biolink:ChemicalEntity steviolbioside(1-) A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of steviolbioside. The major species at pH 7.3. metacyc.compound:CPD-14503|pubmed:15610349 Graph steviolbioside|steviolbioside anion steviolbioside|steviolbioside anion http://purl.obolibrary.org/obo/CHEBI_145009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145010 biolink:ChemicalEntity steviolmonoside(1-) A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of steviolmonoside. The major species at pH 7.3. metacyc.compound:CPD-14502|pubmed:15610349|pubmed:31324778 Graph steviolmonoside steviolmonoside http://purl.obolibrary.org/obo/CHEBI_145010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145011 biolink:ChemicalEntity steviol(1-) A monocarboxylic acid anion that is the conjugate base of steviol, obtained by deprotonation of the carboxy group. metacyc.compound:CPD-14501|pubmed:15610349|pubmed:31324778 Graph 13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate|steviol 13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate 13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate|steviol http://purl.obolibrary.org/obo/CHEBI_145011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145012 biolink:ChemicalEntity rebaudioside A A rebaudioside that is rubusoside in which the hydroxy groups at positions 3 and 4 of the β-D-glucopyranosyloxy group at the 13α position have both been converted to the corresponding β-D-glucopyranoside. agr:IND606339833|cas:58543-16-1|foodb.food:FDB013543|hmdb:HMDB0034950|knapsack:C00023175|metacyc.compound:CPD-14506|pubmed:15610349|pubmed:25353385|pubmed:26776281|pubmed:27352150|pubmed:27638403|pubmed:28218969|pubmed:29262312|pubmed:29355553|pubmed:29433626|pubmed:29461634|pubmed:29655729|pubmed:30291959|pubmed:30666114|pubmed:30883860|pubmed:31030274|pubmed:31159256|pubmed:31324778|wikipedia.en:Rebaudioside_A Graph 1-O-(13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl)-beta-D-glucopyranose|13-[(2-O-beta-D-glucopyranosyl-3-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-ent-kaur-16-en-19-oic acid beta-D-glucopyranosyl ester|19-O-beta-glucopyranosyl-13-O-(beta-glucopyranosyl(1-2)-beta-glucopyranosyl(1-3))-beta-glucopyranosyl-13-hydroxykaur-16-en-19-oic acid|19-O-beta-glucopyranosyl-13-O-(beta-glucopyranosyl(1-2)-beta-glucopyranosyl(1-3))-beta-glucopyranosylsteviol|Reb A|Reb-A|Stevia|Sweetener 4G-S|rebaudioside A|rebaudioside-A 1-O-(13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl)-beta-D-glucopyranose 1-O-(13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl)-beta-D-glucopyranose|13-[(2-O-beta-D-glucopyranosyl-3-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-ent-kaur-16-en-19-oic acid beta-D-glucopyranosyl ester|19-O-beta-glucopyranosyl-13-O-(beta-glucopyranosyl(1-2)-beta-glucopyranosyl(1-3))-beta-glucopyranosyl-13-hydroxykaur-16-en-19-oic acid|19-O-beta-glucopyranosyl-13-O-(beta-glucopyranosyl(1-2)-beta-glucopyranosyl(1-3))-beta-glucopyranosylsteviol|Reb A|Reb-A|Stevia|Sweetener 4G-S|rebaudioside A|rebaudioside-A http://purl.obolibrary.org/obo/CHEBI_145012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145013 biolink:ChemicalEntity rebaudioside B(1-) A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of rebaudioside B. The major species at pH 7.3. metacyc.compound:CPD-14507|pubmed:15610349|pubmed:31324778 Graph 13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate|rebaudioside B|rebaudioside B anion|stevioside a4(1-) 13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate 13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oate|rebaudioside B|rebaudioside B anion|stevioside a4(1-) http://purl.obolibrary.org/obo/CHEBI_145013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145015 biolink:ChemicalEntity 3''-O-propanoyl-ADP-D-ribose(2-) A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups of 3''-O-butanoyl-ADP-D-ribose; major species at pH 7.3. Graph 3''-O-propanoyl-ADP-D-ribose|3''-O-propionyl-ADP-D-ribose 3''-O-propanoyl-ADP-D-ribose|3''-O-propionyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_145015 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145021 biolink:ChemicalEntity rubusoside A steviol glycoside that is steviol in which both the carboxy group and the tertiary allylic hydroxy group have been converted to their corresponding β-D-glucosides. A precious bioactive natural sweetener which mainly exists the in Chinese sweet tea plant, Rubus suavissimus. metacyc.compound:CPD-14505|pubmed:15610349 Graph 1-O-[13alpha-(beta-D-glucopyranosyloxy)-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl]-beta-D-glucopyranose|rubusoside 1-O-[13alpha-(beta-D-glucopyranosyloxy)-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl]-beta-D-glucopyranose 1-O-[13alpha-(beta-D-glucopyranosyloxy)-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl]-beta-D-glucopyranose|rubusoside http://purl.obolibrary.org/obo/CHEBI_145021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145023 biolink:ChemicalEntity rebaudioside "Any of the steviol glycosides found in the leaves of the stevia plant, Stevia rebaudiana. They are typically more than 100 times sweeter than sucrose." pubmed:21464800|pubmed:21489412|pubmed:21527882|pubmed:21798525|pubmed:24361573|pubmed:24758242|pubmed:26924787|pubmed:27119206|pubmed:27428112|pubmed:27979591|pubmed:28762654|pubmed:30769819 Graph rebaudiosides rebaudiosides http://purl.obolibrary.org/obo/CHEBI_145023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145024 biolink:ChemicalEntity steviol An ent-kaurane diterpenoid that is 5β,8α,9β,10α-kaur-16-en-18-oic acid in which the hydrogen at position 13 has been replaced by a hydroxy group. agr:IND605891739|cas:471-80-7|foodb.food:FDB015642|hmdb:HMDB0036706|kegg.compound:C20212|knapsack:C00034695|metacyc.compound:CPD-14501|pubmed:15610349|pubmed:28903608|pubmed:29064007|pubmed:29892740|pubmed:29899860|pubmed:31182573|pubmed:31324778|wikipedia.en:Steviol Graph (-)-steviol|(14-alpha)-13-hydroxykaur-16-en-18-oic acid|13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|hydroxydehydrostevic acid 13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid (-)-steviol|(14-alpha)-13-hydroxykaur-16-en-18-oic acid|13alpha-hydroxy-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|hydroxydehydrostevic acid http://purl.obolibrary.org/obo/CHEBI_145024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145026 biolink:ChemicalEntity L-psicose The L-enantiomer of psicose. cas:16354-64-6|pubmed:16243286|pubmed:19111643|pubmed:25888171|pubmed:26020767|pubmed:27262904|pubmed:27713017 Graph (3S,4S,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-allulose|L-psicose|L-ribo-2-hexulose L-psicose (3S,4S,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-allulose|L-psicose|L-ribo-2-hexulose http://purl.obolibrary.org/obo/CHEBI_145026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145027 biolink:ChemicalEntity steviol glycoside A diterpene glycoside derived from steviol by formal esterification of the carboxy group with glucose (or a glucose derivative) and glycosylation of the tertiary hydroxy group with combinations of glucose and rhamnose to give the corresponding glycosides. pubmed:29537255|pubmed:29863335|pubmed:30466787|pubmed:30506508|pubmed:30897351|pubmed:31063378|pubmed:31195254|pubmed:31295559|pubmed:31438580|pubmed:31491712|wikipedia.en:Steviol_glycoside Graph steviol glycosides steviol glycosides http://purl.obolibrary.org/obo/CHEBI_145027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145029 biolink:ChemicalEntity steviolmonoside A β-D-glucoside resulting from the formal condensation the tertiary allylic hydroxy group of steviol with β-D-glucopyranose. cas:60129-60-4|knapsack:C00034697|metacyc.compound:CPD-14502|pubmed:12436720|pubmed:15610349|pubmed:17397883|pubmed:1814608|pubmed:21477883|pubmed:27642557|pubmed:31324778|pubmed:7646064 Graph 13-O-beta-D-glucopyranosyl steviol|13alpha-(beta-D-glucopyranosyloxy)-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|glucosilsteviol|steviol-13-O-D-glucopyranoside|steviolmonoside 13alpha-(beta-D-glucopyranosyloxy)-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid 13-O-beta-D-glucopyranosyl steviol|13alpha-(beta-D-glucopyranosyloxy)-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|glucosilsteviol|steviol-13-O-D-glucopyranoside|steviolmonoside http://purl.obolibrary.org/obo/CHEBI_145029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145030 biolink:ChemicalEntity steviolbioside A β-D-glucoside that is steviolmonoside in which the hydroxy group at position 2 of the glucoside moiety has been converted into its β-D-glucoside. cas:41093-60-1|drugbank:DB12434|foodb.food:FDB015643|hmdb:HMDB0036707|knapsack:C00034696|lipidmaps:LMPR01040122|metacyc.compound:CPD-14503|pubmed:15340201|pubmed:15610349|pubmed:1814608|pubmed:22096997|pubmed:26003514|pubmed:26593477|pubmed:26924787|pubmed:27513814|pubmed:27642557|pubmed:27784241|pubmed:28242916|pubmed:30897351|pubmed:32563799|pubmed:33218179|pubmed:34023281 Graph (-)-steviolbioside|13alpha-[(2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid 13alpha-[(2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid (-)-steviolbioside|13alpha-[(2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid http://purl.obolibrary.org/obo/CHEBI_145030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145039 biolink:ChemicalEntity polyunsaturated fatty ester Any fatty acid ester resulting from the formal esterification of the carboxy group of a polyunsaturated fatty acid. Graph polyunsaturated fatty acid ester|polyunsaturated fatty acid esters|polyunsaturated fatty esters polyunsaturated fatty acid ester|polyunsaturated fatty acid esters|polyunsaturated fatty esters http://purl.obolibrary.org/obo/CHEBI_145039 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145047 biolink:ChemicalEntity antispermatogenic agent An agent that destroy spermatozoa in the male genitalia and block spermatogenesis. pubmed:16371305 Graph antispermatogenic|antispermatogenic agents|antispermatogenics antispermatogenic|antispermatogenic agents|antispermatogenics http://purl.obolibrary.org/obo/CHEBI_145047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145072 biolink:ChemicalEntity campesterol 3-beta-D-glucoside A sterol 3-β-D-glucoside resulting from the formal condensation of the hydroxy group of campesterol with β-D-glucopyranose. Found in cloves, common wheat, and peaches. cas:32214-82-7|foodb.food:FDB021715|lipidmaps:LMST01031126|pubmed:23463370|pubmed:25575593|pubmed:26643965|pubmed:28649260 Graph (24R)-ergost-5-en-3beta-yl beta-D-glucopyranoside|(3beta)-campest-5-en-3-yl D-glucopyranoside|3-O-(beta-D-glucopyranosyl)-campest-5-en-3beta-ol|campest-5-en-3beta-yl D-glucopyranoside|campesterol beta-D-glucoside|campesteryl 3-beta-D-glucoside|campesteryl beta-D-glucoside|campesteryl glucoside (24R)-ergost-5-en-3beta-yl beta-D-glucopyranoside (24R)-ergost-5-en-3beta-yl beta-D-glucopyranoside|(3beta)-campest-5-en-3-yl D-glucopyranoside|3-O-(beta-D-glucopyranosyl)-campest-5-en-3beta-ol|campest-5-en-3beta-yl D-glucopyranoside|campesterol beta-D-glucoside|campesteryl 3-beta-D-glucoside|campesteryl beta-D-glucoside|campesteryl glucoside http://purl.obolibrary.org/obo/CHEBI_145072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145078 biolink:ChemicalEntity 3-oxo aldehyde Any aldehyde having an oxo substituent at the 3-position. Graph 3-oxo aldehydes|3-oxo-aldehyde|3-oxo-aldehydes|3-oxoaldehyde|beta-oxo-aldehyde|beta-oxo-aldehydes 3-oxo aldehydes|3-oxo-aldehyde|3-oxo-aldehydes|3-oxoaldehyde|beta-oxo-aldehyde|beta-oxo-aldehydes http://purl.obolibrary.org/obo/CHEBI_145078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145122 biolink:ChemicalEntity SKF-96365 free base An ether that is 2-(1H-imidazol-1-yl)-1-(4-methoxyphenyl)ethanol in which the hydrogen of the hydroxy group has been substituted by a 3-(4-methoxyphenyl)propyl group. lincs.smallmolecule:LSM-1766|pubmed:25218985 Graph 1-(2-(3-(4-methoxyphenyl)propoxy)-4-methoxyphenylethyl)-1H-imidazole|1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazole|SK&F-96365 free base 1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazole 1-(2-(3-(4-methoxyphenyl)propoxy)-4-methoxyphenylethyl)-1H-imidazole|1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazole|SK&F-96365 free base http://purl.obolibrary.org/obo/CHEBI_145122 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145128 biolink:ChemicalEntity SKF-96365 free base(1+) An organic cation obtained by protonation of the imidazole group of SKF-96365 free base. Graph 1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazol-3-ium|SKF-96365 cation 1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazol-3-ium 1-{2-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)propoxy]ethyl}-1H-imidazol-3-ium|SKF-96365 cation http://purl.obolibrary.org/obo/CHEBI_145128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145181 biolink:ChemicalEntity 1-O-(1Z-hexadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion pubmed:31604315 Graph 1-O-(Z)-hexadec-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion|a 1-O-(1Z-hexadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine 1-O-(Z)-hexadec-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion|a 1-O-(1Z-hexadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_145181 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145217 biolink:ChemicalEntity epoxy steroid Any steroid whose structure includes an epoxy group. Graph epoxy steroids|epoxy-steroid|epoxy-steroids epoxy steroids|epoxy-steroid|epoxy-steroids http://purl.obolibrary.org/obo/CHEBI_145217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145231 biolink:ChemicalEntity N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine A dipeptide that is N-[(2S)-2-aminobutanoyl]glycine in which the terminal amino group has been acylated by formal condensation of the 5-carboxy group of 2-oxopentanedioic acid. pubmed:28373563|pubmed:30692244 Graph 5-({(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoic acid|CLONE_N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine|N-[(2S)-2-(4-carboxy-4-oxobutanoylamino)butanoyl]glycine 5-({(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoic acid 5-({(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}amino)-2,5-dioxopentanoic acid|CLONE_N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine|N-[(2S)-2-(4-carboxy-4-oxobutanoylamino)butanoyl]glycine http://purl.obolibrary.org/obo/CHEBI_145231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145253 biolink:ChemicalEntity hyaluronan synthesis inhibitor "Any inhibitor that interferes with the synthesis of hyaluronic acid (HA, also known as hyaluronan)." pubmed:15373776|pubmed:19444760|pubmed:20332231|pubmed:23288481|pubmed:23426189|pubmed:24141285|pubmed:25537799|pubmed:27706810 Graph HA synthesis inhibitor|HA synthesis inhibitors|hyaluronan synthesis inhibitors|hyaluronic acid synthesis inhibitor|hyaluronic acid synthesis inhibitors HA synthesis inhibitor|HA synthesis inhibitors|hyaluronan synthesis inhibitors|hyaluronic acid synthesis inhibitor|hyaluronic acid synthesis inhibitors http://purl.obolibrary.org/obo/CHEBI_145253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145256 biolink:ChemicalEntity 6,7-dihydroxy-4-methylcoumarin "A hydroxycoumarin that is 4-methylcuomarin which is substituted by hydroxy groups at positions 3 and 4. A hyaluronan synthesis inhibitor. It has also been used as a fluorescent sensor to monitor the consumption of a boronic acid in Suzuki coupling reactions; fluorescence is readily detectable by the naked eye using a standard 365 nm UV lamp." cas:529-84-0|pubmed:17354230|pubmed:20380826|pubmed:21530605|pubmed:22119283|pubmed:23047850|pubmed:23485680|pubmed:23744425|pubmed:25424619|pubmed:25854527|pubmed:26071545|pubmed:2868641|pubmed:29217385|pubmed:29698774|pubmed:3004169|pubmed:3937451|pubmed:508424|pubmed:597417|pubmed:597443|pubmed:597444|pubmed:603704|pubmed:603706|pubmed:6411101|pubmed:6626341|pubmed:6626355|pubmed:7347133 Graph 4-methyl-6,7-dihydroxycoumarin|4-methylaesculetin|4-methylesculetin|4-methylesculetol|6,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one|6,7-dihydroxy-4-methyl-2H-benzopyran-2-one|6,7-dihydroxy-4-methyl-2H-chromen-2-one|6,7-dihydroxy-4-methylchromen-2-one|methylesculetin 6,7-dihydroxy-4-methyl-2H-chromen-2-one 4-methyl-6,7-dihydroxycoumarin|4-methylaesculetin|4-methylesculetin|4-methylesculetol|6,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one|6,7-dihydroxy-4-methyl-2H-benzopyran-2-one|6,7-dihydroxy-4-methyl-2H-chromen-2-one|6,7-dihydroxy-4-methylchromen-2-one|methylesculetin http://purl.obolibrary.org/obo/CHEBI_145256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145324 biolink:ChemicalEntity N(6)-lactoyl-L-lysine residue An N6-acyl-L-lysine residue that has lactoyl as the N6-acyl group. pubmed:31645732 Graph N(6)-(2-hydroxypropanoyl)-L-lysine residue|N(6)-(lactoyl)-L-lysine residue N(6)-(2-hydroxypropanoyl)-L-lysine residue|N(6)-(lactoyl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_145324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145326 biolink:ChemicalEntity 2,3-dehydroamino acid A dehydroamino acid whose side-chain contains a double bond at the 2-3 position. Graph 2,3-dehydroamino acids|alpha,beta-dehydroamino acid|alpha,beta-dehydroamino acids 2,3-dehydroamino acids|alpha,beta-dehydroamino acid|alpha,beta-dehydroamino acids http://purl.obolibrary.org/obo/CHEBI_145326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145348 biolink:ChemicalEntity 6-sulfo-beta-D-quinovose A 6-sulfo-D-quinovose (6-deoxy-6-sulfo-D-glucopyranose) that has β configuration at the anomeric centre. metacyc.compound:CPD-21686|pubmed:29535276 Graph 6-deoxy-6-sulfo-beta-D-glucopyranose|6-sulfo-beta-quinovose 6-deoxy-6-sulfo-beta-D-glucopyranose 6-deoxy-6-sulfo-beta-D-glucopyranose|6-sulfo-beta-quinovose http://purl.obolibrary.org/obo/CHEBI_145348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145351 biolink:ChemicalEntity 3beta-hydroxy-4alpha-hydroxymethyl-4beta-methylsteroid Any 3β-hydroxy steroid which is substituted at the 4α and 4β positions by hydroxymethyl and methyl groups, respectively. Graph http://purl.obolibrary.org/obo/CHEBI_145351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145353 biolink:ChemicalEntity 3beta-hydroxy-4alpha-formyl-4beta-methylsteroid Any 3β-hydroxy steroid which is substituted at the 4α and 4β positions by formyl and methyl groups, respectively. Graph http://purl.obolibrary.org/obo/CHEBI_145353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145373 biolink:ChemicalEntity pexidartinib A pyrrolopyridine that is 5-chloro-1H-pyrrolo[2,3-b]pyridine which is substituted by a [6-({[6-(trifluoromethyl)pyridin-3-yl]methyl}amino)pyridin-3-yl]methyl group at position 3. It is a potent multi-targeted receptor tyrosine kinase inhibitor of CSF-1R, KIT, and FLT3 (IC50 of 20 nM, 10 nM and 160 nM, respectively). Approved by the FDA for the treatment of adult patients with symptomatic tenosynovial giant cell tumor (TGCT). cas:1029044-16-3|drugbank:DB12978|kegg.drug:D11270|pdb-ccd:P31|pmc:PMC6012252|pubmed:26222558|pubmed:26449250|pubmed:30002809|pubmed:30628737|pubmed:30825104|pubmed:30926949|pubmed:31167689|pubmed:31213500|pubmed:31229240|pubmed:31240240|pubmed:31258629|pubmed:31602563|pubmed:31696640|wikipedia.en:Pexidartinib Graph 5-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-{[6-(trifluoromethyl)pyridin-3-yl]methyl}pyridin-2-amine|CML-261|PLX-3397|PLX3397|Turalio|pexidartinib|pexidartinibum 5-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-{[6-(trifluoromethyl)pyridin-3-yl]methyl}pyridin-2-amine 5-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-{[6-(trifluoromethyl)pyridin-3-yl]methyl}pyridin-2-amine|CML-261|PLX-3397|PLX3397|Turalio|pexidartinib|pexidartinibum http://purl.obolibrary.org/obo/CHEBI_145373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145390 biolink:ChemicalEntity N(6)-lactoyl-L-lysine An N6-acyl-L-lysine that has lactoyl as the N6-acyl group. Graph N(6)-(2-hydroxypropanoyl)-L-lysine|N(6)-lactoyl-L-lysine N(6)-lactoyl-L-lysine N(6)-(2-hydroxypropanoyl)-L-lysine|N(6)-lactoyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_145390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145391 biolink:ChemicalEntity N(6)-(2-hydroxyisobutanoyl)-L-lysine An N6-acyl-L-lysine that has 2-hydroxyisobutanoyl as the N6-acyl group. Graph N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine|N(6)-(2-hydroxyisobutanoyl)-L-lysine|N(6)-(2-hydroxyisobutyryl)-L-lysine N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine N(6)-(2-hydroxy-2-methylpropanoyl)-L-lysine|N(6)-(2-hydroxyisobutanoyl)-L-lysine|N(6)-(2-hydroxyisobutyryl)-L-lysine http://purl.obolibrary.org/obo/CHEBI_145391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145393 biolink:ChemicalEntity 2-acyl-sn-glycero-3-phosphoglycerol(1-) A 2-acylglycero-3-phospho-1'-glycerol(1−) obtained by deprotonation of the phosphate OH group of any 2-acyl-sn-glycero-3-phosphoglycerol; Major species at pH 7.3. pubmed:25014274 Graph 1-lyso-2-acyl-sn-glycero-3-phosphoglycerol(1-)|a 2-acyl-sn-glycero-3-phosphoglycerol 1-lyso-2-acyl-sn-glycero-3-phosphoglycerol(1-)|a 2-acyl-sn-glycero-3-phosphoglycerol http://purl.obolibrary.org/obo/CHEBI_145393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145394 biolink:ChemicalEntity 1,2-diacyl-sn-glycero-3-phosphoglycerol(1-) Graph 1,2-diacyl-sn-glycero-3-phospho-1'-glycerol|a 1,2-diacyl-sn-glycero-3-phosphoglycerol 1,2-diacyl-sn-glycero-3-phospho-1'-glycerol|a 1,2-diacyl-sn-glycero-3-phosphoglycerol http://purl.obolibrary.org/obo/CHEBI_145394 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145417 biolink:ChemicalEntity rigosertib An N-[2-methoxy-5-({[2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine in which the double bond has E-configuration. It is a non-ATP-competitive inhibitor of PLK1 with an IC50 of 9 nM and exhibits anti-cancer properties. cas:592542-59-1|drugbank:DB12146|kegg.drug:D10154|lincs.smallmolecule:LSM-44531|pdb-ccd:6FS|pubmed:15766665|pubmed:16223707|pubmed:27150054|pubmed:27764820|pubmed:28985505|pubmed:29070108|pubmed:29144985|pubmed:30956775|pubmed:31299161|pubmed:31312928|wikipedia.en:Rigosertib Graph (E)-ON 01910|N-[2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine|ON 01910|ON-01910|[2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetic acid|rigosertib|rigosertibum N-[2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine (E)-ON 01910|N-[2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)phenyl]glycine|ON 01910|ON-01910|[2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetic acid|rigosertib|rigosertibum http://purl.obolibrary.org/obo/CHEBI_145417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145422 biolink:ChemicalEntity rigosertib(1-) A monocarboxylic acid anion that is the conjugate base of rigosertib, resulting from the deprotonation of the carboxy group. The major species at pH 7.3. Graph [2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetate|rigosertib anion [2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetate [2-methoxy-5-({[(E)-2-(2,4,6-trimethoxyphenyl)ethenyl]sulfonyl}methyl)anilino]acetate|rigosertib anion http://purl.obolibrary.org/obo/CHEBI_145422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145425 biolink:ChemicalEntity EC 2.7.11.21 (polo kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of any polo kinase (EC 2.7.11.21). wikipedia.en:Polo_kinase Graph Cdc5 inhibitor|Cdc5 inhibitors|Cdc5p inhibitor|Cdc5p inhibitors|EC 2.7.11.21 (polo kinase) inhibitors|EC 2.7.11.21 inhibitor|EC 2.7.11.21 inhibitors|PLK inhibitor|PLK inhibitors|Plk inhibitor|Plk inhibitors|Plk1 inhibitor|Plk1 inhibitors|Plo1 inhibitor|Plo1 inhibitors|STK21 inhibitor|STK21 inhibitors|polo kinase inhibitor|polo kinase inhibitors|polo serine-threonine kinase inhibitor|polo serine-threonine kinase inhibitors|polo-like kinase 1 inhibitor|polo-like kinase 1 inhibitors|polo-like kinase inhibitor|polo-like kinase inhibitors|serine/threonine-specific Drosophila kinase polo inhibitor|serine/threonine-specific Drosophila kinase polo inhibitors Cdc5 inhibitor|Cdc5 inhibitors|Cdc5p inhibitor|Cdc5p inhibitors|EC 2.7.11.21 (polo kinase) inhibitors|EC 2.7.11.21 inhibitor|EC 2.7.11.21 inhibitors|PLK inhibitor|PLK inhibitors|Plk inhibitor|Plk inhibitors|Plk1 inhibitor|Plk1 inhibitors|Plo1 inhibitor|Plo1 inhibitors|STK21 inhibitor|STK21 inhibitors|polo kinase inhibitor|polo kinase inhibitors|polo serine-threonine kinase inhibitor|polo serine-threonine kinase inhibitors|polo-like kinase 1 inhibitor|polo-like kinase 1 inhibitors|polo-like kinase inhibitor|polo-like kinase inhibitors|serine/threonine-specific Drosophila kinase polo inhibitor|serine/threonine-specific Drosophila kinase polo inhibitors http://purl.obolibrary.org/obo/CHEBI_145425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145427 biolink:ChemicalEntity D-glucopyranose 6-sulfate(1-) An organosulfate oxoanion resulting from deprotonation of the sulfate OH group of D-glucopyranose 6-sulfate; major species at pH 7.3. metacyc.compound:CPD-544 Graph 6-O-sulfonato-D-glucopyranose|D-glucose 6-sulfate 6-O-sulfonato-D-glucopyranose 6-O-sulfonato-D-glucopyranose|D-glucose 6-sulfate http://purl.obolibrary.org/obo/CHEBI_145427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145436 biolink:ChemicalEntity D-glucopyranose 6-sulfate A monosaccharide sulfate that is D-glucopyranose carrying a single sulfo substituent at position 6. kegg.compound:C02827|metacyc.compound:CPD-544 Graph http://purl.obolibrary.org/obo/CHEBI_145436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145437 biolink:ChemicalEntity uncoupling protein inhibitor "Any inhibitor that acts on uncoupling protein." patent:US2009258064|patent:US7510710|pubmed:22420157|pubmed:23008094|pubmed:23609063|pubmed:24904988|pubmed:28089824|pubmed:29858912 Graph UCP inhibitor|UCP inhibitors|mitochondrial uncoupling protein inhibitor|mitochondrial uncoupling protein inhibitors|uncoupling protein inhibitors UCP inhibitor|UCP inhibitors|mitochondrial uncoupling protein inhibitor|mitochondrial uncoupling protein inhibitors|uncoupling protein inhibitors http://purl.obolibrary.org/obo/CHEBI_145437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145438 biolink:ChemicalEntity C-X-C chemokine receptor type 4 antagonist An antogonist that blocks C-X-C chemokine receptor type 4 (CXCR-4). wikipedia.en:CXCR4 Graph C-X-C chemokine receptor type 4 antagonists|C-X-C motif chemokine receptor 4 antagonist|C-X-C motif chemokine receptor 4 antagonists|CD184 antagonist|CD184 antagonists|CXCR-4 antagonist|CXCR-4 antagonists|CXCR4 antagonist|CXCR4 antagonists|chemokine (C-X-C motif) receptor 4 antagonist|chemokine (C-X-C motif) receptor 4 antagonists|fusin antagonist|fusin antagonists C-X-C chemokine receptor type 4 antagonists|C-X-C motif chemokine receptor 4 antagonist|C-X-C motif chemokine receptor 4 antagonists|CD184 antagonist|CD184 antagonists|CXCR-4 antagonist|CXCR-4 antagonists|CXCR4 antagonist|CXCR4 antagonists|chemokine (C-X-C motif) receptor 4 antagonist|chemokine (C-X-C motif) receptor 4 antagonists|fusin antagonist|fusin antagonists http://purl.obolibrary.org/obo/CHEBI_145438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145470 biolink:ChemicalEntity sophoroside Any glycoside of sophorose (2-O-β-D-glucopyranosyl-D-glucopyranose). Graph sophorosides sophorosides http://purl.obolibrary.org/obo/CHEBI_145470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145478 biolink:ChemicalEntity beta-D-glucosaminyl-(1->4)-N-acetyl-D-glucosamine(1+) A primary ammonium ion derivative resulting from the protonation of the primary amino group of β-D-glucosaminyl-(1→4)-N-acetyl-D-glucosamine. The major species at pH 7.3. metacyc.compound:CPD-13516|pubmed:15136574|pubmed:28130448 Graph 2-acetamido-4-O-(2-ammonio-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose|2-ammonio-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|beta-D-GlcN-(1->4)-GlcNAc(1+)|beta-D-glucosaminyl-(1->4)-N-acetyl-D-glucosamine 2-acetamido-4-O-(2-ammonio-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose 2-acetamido-4-O-(2-ammonio-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose|2-ammonio-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|beta-D-GlcN-(1->4)-GlcNAc(1+)|beta-D-glucosaminyl-(1->4)-N-acetyl-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_145478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145498 biolink:ChemicalEntity donepezil (1+) A piperidinium ion resulting from the protonation of amino group of donepezil. Graph 1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium 1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium 1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium http://purl.obolibrary.org/obo/CHEBI_145498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145499 biolink:ChemicalEntity 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one A member of the class of indanones that is 5,6-dimethoxyindan-1-one which is substituted at position 2 by an (N-benzylpiperidin-4-yl)methyl group. Graph 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one http://purl.obolibrary.org/obo/CHEBI_145499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145502 biolink:ChemicalEntity (R)-donepezil(1+) A piperidinium ion resulting from the protonation of the amino group of (R)-donepezil. Graph (2R)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium (2R)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium (2R)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium http://purl.obolibrary.org/obo/CHEBI_145502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145503 biolink:ChemicalEntity (S)-donepezil(1+) A piperidinium ion resulting from the protonation of the amino group of (S)-donepezil. pubmed:23798321 Graph (2S)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium|(S)-donepezil cation (2S)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium (2S)-1-benzyl-4-[(5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl]piperidinium|(S)-donepezil cation http://purl.obolibrary.org/obo/CHEBI_145503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145515 biolink:ChemicalEntity GABAA receptor antagonist A GABA receptor antgonist specific for GABAA receptors, ligand-gated ion channels (also known as ionotropic receptors). Graph GABAA receptor antagonists|GABAAR antagonist|GABAAR antagonists GABAA receptor antagonists|GABAAR antagonist|GABAAR antagonists http://purl.obolibrary.org/obo/CHEBI_145515 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:145543 biolink:ChemicalEntity viteagnusin D A labdane diterpenoid resulting from the formal allylic rearrangement of the allylic hydroxy group of peregrinol. cas:1123613-64-8|knapsack:C00032497|pubmed:29315936 Graph (+)-vkiteagnusin D|(1R,2R,4aS,8aS)-1-(3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol|viteagnusin D (1R,2R,4aS,8aS)-1-(3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol (+)-vkiteagnusin D|(1R,2R,4aS,8aS)-1-(3-hydroxy-3-methylpent-4-en-1-yl)-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol|viteagnusin D http://purl.obolibrary.org/obo/CHEBI_145543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145544 biolink:ChemicalEntity S-nitrosoglutathione(1-) A peptide anion obtained by deprotonation of both carboxy groups and protonation of the glutamyl amino group of S-nitrosoglutathione; major species at pH 7.3. metacyc.compound:S-NITROSOGLUTATHIONE Graph (2S)-2-ammonio-5-{[(2S)-1-[(carboxylatomethyl)amino]-3-(nitrosothio)-1-oxopropan-2-yl]amino}-5-oxopentanoate|(2S)-2-azaniumyl-5-{[(2R)-1-[(carboxylatomethyl)amino]-3-(nitrososulfanyl)-1-oxopropan-2-yl]amino}-5-oxopentanoate|GSNO(1-)|L-gamma-glutamyl-S-nitroso-L-cysteinylglycine(1-)|S-nitrosoglutathione (2S)-2-ammonio-5-{[(2S)-1-[(carboxylatomethyl)amino]-3-(nitrosothio)-1-oxopropan-2-yl]amino}-5-oxopentanoate (2S)-2-ammonio-5-{[(2S)-1-[(carboxylatomethyl)amino]-3-(nitrosothio)-1-oxopropan-2-yl]amino}-5-oxopentanoate|(2S)-2-azaniumyl-5-{[(2R)-1-[(carboxylatomethyl)amino]-3-(nitrososulfanyl)-1-oxopropan-2-yl]amino}-5-oxopentanoate|GSNO(1-)|L-gamma-glutamyl-S-nitroso-L-cysteinylglycine(1-)|S-nitrosoglutathione http://purl.obolibrary.org/obo/CHEBI_145544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145545 biolink:ChemicalEntity nitrosothio compound Any nitroso compound in which a carbon atom of an organyl group is attached to the sulfur atom of a nitrosothio group: R‒S‒N=O. Graph S-nitrosothiol compound|S-nitrosothiols|SNO compound|nitrosothio compounds S-nitrosothiol compound|S-nitrosothiols|SNO compound|nitrosothio compounds http://purl.obolibrary.org/obo/CHEBI_145545 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145549 biolink:ChemicalEntity labd-13(16),14-diene-9-ol A labdane diterpenoid resulting from the formal dehydration of the allylic hydroxy group of peregrinol. pubmed:29315936 Graph (1R,2R,4aS,8aS)-2,5,5,8a-tetramethyl-1-(3-methylenepent-4-en-1-yl)decahydronaphthalen-1-ol|labd-13(16),14-diene-9-ol (1R,2R,4aS,8aS)-2,5,5,8a-tetramethyl-1-(3-methylenepent-4-en-1-yl)decahydronaphthalen-1-ol (1R,2R,4aS,8aS)-2,5,5,8a-tetramethyl-1-(3-methylenepent-4-en-1-yl)decahydronaphthalen-1-ol|labd-13(16),14-diene-9-ol http://purl.obolibrary.org/obo/CHEBI_145549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145550 biolink:ChemicalEntity peregrinol A labdane diterpenoid that is labdane which has been hydroxylated at position 5 of the decalin ring and in which the 3-methylpentyl substituent (also at position 5 of the decalin ring) has been dehydrogenated to introduce a trans double bond at the 3-4 position and hydroxylated at position 5. cas:17140-23-7|knapsack:C00023322|metacyc.compound:CPD-20438|pubmed:29315936 Graph (1R,2R,4aS,8aS)-1-[(3E)-5-hydroxy-3-methylpent-3-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol|peregrinol (1R,2R,4aS,8aS)-1-[(3E)-5-hydroxy-3-methylpent-3-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol (1R,2R,4aS,8aS)-1-[(3E)-5-hydroxy-3-methylpent-3-en-1-yl]-2,5,5,8a-tetramethyldecahydronaphthalen-1-ol|peregrinol http://purl.obolibrary.org/obo/CHEBI_145550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145552 biolink:ChemicalEntity labd-13Z-ene-9,15,16-triol A labdane diterpenoid that is peregrinol in which one of the hydrogens of the methyl group attached to the double bond has been replaced by a hydroxy group. pubmed:29315936 Graph (2Z)-2-{2-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]ethyl}but-2-ene-1,4-diol|labd-13Z-ene-9,15,16-triol (2Z)-2-{2-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]ethyl}but-2-ene-1,4-diol (2Z)-2-{2-[(1R,2R,4aS,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl]ethyl}but-2-ene-1,4-diol|labd-13Z-ene-9,15,16-triol http://purl.obolibrary.org/obo/CHEBI_145552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145555 biolink:ChemicalEntity macropolylide Macrolides (macrocyclic lactones) in which the macrocyclic ring contains more than one ester linkage. Macropolylides include macrodiolides, macrotriolides, macrotetrolides and macropentolides, each containing di-, tri-, tetra-, and penta- ester linkages, respectively, in one macrocyclic ring. Macrocyclic lactones containing nitrogen in their skeletons (azamacrolides and macrolide lactams) and also containing oxazole or thiazole in their skeletons are known in nature. Graph macropolylides macropolylides http://purl.obolibrary.org/obo/CHEBI_145555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145556 biolink:ChemicalEntity macrodiolide A macropolylide which contains two ester linkages in one macrocyclic ring. pubmed:17446696|pubmed:29624065|pubmed:29671776|pubmed:31247219 Graph macrodiolides macrodiolides http://purl.obolibrary.org/obo/CHEBI_145556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145559 biolink:ChemicalEntity macrotriolide A macropolylide which contains three ester linkages in one macrocyclic ring. Graph http://purl.obolibrary.org/obo/CHEBI_145559 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145565 biolink:ChemicalEntity macrolide lactam A macrolide in which the macrocyclic lactone ring includes an amide group. pubmed:11678663|pubmed:12227772|pubmed:15248618|pubmed:17378533|pubmed:31226284 Graph macrolide lactams macrolide lactams http://purl.obolibrary.org/obo/CHEBI_145565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145566 biolink:ChemicalEntity syn-isopimara-7,15-diene A carbotricyclic compound that is isopimarane with double bonds introduced at the 7-8 and 15-16 positions and in which the hydrogen at position 9 is β instead of α. pubmed:23009879|pubmed:26749264|pubmed:29315936 Graph 9beta,13alpha-pimara-7,15-diene|syn-isopimara-7,15-diene 9beta,13alpha-pimara-7,15-diene 9beta,13alpha-pimara-7,15-diene|syn-isopimara-7,15-diene http://purl.obolibrary.org/obo/CHEBI_145566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145599 biolink:ChemicalEntity normethylfondaparinux A heparin pentasaccharide resulting from the hydrolysis of the O-methyl group of fondaparinux. glygen:G27775IZ|glytoucan:G27775IZ Graph 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->4)-2-deoxy-3,6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-2-O-sulfo-alpha-L-idopyranuronosyl-(1->4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose|GlcNS6S(a1-4)GlcA(b1-4)GlcNS3S6S(a1-4)IdoA2S(a1-4)a-GlcNS6S 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->4)-2-deoxy-3,6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-2-O-sulfo-alpha-L-idopyranuronosyl-(1->4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->4)-2-deoxy-3,6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-2-O-sulfo-alpha-L-idopyranuronosyl-(1->4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose|GlcNS6S(a1-4)GlcA(b1-4)GlcNS3S6S(a1-4)IdoA2S(a1-4)a-GlcNS6S http://purl.obolibrary.org/obo/CHEBI_145599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145630 biolink:ChemicalEntity Glc(alpha1->2)Glc(alpha1->3)Glc(alpha1->3)Man(alpha1->2)Man(alpha1->2)Man(alpha1->3)[Man(alpha1->2)Man(alpha1->3)[Man(alpha1->2)Man(alpha1->6)]Man(alpha1->6)]Man(beta1->4)GlcNAc(beta1->4)alpha-GlcNAc A polysaccharide consisting of α-D-Glcp-(1→2)-α-D-Glcp-(1→3)-α-D-Glcp-(1→3)-α-D-Manp-(1→2)-α-D-Manp-(1→2)-α-D-Manp-(1→3)-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-α-D-GlcpNAc in which the β-D-Manp- residue is glycosylated at position 6 by an α-D-mannopyranosyl group, which in turn is substituted at positions 3 and 6 by 2-O-α-D-mannopyranosyl-α-D-mannopyranosyl groups. glygen:G72079JG|glytoucan:G72079JG Graph Glc(a1-2)Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)a-GlcNAc|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranose alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranose Glc(a1-2)Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)a-GlcNAc|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_145630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145656 biolink:ChemicalEntity galactoxylomannan An exopolysaccharide composed of an α-(1→6)-galactan backbone containing four potential short oligosaccharide branch structures, produced by the human pathogenic fungus Cryptococcus neoformans, that produces immune paralysis in some animals, including humans. cas:70903-49-0|pubmed:16441437|pubmed:18952901|pubmed:19345342|pubmed:19414751|pubmed:19684080|pubmed:20856869|pubmed:21178496|pubmed:21238568|pubmed:21843086|pubmed:23308194|pubmed:6367980|pubmed:9691456 Graph GalXM|glucuronoxylomannogalactan GalXM|glucuronoxylomannogalactan http://purl.obolibrary.org/obo/CHEBI_145656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145663 biolink:ChemicalEntity 2-(beta-D-glucopyranosyloxy)benzoic acid A 2-(D-glucosyloxy)benzoic acid with β configuration at the anomeric centre. cas:10367-11-0|pubmed:18182429|pubmed:19117519|pubmed:19449088|pubmed:19714359|pubmed:22118617|pubmed:26241499|pubmed:30294315|pubmed:9662552 Graph 2-(beta-D-glucopyranosyloxy)benzoic acid|2-O-(beta-D-glucosyl)salicylic acid|2-O-beta-glucopyranosylsalicylic acid|2-carboxyphenyl beta-D-glucopyranoside|2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}benzoic acid|salicylic acid 2-O-beta-D-glucoside|salicylic acid beta-D-glucoside 2-(beta-D-glucopyranosyloxy)benzoic acid 2-(beta-D-glucopyranosyloxy)benzoic acid|2-O-(beta-D-glucosyl)salicylic acid|2-O-beta-glucopyranosylsalicylic acid|2-carboxyphenyl beta-D-glucopyranoside|2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}benzoic acid|salicylic acid 2-O-beta-D-glucoside|salicylic acid beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_145663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145670 biolink:ChemicalEntity 2-(beta-D-glucopyranosyloxy)benzoate A benzoate resulting from the removal of a proton from the carboxylic acid group of 2-(β-D-glucopyranosyloxy)benzoic acid. pubmed:19117519|pubmed:30294315|pubmed:9662552 Graph 2-(beta-D-glucopyranosyloxy)benzoate|2-(beta-D-glucosyloxy)benzoate|2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}benzoate|salicylate 2-O-beta-D-glucoside 2-(beta-D-glucopyranosyloxy)benzoate 2-(beta-D-glucopyranosyloxy)benzoate|2-(beta-D-glucosyloxy)benzoate|2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}benzoate|salicylate 2-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_145670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145673 biolink:ChemicalEntity tandospirone A dicarboximide that is (3aR,4S,7R,7aS)-hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione which is substituted by a 4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl group at position 2. It is a potent and selective 5-HT1A receptor partial agonist (Ki = 27 nM). cas:87760-53-0|drugbank:DB12833|drugcentral:2563|kegg.drug:D08561|pubmed:18062405|pubmed:1970610|pubmed:1971265|pubmed:1974152|pubmed:1981263|pubmed:20676611|pubmed:24207070|pubmed:25170231|pubmed:2572002|pubmed:25804359|pubmed:25879718|pubmed:26027828|pubmed:2895201|pubmed:2897609|pubmed:2898033|pubmed:29254282|pubmed:29433063|pubmed:30204599|pubmed:30628997|pubmed:30822365|pubmed:31509356|pubmed:31643024|wikipedia.en:Tandospirone Graph (3aR,4S,7R,7aS)-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione|SM 3997|SM-3997|tandospirona|tandospirone|tandospironum (3aR,4S,7R,7aS)-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (3aR,4S,7R,7aS)-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione|SM 3997|SM-3997|tandospirona|tandospirone|tandospironum http://purl.obolibrary.org/obo/CHEBI_145673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145674 biolink:ChemicalEntity tandospirone(1+) An ammonium ion resulting from the addition of a proton to the piperazine nitrogen which is attached to the alkyl chain. The major species at pH 7.3. Graph 1-{4-[(3aR,4S,7R,7aS)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]butyl}-4-(pyrimidin-2-yl)piperazin-1-ium|tandospirone cation 1-{4-[(3aR,4S,7R,7aS)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]butyl}-4-(pyrimidin-2-yl)piperazin-1-ium 1-{4-[(3aR,4S,7R,7aS)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]butyl}-4-(pyrimidin-2-yl)piperazin-1-ium|tandospirone cation http://purl.obolibrary.org/obo/CHEBI_145674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145681 biolink:ChemicalEntity beta-D-glucosyl salicylate "A D-glucosyl salicylate in which the glucosyl moiety has β-configuration at the anomeric centre. A transferrin binding compound used in research for cancer therapy." cas:60517-74-0|metacyc.compound:CPD-12629 Graph 1-O-(2-hydroxybenzoyl)-beta-D-glucopyranose|1-O-(o-hydroxybenzoyl)-beta-D-glucopyranose|1-O-salicyl-beta-D-glucose|beta-D-glucopyranosyl salicylate|salicylate-beta-D-glucose ester|salicylic acid acyl beta-D-glucoside|salicylic acid beta-D-glucopyranosyl ester|salicylic acid beta-D-glucose ester 1-O-(2-hydroxybenzoyl)-beta-D-glucopyranose 1-O-(2-hydroxybenzoyl)-beta-D-glucopyranose|1-O-(o-hydroxybenzoyl)-beta-D-glucopyranose|1-O-salicyl-beta-D-glucose|beta-D-glucopyranosyl salicylate|salicylate-beta-D-glucose ester|salicylic acid acyl beta-D-glucoside|salicylic acid beta-D-glucopyranosyl ester|salicylic acid beta-D-glucose ester http://purl.obolibrary.org/obo/CHEBI_145681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145694 biolink:ChemicalEntity 8-oxo-GMP(2-) Graph 8-oxo-GMP 8-oxo-GMP http://purl.obolibrary.org/obo/CHEBI_145694 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145698 biolink:ChemicalEntity amezinium A pyridazinium ion that is pyridazin-1-ium which is substituted by a phenyl, amino and methoxy groups at positions 1, 4 and 6, respectively. beilstein:4141517|cas:41658-78-0|drugcentral:153|pubmed:10481962|pubmed:11145175|pubmed:11433766|pubmed:11451005|pubmed:11876436|pubmed:12746100|pubmed:2564830|pubmed:2863856|pubmed:6419132|pubmed:7030355|pubmed:7197966|pubmed:7197974|pubmed:7197975|pubmed:7197976|pubmed:7197978|pubmed:8740147|pubmed:9203481 Graph 4-amino-6-methoxy-1-phenyl-pyridazinium|4-amino-6-methoxy-1-phenylpyridazin-1-ium|amezinium(1+) 4-amino-6-methoxy-1-phenylpyridazin-1-ium 4-amino-6-methoxy-1-phenyl-pyridazinium|4-amino-6-methoxy-1-phenylpyridazin-1-ium|amezinium(1+) http://purl.obolibrary.org/obo/CHEBI_145698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145699 biolink:ChemicalEntity pyridazinium ion An organic cation resulting from the protonation of one of the nitrogens of pyridazine or its derivatives. Graph pyridazinium ions pyridazinium ions http://purl.obolibrary.org/obo/CHEBI_145699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1457 biolink:ChemicalEntity 3-aminopropanesulfonic acid An amino sulfonic acid that is the 3-amino derivative of propanesulfonic acid. cas:3687-18-1|kegg.compound:C03349|kegg.drug:D06202|patent:AU2007357451|patent:WO2007023389|pdb-ccd:A20|pmc:PMC6513583|pubmed:22961121|pubmed:23070966|pubmed:25295005|pubmed:29063518|pubmed:29244487|pubmed:30455639|pubmed:30877726|pubmed:31816880|pubmed:32340314|pubmed:32733362|pubmed:32774284|pubmed:33260376|pubmed:33633656|pubmed:33686135|pubmed:33826295|pubmed:34399181|pubmed:35301136|pubmed:35515001|pubmed:36113682|pubmed:36460715|pubmed:37239149|pubmed:37280636|wikipedia.en:Homotaurine Graph 3-amino-1-propanesulfonic acid|3-aminopropane-1-sulfonic acid|3-aminopropiosulfonic acid|3-sulfopropylamine|gamma-aminopropylsulfonic acid|homotaurine|tramiprosate|tramiprosato|tramiprosatum 3-aminopropane-1-sulfonic acid 3-amino-1-propanesulfonic acid|3-aminopropane-1-sulfonic acid|3-aminopropiosulfonic acid|3-sulfopropylamine|gamma-aminopropylsulfonic acid|homotaurine|tramiprosate|tramiprosato|tramiprosatum http://purl.obolibrary.org/obo/CHEBI_1457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145705 biolink:ChemicalEntity prednisolone phosphate A synthetic glucocorticoid resulting from the formal condensation of the 21-hydroxy group of prednisolone with one of the hydroxy groups of phosphoric acid. It is a prodrug for prednisolone that is activated in vivo by phosphatases. cas:302-25-0|drugbank:DB14631|drugcentral:4451|pubmed:13783671|pubmed:15802017|pubmed:18283332|pubmed:21896328|pubmed:25791805|pubmed:26319748|pubmed:30547315|pubmed:31578578|pubmed:5090826 Graph 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl dihydrogen phosphate|prednisolone 21-(dihydrogen phosphate)|prednisolone 21-monophosphate|prednisolone 21-phosphate 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl dihydrogen phosphate 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl dihydrogen phosphate|prednisolone 21-(dihydrogen phosphate)|prednisolone 21-monophosphate|prednisolone 21-phosphate http://purl.obolibrary.org/obo/CHEBI_145705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145706 biolink:ChemicalEntity prednisolone phosphate(2-) A steroid phosphate oxoanion which is the dianion obtained by the deprotonation of the phosphate OH groups of prednisolone phosphate. Graph 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl phosphate 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl phosphate 11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl phosphate http://purl.obolibrary.org/obo/CHEBI_145706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145707 biolink:ChemicalEntity glycosylarabinose A disaccharide having arabinose at the reducing end with a glycosyl residue attached at an unspecified position via a glycosidic bond. Graph glycosylarabinoses glycosylarabinoses http://purl.obolibrary.org/obo/CHEBI_145707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145714 biolink:ChemicalEntity tiquizium A member of the class of quinolizines that is trans-5-methyloctahydro-2H-quinolizinium which is substituted by a di(thiophen-2-yl)methylidene group at position 3. Its bromide salt is used as an antispasmodic drug. cas:149755-23-7|drugcentral:2678|pubmed:2895053|pubmed:2895054|pubmed:3656779 Graph (5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizin-5-ium|(5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizinium|3-(di-2-thienylmethylene)-octahydro-5-methyl-trans-quinolizinium|trans-3-(di-2-thienylmethylene)octahydro-5-methyl-2H-quinolizinium (5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizinium (5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizin-5-ium|(5R,9aR)-3-[di(thiophen-2-yl)methylidene]-5-methyloctahydro-2H-quinolizinium|3-(di-2-thienylmethylene)-octahydro-5-methyl-trans-quinolizinium|trans-3-(di-2-thienylmethylene)octahydro-5-methyl-2H-quinolizinium http://purl.obolibrary.org/obo/CHEBI_145714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145715 biolink:ChemicalEntity hex-3-en-1-ol A primary alcohol that is hex-3-ene substituted by a hydroxy group at position 1. agr:IND606260054|cas:544-12-7|pubmed:25809070|pubmed:30042579 Graph 3-hexen-1-ol|3-hexenol|hex-3-en-1-ol hex-3-en-1-ol 3-hexen-1-ol|3-hexenol|hex-3-en-1-ol http://purl.obolibrary.org/obo/CHEBI_145715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145777 biolink:ChemicalEntity beta-D-glucosaminyl-(1->4)-N-acetyl-D-glucosamine A member of the class of chitobioses consisting of N-acetyl-D-glucosamine having a β-D-glucosaminyl residue attached at the 4-position. metacyc.compound:CPD-13516|pubmed:15136574|pubmed:28130448|pubmed:8987672 Graph 2-acetamido-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose|2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|2-amino-beta-D-glucopyranosyl-(1->4)-2-acetamido-D-glucopyranose|GlcN(b1-4)GlcNAc|beta-D-GlcN-(1->4)-GlcNAc 2-acetamido-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose|GlcN(b1-4)GlcNAc 2-acetamido-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D-glucopyranose|2-amino-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|2-amino-beta-D-glucopyranosyl-(1->4)-2-acetamido-D-glucopyranose|GlcN(b1-4)GlcNAc|beta-D-GlcN-(1->4)-GlcNAc http://purl.obolibrary.org/obo/CHEBI_145777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145790 biolink:ChemicalEntity mupirocin(1-) A monocarboxylic acid anion that is the conjugate base of mupirocin obtained by the deprotonation of the carboxy group; major microspecies at pH 7.3. Graph 9-({(2E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-({(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl)tetrahydro-2H-pyran-2-yl]-3-methylbut-2-enoyl}oxy)nonanoate 9-({(2E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-({(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl)tetrahydro-2H-pyran-2-yl]-3-methylbut-2-enoyl}oxy)nonanoate 9-({(2E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-({(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl)tetrahydro-2H-pyran-2-yl]-3-methylbut-2-enoyl}oxy)nonanoate http://purl.obolibrary.org/obo/CHEBI_145790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145791 biolink:ChemicalEntity trospium A carboxylic ester resulting from the formal condensation of the carboxy group of hydroxy(diphenyl)acetic acid with the hydroxy group of (1S,3R,5R)-3-hydroxy-8λ5-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium. Its chloride salt is used to treat overactive bladder. cas:47608-32-2|drugbank:DB00209|drugcentral:2776|hmdb:HMDB0014354|pubmed:21212936|pubmed:26186951|pubmed:28247723|pubmed:30656943|pubmed:30697533|pubmed:31602966 Graph (1S,3R,5R)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8lambda(5)-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium|(1alpha,3beta,5alpha)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-pyrrolidinium]|tropsium cation|tropsium ion (1S,3R,5R)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8lambda(5)-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium (1S,3R,5R)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8lambda(5)-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium|(1alpha,3beta,5alpha)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-pyrrolidinium]|tropsium cation|tropsium ion http://purl.obolibrary.org/obo/CHEBI_145791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145795 biolink:ChemicalEntity digoxin(1-) An organic anion that is the conjugate base of digoxin resulting from the deprotonation of furanone moiety; major species at pH 7.3. pubmed:31994361|pubmed:32272101|pubmed:32464466|pubmed:32488807|pubmed:32546555|pubmed:32603789 Graph 12beta,14-dihydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranoside|digoxin|digoxin anion 12beta,14-dihydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranoside 12beta,14-dihydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranoside|digoxin|digoxin anion http://purl.obolibrary.org/obo/CHEBI_145795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145796 biolink:ChemicalEntity digitoxin(1-) An organic anion that is the conjugate base of digitoxin resulting from the deprotonation of furanone moiety; major species at pH 7.3. Graph digitoxin|digitoxin anion digitoxin|digitoxin anion http://purl.obolibrary.org/obo/CHEBI_145796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145798 biolink:ChemicalEntity ouabain(1-) An organic anion that is the conjugate base of ouabain resulting from the deprotonation of the furanone moiety; major species at pH 7.3. pubmed:31075189|pubmed:31087249|pubmed:31170971|pubmed:32326025|pubmed:32368275|pubmed:32488807|pubmed:32651756 Graph 1beta,5,11alpha,14,19-pentahydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 6-deoxy-alpha-L-mannopyranoside|ouabain|ouabain anion 1beta,5,11alpha,14,19-pentahydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 6-deoxy-alpha-L-mannopyranoside 1beta,5,11alpha,14,19-pentahydroxy-17beta-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5beta,14beta-androstan-3beta-yl 6-deoxy-alpha-L-mannopyranoside|ouabain|ouabain anion http://purl.obolibrary.org/obo/CHEBI_145798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145800 biolink:ChemicalEntity AS1842856 "A quinolone that is 4-quinolone substituted at positions 1, 3, 5, 6 and 7 by ethyl, carboxy, amino, fluorine, and cyclohexylamino groups, respectively. It can directly bind to and block the transcription activity of the active forkhead box protein O1 (Foxo1), but not the Ser256-phosphorylated form. It induces cell death and growth arrest in Burkitt lymphoma cell lines at low concentrations." cas:836620-48-5|pubmed:20736318|pubmed:24807827|pubmed:25483084|pubmed:26239835|pubmed:26502358|pubmed:27260854|pubmed:28215713|pubmed:28687587|pubmed:28888048|pubmed:29157981|pubmed:30404794|pubmed:30611853|pubmed:31042779|pubmed:31085234|pubmed:31146723|pubmed:31298345|pubmed:31557894|pubmed:31579588|pubmed:31655022 Graph 5-amino-7-(cyclohexylamino)-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid|5-amino-7-(cyclohexylamino)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid|AS 1842856|AS-1842856|FOXO1 inhibitor 5-amino-7-(cyclohexylamino)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid 5-amino-7-(cyclohexylamino)-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid|5-amino-7-(cyclohexylamino)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid|AS 1842856|AS-1842856|FOXO1 inhibitor http://purl.obolibrary.org/obo/CHEBI_145800 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145806 biolink:ChemicalEntity (R)-(+)-perillyl alcohol A perillyl alcohol in which the chiral centre has R configuration. cas:57717-97-2|foodb.food:FDB014924|hmdb:HMDB0036087|knapsack:C00010884|metacyc.compound:CPD-17084|pubmed:28233648|pubmed:28594456|pubmed:29716998 Graph (+)-perillyl alcohol|(4R)-perillyl alcohol|(R)-p-mentha-1,8-dien-7-ol|(R)-perillyl alcohol|[(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|d-perillyl alcohol [(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol (+)-perillyl alcohol|(4R)-perillyl alcohol|(R)-p-mentha-1,8-dien-7-ol|(R)-perillyl alcohol|[(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|d-perillyl alcohol http://purl.obolibrary.org/obo/CHEBI_145806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145807 biolink:ChemicalEntity forkhead box protein O1 inhibitor "Any inhibitor that acts on forkhead box protein O1 (FOXO1)." pubmed:20655898|pubmed:26239835|pubmed:28653156 Graph FOXO1 inhibitor|FOXO1 inhibitors|Foxo1 inhibitor|Foxo1 inhibitors|forkhead box protein O1 inhibitors|forkhead in rhabdomyosarcoma inhibitor|forkhead in rhabdomyosarcoma inhibitors FOXO1 inhibitor|FOXO1 inhibitors|Foxo1 inhibitor|Foxo1 inhibitors|forkhead box protein O1 inhibitors|forkhead in rhabdomyosarcoma inhibitor|forkhead in rhabdomyosarcoma inhibitors http://purl.obolibrary.org/obo/CHEBI_145807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145810 biolink:ChemicalEntity insulin A peptide hormone which consists of two polypeptide chains, A- and B- chains which are linked together by disulfide bonds. The amino acid sequence of insulin varies across species and certain segments of the molecule are highly conserved. In most species, the A chain consists of 21 amino acids and the B chain consists of 30 amino acids. In mammals, insulin is synthesised in the pancreas within the β cells whereas in certain species of fish, the insulin-producing tissue is uniquely located in separate structures called Brockmann bodies. pubmed:12137720|pubmed:19251032|pubmed:25848166|pubmed:5941964|pubmed:6069707|wikipedia.en:Insulin Graph http://purl.obolibrary.org/obo/CHEBI_145810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145813 biolink:ChemicalEntity D-cystine zwitterion A cysteine zwitterion derived from D-cysteine by transfer of a proton from each of the carboxy groups to the amino groups. metacyc.compound:CPD0-1564 Graph (2S,2'S)-3,3'-disulfanediylbis(2-ammoniopropanoate)|(2S,2'S)-3,3'-dithiobis(2-ammoniopropanoate)|D-cystine (2S,2'S)-3,3'-disulfanediylbis(2-ammoniopropanoate)|(2S,2'S)-3,3'-dithiobis(2-ammoniopropanoate) (2S,2'S)-3,3'-disulfanediylbis(2-ammoniopropanoate)|(2S,2'S)-3,3'-dithiobis(2-ammoniopropanoate)|D-cystine http://purl.obolibrary.org/obo/CHEBI_145813 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145814 biolink:ChemicalEntity EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitor Any EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD+ or NADP+ as acceptor) inhibitor that inhibits the action of aspartate-semialdehyde dehydrogenase (EC 1.2.1.11). pubmed:14726201|pubmed:26404410|wikipedia.en:Aspartate-semialdehyde_dehydrogenase Graph ASA dehydrogenase inhibitor|ASA dehydrogenase inhibitors|EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitors|EC 1.2.1.11 inhibitor|EC 1.2.1.11 inhibitors|L-aspartate-4-semialdehyde:NADP+ oxidoreductase (phosphorylating) inhibitor|L-aspartate-4-semialdehyde:NADP+ oxidoreductase (phosphorylating) inhibitors|L-aspartate-beta-semialdehyde:NADP oxidoreductase (phosporylating) inhibitor|L-aspartate-beta-semialdehyde:NADP oxidoreductase (phosporylating) inhibitors|aspartate semialdehyde dehydrogenase inhibitor|aspartate semialdehyde dehydrogenase inhibitors|aspartate-semialdehyde dehydrogenase (EC 1.2.1.11) inhibitor|aspartate-semialdehyde dehydrogenase (EC 1.2.1.11) inhibitors|aspartate-semialdehyde dehydrogenase inhibitor|aspartate-semialdehyde dehydrogenase inhibitors|aspartic beta-semialdehyde dehydrogenase inhibitor|aspartic beta-semialdehyde dehydrogenase inhibitors|aspartic semialdehyde dehydrogenase inhibitor|aspartic semialdehyde dehydrogenase inhibitors ASA dehydrogenase inhibitor|ASA dehydrogenase inhibitors|EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitors|EC 1.2.1.11 inhibitor|EC 1.2.1.11 inhibitors|L-aspartate-4-semialdehyde:NADP+ oxidoreductase (phosphorylating) inhibitor|L-aspartate-4-semialdehyde:NADP+ oxidoreductase (phosphorylating) inhibitors|L-aspartate-beta-semialdehyde:NADP oxidoreductase (phosporylating) inhibitor|L-aspartate-beta-semialdehyde:NADP oxidoreductase (phosporylating) inhibitors|aspartate semialdehyde dehydrogenase inhibitor|aspartate semialdehyde dehydrogenase inhibitors|aspartate-semialdehyde dehydrogenase (EC 1.2.1.11) inhibitor|aspartate-semialdehyde dehydrogenase (EC 1.2.1.11) inhibitors|aspartate-semialdehyde dehydrogenase inhibitor|aspartate-semialdehyde dehydrogenase inhibitors|aspartic beta-semialdehyde dehydrogenase inhibitor|aspartic beta-semialdehyde dehydrogenase inhibitors|aspartic semialdehyde dehydrogenase inhibitor|aspartic semialdehyde dehydrogenase inhibitors http://purl.obolibrary.org/obo/CHEBI_145814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145828 biolink:ChemicalEntity methyl 3,4,5-trihydroxybenzoate A gallate ester obtained by the formal condensation of gallic acid with methanol. It exhibits anti-oxidant, anti-tumor, anti-microbial and anti-inflammatory properties. cas:99-24-1|foodb.food:FDB000663|knapsack:C00030754|pubmed:10346950|pubmed:12094296|pubmed:2437251|pubmed:27227459|pubmed:27592552|pubmed:28272351|pubmed:2840133|pubmed:28744880|pubmed:29116460|pubmed:29120784|pubmed:29847215|pubmed:30314293|pubmed:30886338|pubmed:31151650|pubmed:31557976|pubmed:31890180|reaxys:2113180|wikipedia.en:Methyl_gallate Graph 3,4,5-trihydroxy-benzoic acid methyl ester|gallic acid methyl ester|methyl 3,4,5-trihydroxybenzoate|methyl gallate|methylgallate methyl 3,4,5-trihydroxybenzoate 3,4,5-trihydroxy-benzoic acid methyl ester|gallic acid methyl ester|methyl 3,4,5-trihydroxybenzoate|methyl gallate|methylgallate http://purl.obolibrary.org/obo/CHEBI_145828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145853 biolink:ChemicalEntity N(6)-methyl-2'-O-methyladenosine monophosphate(1-) residue An organic anionic group obtained by deprotonation of the phosphate OH groups of N6-methyl-2'-O-methyladenosine residue; major species at pH 7.3. pubmed:31913360 Graph N(6)-methyl-2'-O-methyladenosine monophosphate residue|m(6)Am residue N(6)-methyl-2'-O-methyladenosine monophosphate residue|m(6)Am residue http://purl.obolibrary.org/obo/CHEBI_145853 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145885 biolink:ChemicalEntity Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc A high-mannose oligosaccharide consisting of α-D-Glcp-(1→3)-α-D-Glcp-(1→3)-α-D-Manp-(1→2)-α-D-Manp-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-D-GlcpNAc. glygen:G13746SQ|glytoucan:G13746SQ Graph Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|Glc2Man9GlcNAc2|alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|Glc2Man9GlcNAc2|alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_145885 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145890 biolink:ChemicalEntity Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc A high-mannose oligosaccharide that is Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc in which the hydroxy group at position 3 of the initial mannosyl gruop has been converted to the corresponding α-D-glucoside. glygen:G82207VX|glytoucan:G82207VX|kegg.glycan:G01329|pubmed:12626419|pubmed:15845364|pubmed:8194071 Graph Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|N-[(3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-Acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-3-[(2R,3S,4S,5S,6R)-3-[(2R,3S,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide|alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|N-[(3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-Acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-3-[(2R,3S,4S,5S,6R)-3-[(2R,3S,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide|alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_145890 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145891 biolink:ChemicalEntity Glc(alpha1->2)Glc(alpha1->3)Glc(alpha1->3)Man(alpha1->2)Man(alpha1->2)Man(alpha1->3)[Man(alpha1->2)Man(alpha1->3)[Man(alpha1->2)Man(alpha1->6)]Man(alpha1->6)]Man(beta1->4)GlcNAc(beta1->4)GlcNAc A high-mannose oligosaccharide that is Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc in which the initial (α-1→3)-D-glucosyl residue has been glycosylated at position 2 by an α-D-glucopyranosyl group. glygen:G87784HD|glytoucan:G87784HD|kegg.glycan:G11910|metacyc.compound:CPD-13936|pubmed:35137040|pubmed:7014569|pubmed:7201293 Graph Glc(3)Man(9)GlcNAc(2)|Glc(a1-2)Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|Glc3Man9GlcNAc2|alpha-D-Glcp-(1->2)-alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->2)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose Glc(3)Man(9)GlcNAc(2)|Glc(a1-2)Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc|Glc3Man9GlcNAc2|alpha-D-Glcp-(1->2)-alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc|alpha-D-gluco-hexopyranosyl-(1->2)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-alpha-D-glucopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_145891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145902 biolink:ChemicalEntity 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose(1-) Graph 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_145902 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:145924 biolink:ChemicalEntity Kaletra A mixture containing lopinavir and ritonavir. It is a prescription medicine that is used with other antiretroviral medicines to treat Human Immunodeficiency Virus-1 (HIV-1) infection in adults and children 14 days of age and older. cas:369372-47-4|kegg.drug:D02498|pmc:PMC6255574|pubmed:17565464|pubmed:19480095|pubmed:24516081|pubmed:25656621|pubmed:26953282|pubmed:29136115|pubmed:29584910|pubmed:29602711|pubmed:29959798|pubmed:30174599|pubmed:30346663|pubmed:30549217|pubmed:30798695|pubmed:30814028|pubmed:30909871|pubmed:30995874|pubmed:31081020|pubmed:31139825|pubmed:31334298|pubmed:31490959|pubmed:31612827|pubmed:31704214|pubmed:31920659|wikipedia.en:Lopinavir/ritonavir Graph ABT-378 & ABT-538|Aluvia|Kaletra|Lopimune|lopinavir & ritonavir|lopinavir and ritonavir|lopinavir mixture with ritonavir|lopinavir-ritonavir|lopinavir-ritonavir mixt|lopinavir/ritonavir|ritonavir and lopinavir mixture|ritonavir-boosted lopinavir ABT-378 & ABT-538|Aluvia|Kaletra|Lopimune|lopinavir & ritonavir|lopinavir and ritonavir|lopinavir mixture with ritonavir|lopinavir-ritonavir|lopinavir-ritonavir mixt|lopinavir/ritonavir|ritonavir and lopinavir mixture|ritonavir-boosted lopinavir http://purl.obolibrary.org/obo/CHEBI_145924 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145927 biolink:ChemicalEntity 4-(indol-3-yl)butanoyl-beta-D-glucose A β-D-glucoside resulting from the formal condensation of 1-hydroxy group of β-D-glucopyranose with the carboxy group of indole-3-butyric acid. metacyc.compound:CPD-12621|pubmed:15779830|pubmed:19885676|pubmed:20798329 Graph (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 4-(1H-indol-3-yl)butanoate|1-O-[4-(1H-indol-3-yl)butanoyl]-beta-D-glucopyranose|1H-indole-3-butyric acid beta-D-glucopyranosyl ester|4-(indol-3-yl)butanoyl-beta-D-glucose|IBA-beta-D-Glc|IBA-beta-D-glucopyranose|IBA-beta-D-glucose|indole-3-butyryl-beta-D-glucose 1-O-[4-(1H-indol-3-yl)butanoyl]-beta-D-glucopyranose (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 4-(1H-indol-3-yl)butanoate|1-O-[4-(1H-indol-3-yl)butanoyl]-beta-D-glucopyranose|1H-indole-3-butyric acid beta-D-glucopyranosyl ester|4-(indol-3-yl)butanoyl-beta-D-glucose|IBA-beta-D-Glc|IBA-beta-D-glucopyranose|IBA-beta-D-glucose|indole-3-butyryl-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_145927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145932 biolink:ChemicalEntity (S)-2-methylbutanoate A branched-chain saturated fatty acid anion resulting from the deprotonation of the carboxy group of (S)-2-methylbutanoic acid. The major species at pH 7.3. pubmed:16819884 Graph (2S)-2-methylbutanoate|(2S)-2-methylbutyrate|(2S)-2-methylbutyric acid anion|(S)-2-methylbutanoate|(S)-2-methylbutyrate|(S)-alpha-methylbutyrate (2S)-2-methylbutanoate (2S)-2-methylbutanoate|(2S)-2-methylbutyrate|(2S)-2-methylbutyric acid anion|(S)-2-methylbutanoate|(S)-2-methylbutyrate|(S)-alpha-methylbutyrate http://purl.obolibrary.org/obo/CHEBI_145932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145944 biolink:ChemicalEntity 4alpha-hydroxymethyl steroid Any steroid which is substituted by a hydroxymethyl group at the 4α position. Graph http://purl.obolibrary.org/obo/CHEBI_145944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145946 biolink:ChemicalEntity N-acetyl-D-leucinate An N-acyl-D-α-amino acid anion that is the conjugate base of N-acetyl-D-leucine: major species at pH 7.3. pubmed:26607469 Graph (2R)-2-acetamido-4-methylpentanoate|N-acetyl-D-Leu(1-)|N-acetyl-D-leucinate anion|N-acetyl-D-leucine|N-acetyl-D-leucine(1-) (2R)-2-acetamido-4-methylpentanoate (2R)-2-acetamido-4-methylpentanoate|N-acetyl-D-Leu(1-)|N-acetyl-D-leucinate anion|N-acetyl-D-leucine|N-acetyl-D-leucine(1-) http://purl.obolibrary.org/obo/CHEBI_145946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145947 biolink:ChemicalEntity antiatherosclerotic agent "A cardiovascular drug that prevents atherosclerosis (a disease in which the inside of an artery narrows due to the build up of plaque). Compare with antiatherogenic agent." Graph anti-atherosclerotic agent|anti-atherosclerotic agents|anti-atherosclerotic drug|anti-atherosclerotic drugs|antiatherosclerotic agent|antiatherosclerotic agents|antiatherosclerotic drug|antiatherosclerotic drugs anti-atherosclerotic agent|anti-atherosclerotic agents|anti-atherosclerotic drug|anti-atherosclerotic drugs|antiatherosclerotic agent|antiatherosclerotic agents|antiatherosclerotic drug|antiatherosclerotic drugs http://purl.obolibrary.org/obo/CHEBI_145947 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145951 biolink:ChemicalEntity 4-hydroxymethylsteroid Any steroid which is substituted by a hydroxymethyl group at position 4. Graph http://purl.obolibrary.org/obo/CHEBI_145951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145952 biolink:ChemicalEntity 4-formyl steroid A steroid aldehyde that is any steroid which is substituted by a formyl group at position 4. Graph 4-formyl steroids 4-formyl steroids http://purl.obolibrary.org/obo/CHEBI_145952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145954 biolink:ChemicalEntity 4alpha-formyl steroid Any 4-formyl steroid in which the formyl group at position 4 has α- configuration. Graph 4alpha-formyl steroid|4alpha-formyl steroids 4alpha-formyl steroid|4alpha-formyl steroids http://purl.obolibrary.org/obo/CHEBI_145954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14597 biolink:ChemicalEntity methylarsonite An arsenic oxoanion obtained deprotonation of both arsenite OH groups of methylarsonous acid. reaxys:11246400 Graph [As(CH3)O2](2-)|methylarsonite methylarsonite [As(CH3)O2](2-)|methylarsonite http://purl.obolibrary.org/obo/CHEBI_14597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145989 biolink:ChemicalEntity 3-phosphonatoshikimate(3-) Trianion of 3-phosphoshikimic acid arising from deprotonation of the phosphate and carboxy groups; major species at pH 7.3. beilstein:4882573 Graph 3-phosphonatoshikimate trianion|3-phosphoshikimate|rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonatooxy)cyclohex-1-ene-1-carboxylate rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonatooxy)cyclohex-1-ene-1-carboxylate 3-phosphonatoshikimate trianion|3-phosphoshikimate|rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonatooxy)cyclohex-1-ene-1-carboxylate http://purl.obolibrary.org/obo/CHEBI_145989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145992 biolink:ChemicalEntity orlandin(1-) A phenolate anion resulting from the deprotonation of the 7-hydroxy group orlandin. It is the major microspecies at pH 7.3. pubmed:447931 Graph 7'-hydroxy-4,4'-dimethoxy-5,5'-dimethyl-2,2'-dioxo-2H,2'H-[8,8'-bi-1-benzopyran]-7-olate|7'-hydroxy-4,4'-dimethoxy-5,5'-dimethyl-2,2'-dioxo-2H,2'H-[8,8'-bichromen]-7-olate|orlandin|orlandin anion 7'-hydroxy-4,4'-dimethoxy-5,5'-dimethyl-2,2'-dioxo-2H,2'H-[8,8'-bichromen]-7-olate 7'-hydroxy-4,4'-dimethoxy-5,5'-dimethyl-2,2'-dioxo-2H,2'H-[8,8'-bi-1-benzopyran]-7-olate|7'-hydroxy-4,4'-dimethoxy-5,5'-dimethyl-2,2'-dioxo-2H,2'H-[8,8'-bichromen]-7-olate|orlandin|orlandin anion http://purl.obolibrary.org/obo/CHEBI_145992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145994 biolink:ChemicalEntity remdesivir A carboxylic ester resulting from the formal condensation of the carboxy group of N-[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]-L-alanine with the hydroxy group of 2-ethylbutan-1-ol. A broad-spectrum antiviral prodrug with potent in vitro antiviral activity against a diverse panel of RNA viruses such as Ebola virus, MERS-CoV and SARS-CoV. It is currently in Phase III clinical trials for the treatment of Covid-19 in adults. cas:1809249-37-3|drugbank:DB14761|kegg.drug:D11472|pmc:PMC5630887|pubmed:26934220|pubmed:28124907|pubmed:28262699|pubmed:28659436|pubmed:29511076|pubmed:30275474|pubmed:30987343|pubmed:31142680|pubmed:31233808|pubmed:31924756|pubmed:32020029|pubmed:32054787|pubmed:32094225|pubmed:32145386|pubmed:32147516|pubmed:32152082|wikipedia.en:Remdesivir Graph (2S)-2-{(2R,3S,4R,5R)-[5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxy-tetrahydro-furan-2-ylmethoxy]phenoxy-(S)-phosphorylamino}propionic acid 2-ethyl-butyl ester|2-ethylbutyl (2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate|2-ethylbutyl N-[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]-L-alaninate|GS 5734|GS-5734|GS5734|remdesivir|remdesivirum 2-ethylbutyl N-[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]-L-alaninate (2S)-2-{(2R,3S,4R,5R)-[5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxy-tetrahydro-furan-2-ylmethoxy]phenoxy-(S)-phosphorylamino}propionic acid 2-ethyl-butyl ester|2-ethylbutyl (2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate|2-ethylbutyl N-[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]-L-alaninate|GS 5734|GS-5734|GS5734|remdesivir|remdesivirum http://purl.obolibrary.org/obo/CHEBI_145994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:145999 biolink:ChemicalEntity cinanserin An aryl sulfide that is (2E)-3-phenyl-N-(2-sulfanylphenyl)prop-2-enamide in which the hydrogen of the thiol group is substituted by a 3-(dimethylamino)propyl group. It is a 5-hydroxytryptamine receptor antagonist and an inhibitor of SARS-CoV replication. cas:1166-34-3|pubmed:1178659|pubmed:1301238|pubmed:142996|pubmed:15890949|pubmed:18827378|pubmed:23131569|pubmed:23523219|pubmed:24971515|pubmed:26851778|pubmed:30417783|pubmed:3237811|pubmed:4254977|pubmed:4725521|pubmed:4776363|pubmed:4929084|pubmed:4939050|pubmed:4946100|pubmed:5348442|pubmed:5409554|pubmed:7667390|wikipedia.en:Cinanserin Graph (2E)-N-(2-{[3-(dimethylamino)propyl]sulfanyl}phenyl)-3-phenylprop-2-enamide|cinanserin|cinanserina|cinanserine|cinanserinum (2E)-N-(2-{[3-(dimethylamino)propyl]sulfanyl}phenyl)-3-phenylprop-2-enamide (2E)-N-(2-{[3-(dimethylamino)propyl]sulfanyl}phenyl)-3-phenylprop-2-enamide|cinanserin|cinanserina|cinanserine|cinanserinum http://purl.obolibrary.org/obo/CHEBI_145999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146007 biolink:ChemicalEntity (M)-viriditoxin "A dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate in which the the 3 and 3' positions (bearing the 2-methoxy-2-oxoethyl (CH2CO2Me) groups) both have S configuration, while the 6 and 6' positions (where the binaphthopyran units are linked) have Ra configuration (the M atropisomer). It has been isolated from the fungi Aspergillus viridinutans and the fungus Paecilomyces variotii derived from the inner tissues of the giant jellyfish Nemopilema nomurai." cas:1381782-08-6|pubmed:21413107|pubmed:23049144|pubmed:25231051|pubmed:29037949|pubmed:31045362|pubmed:31304040 Graph (-)-viriditoxin|(M)-viriditoxin|dimethyl 2,2'-[(3S,3'S,6Ra)-9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl]diacetate dimethyl 2,2'-[(3S,3'S,6Ra)-9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl]diacetate (-)-viriditoxin|(M)-viriditoxin|dimethyl 2,2'-[(3S,3'S,6Ra)-9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl]diacetate http://purl.obolibrary.org/obo/CHEBI_146007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146008 biolink:ChemicalEntity semiviriditoxin A naphthopyran that is 3,4-dihydro-naphtho[2,3-c]pyran-1-one which is substituted by a 2-methoxy-2-oxoethyl group at position 3, a methoxy group at position 7, and hydroxy groups at positions 9 and 10 (the 3S enantiomer). It is produced by the fungus Paecilomyces variotii, isolated from the larvae of the mountain pine beetle Dendroctonus ponderosae. The biological precursor of viriditoxin. pubmed:31045362 Graph methyl [(3S)-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydro-1H-naphtho[2,3-c]pyran-3-yl]acetate|semiviriditoxin methyl [(3S)-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydro-1H-naphtho[2,3-c]pyran-3-yl]acetate methyl [(3S)-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydro-1H-naphtho[2,3-c]pyran-3-yl]acetate|semiviriditoxin http://purl.obolibrary.org/obo/CHEBI_146008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146014 biolink:ChemicalEntity binaphthopyran A biaryl in which both of the coupled aromatic groups consists of a binaphthopyran or a substitutd binaphthopyran. Graph binaphthopyrans binaphthopyrans http://purl.obolibrary.org/obo/CHEBI_146014 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146015 biolink:ChemicalEntity dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate A binaphthopyran resulting from the formal oxidative dimerisation at position 6 of two molecules of methyl (9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydro-1H-naphtho[2,3-c]pyran-3-yl)acetate. Graph dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-1H,1'H-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate http://purl.obolibrary.org/obo/CHEBI_146015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146021 biolink:ChemicalEntity N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminide(1-) Graph an alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-D-GlcNAc derivative an alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-D-GlcNAc derivative http://purl.obolibrary.org/obo/CHEBI_146021 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146136 biolink:ChemicalEntity 7,3',5'-trimethylmyricetin A trimethoxyflavone that is myricetin in which the hydroxy groups at position 7, 3' and 5' have been replaced by methoxy groups. pubmed:21343428 Graph 3',5',7-trimethoxy-3,4',5-trihydroxyflavone|3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one|3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one|7,3',5'-trimethyl myricetin|myricetin 7,3',5'-trimethyl ether 3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one 3',5',7-trimethoxy-3,4',5-trihydroxyflavone|3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one|3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-4H-chromen-4-one|7,3',5'-trimethyl myricetin|myricetin 7,3',5'-trimethyl ether http://purl.obolibrary.org/obo/CHEBI_146136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146144 biolink:ChemicalEntity L-Fucp-(1->2)-[D-Galp-(1->3)]-D-Galp Any branched trisaccharide consisting of D-galactopyranose having an L-fucosyl residue at the 2-position and a D-galactosyl residue at the 3-position. Graph 6-deoxy-L-galactopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose|L-fucopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose 6-deoxy-L-galactopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose|L-fucopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose 6-deoxy-L-galactopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose|L-fucopyranosyl-(1->2)-[D-galactopyranosyl-(1->3)]-D-galactopyranose http://purl.obolibrary.org/obo/CHEBI_146144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146145 biolink:ChemicalEntity 7,4'-dimethylkaempferol A dimethoxyflavone that is kaempferol in which the hydroxy groups at position 4' and 7 have been replaced by methoxy groups. It is a component of bee glue and has been isolated from several plant species including Betula exilis, Zingiber mekongense and Alpinia flabellata. cas:15486-33-6|lipidmaps:LMPK12112595|metacyc.compound:CPD-14951|pubmed:11198817|pubmed:12451496|pubmed:18384188|pubmed:21238547|pubmed:21343428|pubmed:26594759|pubmed:31640181 Graph 3,5-dihydroxy-4',7-dimethoxyflavone|3,5-dihydroxy-7,4'-dimethoxyflavone|3,5-dihydroxy-7-methoxy-2-(4-methoxy-phenyl)-chromen-4-one|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4-benzopyrone|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|4'-O,7-O-dimethylkaempferol|kaempferol 4',7-dimethyl ether|kaempferol 7,4'-dimethyl ether 3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 3,5-dihydroxy-4',7-dimethoxyflavone|3,5-dihydroxy-7,4'-dimethoxyflavone|3,5-dihydroxy-7-methoxy-2-(4-methoxy-phenyl)-chromen-4-one|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4-benzopyrone|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|4'-O,7-O-dimethylkaempferol|kaempferol 4',7-dimethyl ether|kaempferol 7,4'-dimethyl ether http://purl.obolibrary.org/obo/CHEBI_146145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146162 biolink:ChemicalEntity palmitoleamide A primary fatty amide resulting from the formal condensation of the carboxy group of (9Z)-hexadecenoic acid with ammonia. cas:106010-22-4|lipidmaps:LMFA08010010|pubmed:11128635|pubmed:22095832|pubmed:25693860|pubmed:25856314|pubmed:26044516|pubmed:29627605 Graph (9Z)-9-hexadecenamide|(9Z)-hexadec-9-enamide|(9Z)-hexadecenamide|(Z)-9-hexadecenamide|(Z)-hexadec-9-enamide (9Z)-hexadec-9-enamide (9Z)-9-hexadecenamide|(9Z)-hexadec-9-enamide|(9Z)-hexadecenamide|(Z)-9-hexadecenamide|(Z)-hexadec-9-enamide http://purl.obolibrary.org/obo/CHEBI_146162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146176 biolink:ChemicalEntity levomethorphan A 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene in which the stereocenters at positions 4a, 10 and 10a have R-configuration. It is a prodrug of levorphanol and a strong narcotic analgesic, and listed as a schedule II controlled substance. cas:125-70-2|pubmed:16870378|pubmed:26226106|pubmed:28867701|pubmed:29131506|wikipedia.en:Levomethorphan Graph (-)-3-methoxy-17-methylmorphinan|(-)-3-methoxy-N-methylmorphinan|(4aR,10R,10aR)-6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene|3-methoxy-17-methylmorphinan|L-3-methoxy-17-methylmorphinan|L-methorphan|levomethorphan|levomethorphane|levomethorphanum|levometorfano (4aR,10R,10aR)-6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene|3-methoxy-17-methylmorphinan (-)-3-methoxy-17-methylmorphinan|(-)-3-methoxy-N-methylmorphinan|(4aR,10R,10aR)-6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene|3-methoxy-17-methylmorphinan|L-3-methoxy-17-methylmorphinan|L-methorphan|levomethorphan|levomethorphane|levomethorphanum|levometorfano http://purl.obolibrary.org/obo/CHEBI_146176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146178 biolink:ChemicalEntity 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene An organic heterotetracyclic compound that is 1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene which is substituted by a methoxy group at position 6 and a methyl group at position 11. Graph 4-methoxy-17-methyl-17-azatetracyclo[7.5.3.0(1,10).0(2,7)]heptadeca-2(7),3,5-triene|6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene 4-methoxy-17-methyl-17-azatetracyclo[7.5.3.0(1,10).0(2,7)]heptadeca-2(7),3,5-triene|6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene 4-methoxy-17-methyl-17-azatetracyclo[7.5.3.0(1,10).0(2,7)]heptadeca-2(7),3,5-triene|6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene http://purl.obolibrary.org/obo/CHEBI_146178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146179 biolink:ChemicalEntity galactotriose Any trisaccharide composed of 3 galactose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_146179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146180 biolink:ChemicalEntity glucotriose Any trisaccharide composed of 3 glucose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_146180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146181 biolink:ChemicalEntity mannotriose Any trisaccharide composed of 3 mannose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_146181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146193 biolink:ChemicalEntity N-glycoloylneuraminic acid kegg.compound:C03410 Graph http://purl.obolibrary.org/obo/CHEBI_146193 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146199 biolink:ChemicalEntity S-(S-glutathionyl)-L-cysteine(1-) residue Graph S-(S-glutathionyl)-L-cysteine residue S-(S-glutathionyl)-L-cysteine residue http://purl.obolibrary.org/obo/CHEBI_146199 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146212 biolink:ChemicalEntity ilicicolin Any member of the class of antibiotic polyketides originally isolated from the fungus Cylindrocladium ilicicola, isolated from the dead leaf of beach (Fagus sp.). pubmed:5042450|pubmed:5167226 Graph ilicicolins ilicicolins http://purl.obolibrary.org/obo/CHEBI_146212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146219 biolink:ChemicalEntity (R)-efonidipine A 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate that has (R)-configuration. It is a selective blocker of T-type Ca2+ channels. cas:128194-13-8|pdb-ccd:C9X|pubmed:15545287|pubmed:15599089|pubmed:18278483|pubmed:18460822|pubmed:19567868|pubmed:20858482|pubmed:21757861|pubmed:30981510 Graph (-)-(R)-efonidipine|(-)-efonidipine|(R)-(-)-efonidipine|2-[benzyl(phenyl)amino]ethyl (4R)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|2-[benzyl(phenyl)amino]ethyl (4R)-5-(5,5-dimethyl-2-oxo-1,3,2lambda(5)-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|R(-)-efonidipine 2-[benzyl(phenyl)amino]ethyl (4R)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate (-)-(R)-efonidipine|(-)-efonidipine|(R)-(-)-efonidipine|2-[benzyl(phenyl)amino]ethyl (4R)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|2-[benzyl(phenyl)amino]ethyl (4R)-5-(5,5-dimethyl-2-oxo-1,3,2lambda(5)-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|R(-)-efonidipine http://purl.obolibrary.org/obo/CHEBI_146219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146220 biolink:ChemicalEntity (S)-efonidipine A 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate that has (S)-configuration. It is a blocker of L- and T-type Ca2+ channels. cas:128194-12-7|pubmed:15545287|pubmed:20858482 Graph (+)-(S)-efonidipine|(+)-efonidipine|(S)-(+)-efonidipine|2-[benzyl(phenyl)amino]ethyl (4S)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|S(+)-efonidipine 2-[benzyl(phenyl)amino]ethyl (4S)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate (+)-(S)-efonidipine|(+)-efonidipine|(S)-(+)-efonidipine|2-[benzyl(phenyl)amino]ethyl (4S)-5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|S(+)-efonidipine http://purl.obolibrary.org/obo/CHEBI_146220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146221 biolink:ChemicalEntity 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate A carboxylic ester resulting from the formal condensation of the carboxy group of 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid with the hydroxy group of 2-[benzyl(phenyl)amino]ethanol. Graph 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxo-1,3,2lambda(5)-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate 2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate|2-[benzyl(phenyl)amino]ethyl 5-(5,5-dimethyl-2-oxo-1,3,2lambda(5)-dioxaphosphinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate http://purl.obolibrary.org/obo/CHEBI_146221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146223 biolink:ChemicalEntity ryanodine receptor antagonist A ryanodine receptor modulator which deactivates the receptor. pubmed:16195318|pubmed:31775359|pubmed:31901380 Graph ryanodine receptor antagonists|ryanodine receptor inhibitor|ryanodine receptor inhibitors ryanodine receptor antagonists|ryanodine receptor inhibitor|ryanodine receptor inhibitors http://purl.obolibrary.org/obo/CHEBI_146223 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:146234 biolink:ChemicalEntity N(1)-methyl-N(3)-[(3S)-3-amino-3-carboxypropyl]-pseudouridine 5'-phosphate(1-) residue An organic anionic group obtained by deprotonation of the phosphate and carboxy functions as well as protonation of the amino function of N1-methyl-N3-[(3S)-3-amino-3-carboxypropyl]-pseudouridine 5'-phosphate residue; major species at 7.3. pubmed:27084949 Graph N(1)-methyl-N(3)-[(3S)-3-amino-3-carboxypropyl]-pseudouridine residue N(1)-methyl-N(3)-[(3S)-3-amino-3-carboxypropyl]-pseudouridine residue http://purl.obolibrary.org/obo/CHEBI_146234 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146243 biolink:ChemicalEntity JWH-133 "A dibenzopyran that is Δ9-tetrahydrocannabinol which is lacking the hydroxy group and in which the pentyl group at position 3 has been replaced by a 1,1-dimethylbutyl group. A potent and highly selective CB2 receptor agonist." cas:259869-55-1|pubmed:12479982|pubmed:16111718|pubmed:17537989|pubmed:17912054|pubmed:21771590|pubmed:22578958|pubmed:23711495|pubmed:24007798|pubmed:24302957|pubmed:24304686|pubmed:25749929|pubmed:25867462|pubmed:26842917|pubmed:27194477|pubmed:27504865|pubmed:27899748|pubmed:27994006|pubmed:28153531|pubmed:28687201|pubmed:29128791|pubmed:29262578|pubmed:29792186|pubmed:29886251|pubmed:30063884|pubmed:30132506|pubmed:30267762|pubmed:30500552|pubmed:30508607|pubmed:30554372|pubmed:30675824|pubmed:30677422|pubmed:31446615|pubmed:31729056|pubmed:31745152|pubmed:31758544|pubmed:31767546|pubmed:31981721|wikipedia.en:JWH-133 Graph (6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetrahydro-6,6,9-trimethyl-6H-dibenzo[b,d]pyran|(6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,10,10a-tetrahydro-6H-benzo[c]chromene|(6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromene|1,1-dimethylbutyl-1-deoxy-Delta(9)-THC|JW 133|JWH 133|JWH133 (6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,10,10a-tetrahydro-6H-benzo[c]chromene (6aR,10aR)-3-(1,1-dimethylbutyl)-6a,7,10,10a-tetrahydro-6,6,9-trimethyl-6H-dibenzo[b,d]pyran|(6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,10,10a-tetrahydro-6H-benzo[c]chromene|(6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromene|1,1-dimethylbutyl-1-deoxy-Delta(9)-THC|JW 133|JWH 133|JWH133 http://purl.obolibrary.org/obo/CHEBI_146243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146244 biolink:ChemicalEntity HU-308 A carbobicyclic compound that is bicyclo[3.1.1]hept-2-ene which is substituted by a hydroxymethyl group at position 2, a 2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl group at position 4, and two methyl groups at position 6 (the 1S,4S,5S stereoisomer). A highly selective and effective cannabinoid type-2 agonist and the enantiomer of HU-433. pubmed:10588688|pubmed:17652447|pubmed:21542549|pubmed:26124120|pubmed:26846967|pubmed:29450258|pubmed:30372893|wikipedia.en:HU-308 Graph (+)-{(1S,4S,5S)-4-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methanol|HU 308|HU308|{(1S,4S,5S)-4-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methanol {(1S,4S,5S)-4-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methanol (+)-{(1S,4S,5S)-4-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methanol|HU 308|HU308|{(1S,4S,5S)-4-[2,6-dimethoxy-4-(2-methyloctan-2-yl)phenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}methanol http://purl.obolibrary.org/obo/CHEBI_146244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146246 biolink:ChemicalEntity CB2 receptor agonist A cannabinoid receptor agonist that binds to and activates type 2 cannabinoid receptors. wikipedia.en:Cannabinoid_receptor_type_2 Graph CB2 receptor agonist|CB2 receptor agonists|CB2R agonist|CB2R agonists|cannabinoid receptor 2 agonist|cannabinoid receptor 2 agonists|cannabinoid receptor type 2 agonist|cannabinoid receptor type 2 agonists|type 2 cannabinoid receptor agonist|type 2 cannabinoid receptor agonists CB2 receptor agonist|CB2 receptor agonists|CB2R agonist|CB2R agonists|cannabinoid receptor 2 agonist|cannabinoid receptor 2 agonists|cannabinoid receptor type 2 agonist|cannabinoid receptor type 2 agonists|type 2 cannabinoid receptor agonist|type 2 cannabinoid receptor agonists http://purl.obolibrary.org/obo/CHEBI_146246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146248 biolink:ChemicalEntity lysophosphatidylserine O-18:0 Graph LPS O-18:0|LPS(O-18:0)|LysoPS O-18:0|LysoPS(O-18:0)|PS O-18:0/0:0|PS(O-18:0/0:0)|lysophosphatidylserine(O-18:0) LPS O-18:0|LPS(O-18:0)|LysoPS O-18:0|LysoPS(O-18:0)|PS O-18:0/0:0|PS(O-18:0/0:0)|lysophosphatidylserine(O-18:0) http://purl.obolibrary.org/obo/CHEBI_146248 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146252 biolink:ChemicalEntity 1-alkyl-sn-glycero-3-phospho-L-serine Graph Monoalkylglycerophosphoserine|Monoalkylglycerophosphoserines Monoalkylglycerophosphoserine|Monoalkylglycerophosphoserines http://purl.obolibrary.org/obo/CHEBI_146252 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146257 biolink:ChemicalEntity ibogamine(1+) A tertiary ammonium ion resulting from the protonation of the tertiary amino group of ibogamine. It is the major microspecies at pH 7.3. pubmed:30030374|wikipedia.en:Ibogamine Graph (-)-ibogamin-6-ium|(-)-ibogamine|ibogamin-6-ium ibogamin-6-ium (-)-ibogamin-6-ium|(-)-ibogamine|ibogamin-6-ium http://purl.obolibrary.org/obo/CHEBI_146257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146258 biolink:ChemicalEntity noribogaine(1+) A tertiary ammonium ion resulting from the protonation of the tertiary amino group of noribogaine. pubmed:30030374 Graph noribogaine noribogaine http://purl.obolibrary.org/obo/CHEBI_146258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146259 biolink:ChemicalEntity ibogaine(1+) A tertiary ammonium ion resulting from the protonation of the tertiary amino group of ibogaine. metacyc.compound:CPD-21566|pubmed:30030374|wikipedia.en:Ibogaine Graph (-)-ibogaine|(6S,18R)-12-methoxyibogamin-6-ium (6S,18R)-12-methoxyibogamin-6-ium (-)-ibogaine|(6S,18R)-12-methoxyibogamin-6-ium http://purl.obolibrary.org/obo/CHEBI_146259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146260 biolink:ChemicalEntity spectinomycin(1+) A secondary ammonium ion derived from spectinomycin by protonation of the secondary amino group located between the two alcoholic hydroxy groups. Graph spectinomycin spectinomycin http://purl.obolibrary.org/obo/CHEBI_146260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146264 biolink:ChemicalEntity noribogaine An organic heteropentacyclic compound that is ibogamine in which the indole hydrogen para to the indole nitrogen has been replaced by a hydroxy group. It is the primary (and long-lived) metabolite of ibogaine, the psychoactive indole alkaloid found in the African rainforest shrub Tabernanthe iboga. cas:481-88-9|pubmed:25995321|pubmed:26302653|pubmed:26807959|pubmed:27020671|pubmed:27044509|pubmed:27126304|pubmed:27870477|pubmed:28479267|pubmed:28489458|pubmed:28681614|pubmed:28972153|pubmed:29755349|wikipedia.en:Noribogaine Graph (18R)-ibogamine-12-ol|12-hydroxyibogamine|O-demethylibogaine|O-desmethylibogaine|O-noribogaine|ibogamin-12-ol (18R)-ibogamine-12-ol (18R)-ibogamine-12-ol|12-hydroxyibogamine|O-demethylibogaine|O-desmethylibogaine|O-noribogaine|ibogamin-12-ol http://purl.obolibrary.org/obo/CHEBI_146264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146270 biolink:ChemicalEntity oneirogen Any substance that produces or enhances dream-like states of consciousness. wikipedia.en:Oneirogen Graph oneirogens oneirogens http://purl.obolibrary.org/obo/CHEBI_146270 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146280 biolink:ChemicalEntity naphtho-alpha-pyrone Any naphthopyran whose skeleton consists of a naphathalene ring system ortho-fused to an α-pyrone. Graph http://purl.obolibrary.org/obo/CHEBI_146280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146281 biolink:ChemicalEntity anthracenone Any member of the class of anthracenes in which the anthracene moiety is substituted by an oxo group. Graph anthracenones anthracenones http://purl.obolibrary.org/obo/CHEBI_146281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146288 biolink:ChemicalEntity 8-HPETE(1-) pubmed:27435673 Graph 8-hydroperoxy-(5Z,9E,11Z,14Z)-eicosatetraenoate|8-hydroperoxy-(5Z,9E,11Z,14Z)-icosatetraenoate(1-) 8-hydroperoxy-(5Z,9E,11Z,14Z)-eicosatetraenoate|8-hydroperoxy-(5Z,9E,11Z,14Z)-icosatetraenoate(1-) http://purl.obolibrary.org/obo/CHEBI_146288 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146291 biolink:ChemicalEntity 11-HPETE(1-) pubmed:27435673 Graph 11-hydroperoxy-(5Z,8Z,12E,14Z)-eicosatetraenoate|11-hydroperoxy-(5Z,8Z,12E,14Z)-icosatetraenoate(1-) 11-hydroperoxy-(5Z,8Z,12E,14Z)-eicosatetraenoate|11-hydroperoxy-(5Z,8Z,12E,14Z)-icosatetraenoate(1-) http://purl.obolibrary.org/obo/CHEBI_146291 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146293 biolink:ChemicalEntity 9-HPODE(1-) pubmed:27435673 Graph 9-hydroperoxy-(10E,12Z)-octadecadienoate|9-hydroperoxy-(10E,12Z)-octadecadienoate(1-) 9-hydroperoxy-(10E,12Z)-octadecadienoate|9-hydroperoxy-(10E,12Z)-octadecadienoate(1-) http://purl.obolibrary.org/obo/CHEBI_146293 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146295 biolink:ChemicalEntity pyranobenzodioxin Any organic heterotricyclic compound whose core skeleton consists of a benzodioxin ring that is ortho-fused to a pyran ring. Graph pyranobenzodioxins pyranobenzodioxins http://purl.obolibrary.org/obo/CHEBI_146295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146296 biolink:ChemicalEntity N-acetyl-D-leucine The N-acetyl derivative of D-leucine. cas:19764-30-8|lincs.smallmolecule:LSM-5235|pubmed:19518059|pubmed:25803613|pubmed:26607469|pubmed:29509381|pubmed:7763986 Graph (2R)-2-acetamido-4-methylpentanoic acid|(R)-acetylleucine|D-acetylleucine|N-acetyl-D-Leu|N-acetyl-D-leucine|N-acetyl-R-leucine N-acetyl-D-leucine (2R)-2-acetamido-4-methylpentanoic acid|(R)-acetylleucine|D-acetylleucine|N-acetyl-D-Leu|N-acetyl-D-leucine|N-acetyl-R-leucine http://purl.obolibrary.org/obo/CHEBI_146296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146306 biolink:ChemicalEntity partially-defined glycan A member of the class of carbohydrates and carbohydrate derivatives that is any oligosaccharide or polysaccharide in which the identity of one or more of the individual monosaccharide units, their connectivity (position of attachment) or the stereochemistry (α- or β-) of one or more of the glycosidic linkages is not known. Graph partially defined glycan|partially defined glycans|partially-defined glycans partially defined glycan|partially defined glycans|partially-defined glycans http://purl.obolibrary.org/obo/CHEBI_146306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146448 biolink:ChemicalEntity beta-D-Xylp-(1->6)-D-Glcp A disaccharide consisting of β-D-xylopyranose and D-glucopyranose joined in sequence by a (1→6) glycosidic bond. glygen:G01055WR|glytoucan:G01055WR|metacyc.compound:6-O-BETA-D-XYLOPYRANOSYL Graph 6-O-(beta-D-xylopyranosyl)-D-glucopyranose|6-O-beta-D-xylopyranosyl-D-glucopyranose|Xyl(b1-6)Glc|beta-D-xylo-pentopyranosyl-(1->6)-D-gluco-hexopyranose|beta-D-xylopyranosyl-(1->6)-D-glucopyranose|primeverose 6-O-beta-D-xylopyranosyl-D-glucopyranose|Xyl(b1-6)Glc 6-O-(beta-D-xylopyranosyl)-D-glucopyranose|6-O-beta-D-xylopyranosyl-D-glucopyranose|Xyl(b1-6)Glc|beta-D-xylo-pentopyranosyl-(1->6)-D-gluco-hexopyranose|beta-D-xylopyranosyl-(1->6)-D-glucopyranose|primeverose http://purl.obolibrary.org/obo/CHEBI_146448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14648 biolink:ChemicalEntity NMN(+) beilstein:4158043 Graph 3-carbamoyl-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium 3-carbamoyl-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium 3-carbamoyl-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium http://purl.obolibrary.org/obo/CHEBI_14648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14649 biolink:ChemicalEntity NMN(-) beilstein:5153835 Graph 3-carbamoyl-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium|beta-nicotinamide D-ribonucleotide 3-carbamoyl-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium 3-carbamoyl-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium|beta-nicotinamide D-ribonucleotide http://purl.obolibrary.org/obo/CHEBI_14649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146500 biolink:ChemicalEntity D-Galp-(1->3)-D-GalpNAc An amino disaccharide that is 2-acetamido-2-deoxy-D-galactopyranose in which the hydroxy group at position 3 has been converted to the corresponding D-galactopyranoside. The stereochemistry at the anomeric position in each of the galactopyranose rings is not stated. glygen:G01416HI|glytoucan:G01416HI|kegg.glycan:G10100 Graph 2-acetamido-2-deoxy-3-O-D-galactopyranosyl-D-galactopyranose|D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-D-galacto-hexopyranose|Gal(?1-3)GalNAc|N-[(3R,4R,5R,6R)-2,5-dihydroxy-6-(hydroxymethyl)-4-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide 2-acetamido-2-deoxy-3-O-D-galactopyranosyl-D-galactopyranose|Gal(?1-3)GalNAc 2-acetamido-2-deoxy-3-O-D-galactopyranosyl-D-galactopyranose|D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-D-galacto-hexopyranose|Gal(?1-3)GalNAc|N-[(3R,4R,5R,6R)-2,5-dihydroxy-6-(hydroxymethyl)-4-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide http://purl.obolibrary.org/obo/CHEBI_146500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:146781 biolink:ChemicalEntity mature microcin B18 zwitterion The current microcin B17, CHEBI:64624 is a precursor, see fig. 2 pubmed:30661981|pubmed:8895467 Graph MccB17|microcin B17 MccB17|microcin B17 http://purl.obolibrary.org/obo/CHEBI_146781 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:146806 biolink:ChemicalEntity beta-D-Glcp-(1->2)-[beta-D-Glcp-(1->3)]-beta-D-Glcp A glucotriose that is β-D-glucopyranose in which the hydroxy groups at positions 2 and 3 have each been converted into the corresponding β-D-glucopyranoside. glygen:G05353EZ|glytoucan:G05353EZ Graph (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-2,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol|Glc(b1-2)[Glc(b1-3)]b-Glc|beta-D-gluco-hexopyranosyl-(1->2)-[beta-D-gluco-hexopyranosyl-(1->3)]-beta-D-gluco-hexopyranose|beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranose Glc(b1-2)[Glc(b1-3)]b-Glc|beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranose (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-2,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol|Glc(b1-2)[Glc(b1-3)]b-Glc|beta-D-gluco-hexopyranosyl-(1->2)-[beta-D-gluco-hexopyranosyl-(1->3)]-beta-D-gluco-hexopyranose|beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_146806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1472 biolink:ChemicalEntity 3-chloro-cis,cis-muconic acid A 3-chloromuconic acid that is cis,cis-muconic acid substituted by a chloro substituent at position 3. cas:22752-96-1|kegg.compound:C03585|reaxys:2082660 Graph (2E,4Z)-3-chlorohexa-2,4-dienedioic acid|(E,Z)-3-chloro-2,4-hexadienedioic acid|3-Chloro-cis,cis-muconate (2E,4Z)-3-chlorohexa-2,4-dienedioic acid (2E,4Z)-3-chlorohexa-2,4-dienedioic acid|(E,Z)-3-chloro-2,4-hexadienedioic acid|3-Chloro-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_1472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147281 biolink:ChemicalEntity GS-441524 A C-nucleoside analog that is (2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-carbonitrile substituted by a 4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl group at position 2. It is the active metabolite of remdesivir and exhibits a broad range of inhibitory activity against various RNA viruses including HCV, parainfluenza and SARS-CoV. cas:1191237-69-0|pubmed:22446091|pubmed:28124907|pubmed:29778200|pubmed:30755068 Graph (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-carbonitrile|EVO 984|EVO-984|EVO984|GS 441524|GS441524 (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-carbonitrile (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-carbonitrile|EVO 984|EVO-984|EVO984|GS 441524|GS441524 http://purl.obolibrary.org/obo/CHEBI_147281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147283 biolink:ChemicalEntity cinanserin(1+) An ammonium ion derivative that is the conjugate acid of cinanserin, obtained by the protonation of the tertiary amino group. It is the major microspecies at pH 7.3. Graph N,N-dimethyl-3-[(2-{[(2E)-3-phenylprop-2-enoyl]amino}phenyl)sulfanyl]propan-1-aminium|dimethyl-[3-[2-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanylpropyl]azanium N,N-dimethyl-3-[(2-{[(2E)-3-phenylprop-2-enoyl]amino}phenyl)sulfanyl]propan-1-aminium N,N-dimethyl-3-[(2-{[(2E)-3-phenylprop-2-enoyl]amino}phenyl)sulfanyl]propan-1-aminium|dimethyl-[3-[2-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanylpropyl]azanium http://purl.obolibrary.org/obo/CHEBI_147283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147285 biolink:ChemicalEntity EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor An EC 3.4.22.* (cysteine endopeptidase) inhibitor that interferes with the action of SARS coronavirus main proteinase (EC 3.4.22.69). wikipedia.en:C30_Endopeptidase Graph 3C-like protease inhibitor|3C-like protease inhibitors|3cLpro inhibitor|3cLpro inhibitors|EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitors|EC 3.4.22.69 inhibitor|EC 3.4.22.69 inhibitors|Mpro inhibitor|Mpro inhibitors|SARS 3C-like protease inhibitor|SARS 3C-like protease inhibitors|SARS coronavirus 3CL protease inhibitor|SARS coronavirus 3CL protease inhibitors|SARS coronavirus main peptidase inhibitor|SARS coronavirus main peptidase inhibitors|SARS coronavirus main protease inhibitor|SARS coronavirus main protease inhibitors|SARS coronavirus main proteinase inhibitor|SARS coronavirus main proteinase inhibitors|SARS-CoV 3CLpro enzyme inhibitor|SARS-CoV 3CLpro enzyme inhibitors|SARS-CoV Mpro inhibitor|SARS-CoV Mpro inhibitors|SARS-CoV main protease inhibitor|SARS-CoV main protease inhibitors|coronavirus 3C-like protease inhibitor|coronavirus 3C-like protease inhibitors|severe acute respiratory syndrome coronavirus main protease inhibitor|severe acute respiratory syndrome coronavirus main protease inhibitors 3C-like protease inhibitor|3C-like protease inhibitors|3cLpro inhibitor|3cLpro inhibitors|EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitors|EC 3.4.22.69 inhibitor|EC 3.4.22.69 inhibitors|Mpro inhibitor|Mpro inhibitors|SARS 3C-like protease inhibitor|SARS 3C-like protease inhibitors|SARS coronavirus 3CL protease inhibitor|SARS coronavirus 3CL protease inhibitors|SARS coronavirus main peptidase inhibitor|SARS coronavirus main peptidase inhibitors|SARS coronavirus main protease inhibitor|SARS coronavirus main protease inhibitors|SARS coronavirus main proteinase inhibitor|SARS coronavirus main proteinase inhibitors|SARS-CoV 3CLpro enzyme inhibitor|SARS-CoV 3CLpro enzyme inhibitors|SARS-CoV Mpro inhibitor|SARS-CoV Mpro inhibitors|SARS-CoV main protease inhibitor|SARS-CoV main protease inhibitors|coronavirus 3C-like protease inhibitor|coronavirus 3C-like protease inhibitors|severe acute respiratory syndrome coronavirus main protease inhibitor|severe acute respiratory syndrome coronavirus main protease inhibitors http://purl.obolibrary.org/obo/CHEBI_147285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147286 biolink:ChemicalEntity N(2)-formyl-N(1)-(5-phospho-beta-D-ribosyl)glycinamide(2-) There is a wrong x-ref in CHEBI:61357 to MetaCyc 5-P-RIBOSYL-N-FORMYLGLYCINEAMIDE metacyc.compound:5-P-RIBOSYL-N-FORMYLGLYCINEAMIDE Graph N(2)-formyl-N(1)-(5-phospho-beta-D-ribosyl)glycinamide N(2)-formyl-N(1)-(5-phospho-beta-D-ribosyl)glycinamide http://purl.obolibrary.org/obo/CHEBI_147286 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147287 biolink:ChemicalEntity 2-formamido-N(1)-(5-O-phosphonato-beta-D-ribosyl)acetamidine metacyc.compound:5-PHOSPHORIBOSYL-N-FORMYLGLYCINEAMIDINE Graph 2-formamido-N(1)-(5-O-phospho-beta-D-ribosyl)acetamidine 2-formamido-N(1)-(5-O-phospho-beta-D-ribosyl)acetamidine http://purl.obolibrary.org/obo/CHEBI_147287 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147288 biolink:ChemicalEntity omega-hydroxy-ultra-long-chain fatty acid anion Any ω-hydroxy-fatty acid anion which has a chain length greater than C27. Graph an omega-hydroxy-ultra-long-chain fatty acid|omega-hydroxy ultra-long-chain fatty acid anion|omega-hydroxy ultra-long-chain fatty acid anions|omega-hydroxy-ultra-long-chain fatty acid anions|omega-hydroxy-ultra-long-chain fatty acid(1-) an omega-hydroxy-ultra-long-chain fatty acid|omega-hydroxy ultra-long-chain fatty acid anion|omega-hydroxy ultra-long-chain fatty acid anions|omega-hydroxy-ultra-long-chain fatty acid anions|omega-hydroxy-ultra-long-chain fatty acid(1-) http://purl.obolibrary.org/obo/CHEBI_147288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147289 biolink:ChemicalEntity EC 3.4.17.23 (angiotensin-converting enzyme 2) inhibitor Any EC 3.4.17.* (metallocarboxypeptidase) inhibitor that inhibits the action of angiotensin-converting enzyme 2 (EC 3.4.17.23). wikipedia.en:Angiotensin-converting_enzyme_2 Graph ACE-2 inhibitor|ACE-2 inhibitors|ACE2 inhibitor|ACE2 inhibitors|EC 3.4.17.23 (angiotensin-converting enzyme 2) inhibitor|EC 3.4.17.23 (angiotensin-converting enzyme 2) inhibitors|EC 3.4.17.23 inhibitor|EC 3.4.17.23 inhibitors|angiotensin converting enzyme 2 inhibitor|angiotensin converting enzyme 2 inhibitors|angiotensin converting enzyme-2 inhibitor|angiotensin converting enzyme-2 inhibitors|angiotensin-converting enzyme 2 inhibitor|angiotensin-converting enzyme 2 inhibitors|hACE2 inhibitor|hACE2 inhibitors ACE-2 inhibitor|ACE-2 inhibitors|ACE2 inhibitor|ACE2 inhibitors|EC 3.4.17.23 (angiotensin-converting enzyme 2) inhibitor|EC 3.4.17.23 (angiotensin-converting enzyme 2) inhibitors|EC 3.4.17.23 inhibitor|EC 3.4.17.23 inhibitors|angiotensin converting enzyme 2 inhibitor|angiotensin converting enzyme 2 inhibitors|angiotensin converting enzyme-2 inhibitor|angiotensin converting enzyme-2 inhibitors|angiotensin-converting enzyme 2 inhibitor|angiotensin-converting enzyme 2 inhibitors|hACE2 inhibitor|hACE2 inhibitors http://purl.obolibrary.org/obo/CHEBI_147289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147290 biolink:ChemicalEntity EC 3.4.17* (metallocarboxypeptidase) inhibitor Any EC 3.4.* (hydrolases acting on peptide bond) inhibitor that inhibits the action of a metallocarboxypeptidase (EC 3.4.17.*). Graph EC 3.4.17* (metallocarboxypeptidase) inhibitor|EC 3.4.17* (metallocarboxypeptidase) inhibitors|EC 3.4.17.* inhibitor|EC 3.4.17.* inhibitors|metallocarboxypeptidase inhibitor|metallocarboxypeptidase inhibitors EC 3.4.17* (metallocarboxypeptidase) inhibitor|EC 3.4.17* (metallocarboxypeptidase) inhibitors|EC 3.4.17.* inhibitor|EC 3.4.17.* inhibitors|metallocarboxypeptidase inhibitor|metallocarboxypeptidase inhibitors http://purl.obolibrary.org/obo/CHEBI_147290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147297 biolink:ChemicalEntity omega-hydroxy-ultra-long-chain fatty acid Any ω-hydroxy-fatty acid which has a chain length greater than C27. pubmed:24078707 Graph omega-hydroxy-ultra-long-chain fatty acids|ultra-long-chain omega-hydroxy-fatty acid|ultra-long-chain omega-hydroxy-fatty acids|ultra-long-chain-omega-hydroxy-fatty acid|ultra-long-chain-omega-hydroxy-fatty acids omega-hydroxy-ultra-long-chain fatty acids|ultra-long-chain omega-hydroxy-fatty acid|ultra-long-chain omega-hydroxy-fatty acids|ultra-long-chain-omega-hydroxy-fatty acid|ultra-long-chain-omega-hydroxy-fatty acids http://purl.obolibrary.org/obo/CHEBI_147297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147330 biolink:ChemicalEntity biphenyl-2,2',3,3'-tetraol A biphenyl that has four hydroxy groups attached to the benzenoid ring system (position 2,2',3 and 3'); majos species at pH 7.3 metacyc.compound:CPD-14164|pubmed:8449871 Graph 2,2',3,3'-tetrahydroxybiphenyl|biphenyl-2,2',3,3'-tetraol 2,2',3,3'-tetrahydroxybiphenyl|biphenyl-2,2',3,3'-tetraol http://purl.obolibrary.org/obo/CHEBI_147330 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147331 biolink:ChemicalEntity 2-propylphenol A member of the class of phenols that is phenol which is substituted by a propyl group at position 2. agr:IND44277107|cas:644-35-9|foodb.food:FDB010568|hmdb:HMDB0032624|metacyc.compound:CPD-14147|pdb-ccd:JZ4|pubmed:19705287|pubmed:19782087|pubmed:23630291|pubmed:8481010|reaxys:1363932 Graph 1-(2-hydroxyphenyl)propane|1-hydroxy-2-n-propylbenzene|1-hydroxy-2-propylbenzene|2-n-propylphenol|2-propylphenol|o-propylphenol 2-propylphenol 1-(2-hydroxyphenyl)propane|1-hydroxy-2-n-propylbenzene|1-hydroxy-2-propylbenzene|2-n-propylphenol|2-propylphenol|o-propylphenol http://purl.obolibrary.org/obo/CHEBI_147331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147332 biolink:ChemicalEntity 3-propylcatechol A member of the class of catechols that is catechol which is substituted by a propyl group at position 3. It is a chemical component in tobacco. cas:2896-63-1|metacyc.compound:CPD0-2477|pubmed:543699|pubmed:8481010|pubmed:8752345 Graph 3-n-propylcatechol|3-propyl-1,2-benzenediol|3-propylbenzene-1,2-diol|3-propylcatechol|3-propylpyrocatechol 3-propylbenzene-1,2-diol 3-n-propylcatechol|3-propyl-1,2-benzenediol|3-propylbenzene-1,2-diol|3-propylcatechol|3-propylpyrocatechol http://purl.obolibrary.org/obo/CHEBI_147332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147334 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol anion derivative A phosphatidylinositol anion where the inositol is either not phosphorylated or phosphorylated at position 4 and/or position 5; major species at pH 7.3. Graph 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol anion derivative|a 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol derivative 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol anion derivative|a 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol derivative http://purl.obolibrary.org/obo/CHEBI_147334 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147335 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol-3-phosphate anion derivative A phosphatidylinositol anion where the inositol is phosphorylated at position 3 and either phosphorylated or not at position 4 and/or position 5; major species at pH 7.3. Graph 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate anion derivative|a 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate derivative 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate anion derivative|a 1,2-diacyl-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate derivative http://purl.obolibrary.org/obo/CHEBI_147335 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147340 biolink:ChemicalEntity (2R)-2-hydroperoxy fatty acid anion A hydroperoxy fatty acid anion resulting from the deprotonation of the carboxy group of any (2R)-hydroperoxy fatty acid. Graph a (2R)-2-hydroperoxy fatty acid a (2R)-2-hydroperoxy fatty acid http://purl.obolibrary.org/obo/CHEBI_147340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147341 biolink:ChemicalEntity fumigermin A member of the class of nectriapyrones that is 2H-pyran-2-one which is substituted at positions 3, 4, 5 and 6 by methyl, hydroxy, methyl and but-2-en-2-yl groups, respectively. It is a secondary metabolite produced by Aspergillus fumigatus and inhibits germination of spores of the inducing Streptomyces rapamycinicus. pubmed:32083553 Graph 6-[(2E)-but-2-en-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one|fumigermin 6-[(2E)-but-2-en-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one 6-[(2E)-but-2-en-2-yl]-4-hydroxy-3,5-dimethyl-2H-pyran-2-one|fumigermin http://purl.obolibrary.org/obo/CHEBI_147341 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147343 biolink:ChemicalEntity 2-hydroperoxy fatty acid Any hydroperoxy fatty acid in which the hydroperoxy group is located on the carbon at position 2. Graph 2-hydroperoxy fatty acids 2-hydroperoxy fatty acids http://purl.obolibrary.org/obo/CHEBI_147343 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147344 biolink:ChemicalEntity (2R)-hydroperoxy fatty acid Any 2-hydroperoxy fatty acid which has R configuration at the carbon bearing the hydroperoxy group. Graph http://purl.obolibrary.org/obo/CHEBI_147344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147345 biolink:ChemicalEntity (2S)-hydroperoxy fatty acid Any 2-hydroperoxy fatty acid which has S configuration at the carbon bearing the hydroperoxy group. Graph http://purl.obolibrary.org/obo/CHEBI_147345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147347 biolink:ChemicalEntity tilorone A member of the class of fluoren-9-ones that is 9H-fluoren-9-one which is substituted by a 2-(diethylamino)ethoxy group at positions 2 and 7. It is an interferon inducer and a selective α7 nicotinic acetylcholine receptor (α7 nAChR) agonist. Its hydrochloride salt is used as an antiviral drug. cas:27591-97-5|drugbank:DB17965|hmdb:HMDB0259096|lincs.smallmolecule:LSM-20974|pubmed:17571857|pubmed:18157163|pubmed:22281189|pubmed:23665799|pubmed:29133569|pubmed:29655797|pubmed:30463695|pubmed:30537230|pubmed:30880776|pubmed:32205350|pubmed:32215760|pubmed:33400519|pubmed:33804032|pubmed:34705177|pubmed:35056541|pubmed:37012691|pubmed:37033868|wikipedia.en:Tilorone Graph 2,7-bis[2-(diethylamino)ethoxy]-9-fluorenone|2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-one|tilorona|tilorone|tiloronum 2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-one 2,7-bis[2-(diethylamino)ethoxy]-9-fluorenone|2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-one|tilorona|tilorone|tiloronum http://purl.obolibrary.org/obo/CHEBI_147347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147355 biolink:ChemicalEntity tilorone(2+) An ammonium ion derivative resulting from the protonation of the two tertiary amino groups of tilorone. Graph 2,2'-[(9-oxo-9H-fluorene-2,7-diyl)bis(oxy)]bis(N,N-diethylethanaminium)|N,N'-[(9-oxo-9H-fluorene-2,7-diyl)bis(oxyethane-2,1-diyl)]bis(N-ethylethan-1-aminium) 2,2'-[(9-oxo-9H-fluorene-2,7-diyl)bis(oxy)]bis(N,N-diethylethanaminium) 2,2'-[(9-oxo-9H-fluorene-2,7-diyl)bis(oxy)]bis(N,N-diethylethanaminium)|N,N'-[(9-oxo-9H-fluorene-2,7-diyl)bis(oxyethane-2,1-diyl)]bis(N-ethylethan-1-aminium) http://purl.obolibrary.org/obo/CHEBI_147355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147362 biolink:ChemicalEntity neurotensin(1+) A peptide cation obtained from the deprotonation of the carboxy groups of L-α-glutamyl and L-leucine residues, and protonation of the side chains of L-lysyl and L-arginyl residues of neurotensin. It is the major species at pH 7.3. pubmed:31614422|pubmed:32057800|pubmed:32275927 Graph 5-oxo-L-prolyl-L-leucyl-L-tyrosyl-5-oxidanidyl-5-oxidanylidene-L-norvalyl-L-asparaginyl-6-azaniumyl-L-norleucyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-L-tyrosyl-N-[(1S)-1-carboxylato-3-methylbutyl]-L-isoleucinamide|L-Pyr-L-Leu-L-Tyr-L-Glu-L-Asn-L-Lys-L-Pro-L-Arg-L-Arg-L-Pro-L-Tyr-L-Ile-L-Leu(1+)|L-pyroglutamyl-L-leucyl-L-tyrosyl-L-alpha-glutamyl-L-asparagyl-L-lysyl-L-prolyl-L-arginyl-L-arginyl-L-prolyl-L-tyrosyl-L-isoleucyl-L-leucine(1+)|Pyr-Leu-Tyr-Glu-Asn-Lys-Pro-Arg-Arg-Pro-Tyr-Ile-Leu(1+)|neurotensin 5-oxo-L-prolyl-L-leucyl-L-tyrosyl-5-oxidanidyl-5-oxidanylidene-L-norvalyl-L-asparaginyl-6-azaniumyl-L-norleucyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-L-tyrosyl-N-[(1S)-1-carboxylato-3-methylbutyl]-L-isoleucinamide 5-oxo-L-prolyl-L-leucyl-L-tyrosyl-5-oxidanidyl-5-oxidanylidene-L-norvalyl-L-asparaginyl-6-azaniumyl-L-norleucyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-L-tyrosyl-N-[(1S)-1-carboxylato-3-methylbutyl]-L-isoleucinamide|L-Pyr-L-Leu-L-Tyr-L-Glu-L-Asn-L-Lys-L-Pro-L-Arg-L-Arg-L-Pro-L-Tyr-L-Ile-L-Leu(1+)|L-pyroglutamyl-L-leucyl-L-tyrosyl-L-alpha-glutamyl-L-asparagyl-L-lysyl-L-prolyl-L-arginyl-L-arginyl-L-prolyl-L-tyrosyl-L-isoleucyl-L-leucine(1+)|Pyr-Leu-Tyr-Glu-Asn-Lys-Pro-Arg-Arg-Pro-Tyr-Ile-Leu(1+)|neurotensin http://purl.obolibrary.org/obo/CHEBI_147362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147369 biolink:ChemicalEntity glucotetraose Any tetrasaccharide composed of 4 glucose moieties. Graph glucotetrose glucotetrose http://purl.obolibrary.org/obo/CHEBI_147369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14737 biolink:ChemicalEntity pantoic acid cas:470-29-1|kegg.compound:C00522 Graph 2,4-dihydroxy-3,3-dimethylbutanoic acid|Pantoate|Pantoic acid 2,4-dihydroxy-3,3-dimethylbutanoic acid 2,4-dihydroxy-3,3-dimethylbutanoic acid|Pantoate|Pantoic acid http://purl.obolibrary.org/obo/CHEBI_14737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147380 biolink:ChemicalEntity ecdysone 22-phosphate(2-) metacyc.compound:CPD-15594|pubmed:12721294 Graph ecdysone 22-phosphate ecdysone 22-phosphate http://purl.obolibrary.org/obo/CHEBI_147380 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:147392 biolink:ChemicalEntity His-Leu zwitterion A dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of His-Leu. Major species at pH 7.3. Graph (2S)-2-{[(2S)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoyl]amino}-4-methylpentanoate|H-L zwitterion|L-His-L-Leu zwitterion|L-histidyl-L-leucine|histidylleucine zwitterion (2S)-2-{[(2S)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoyl]amino}-4-methylpentanoate (2S)-2-{[(2S)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoyl]amino}-4-methylpentanoate|H-L zwitterion|L-His-L-Leu zwitterion|L-histidyl-L-leucine|histidylleucine zwitterion http://purl.obolibrary.org/obo/CHEBI_147392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147395 biolink:ChemicalEntity apelin-13(3+) A peptide cation obtained from the protonation of the N-terminus amino group and L-arginyl side chains, and deprotonation of the C-terminus carboxy group of apelin-13. It is the major species at pH 7.3. pubmed:11815627 Graph Gln-Arg-Pro-Arg-Leu-Ser-His-Lys-Gly-Pro-Met-Pro-Phe(3+)|L-Gln-L-Arg-L-Pro-L-Arg-L-Leu-L-Ser-L-His-L-Lys-L-Gly-L-Pro-L-Met-L-Pro-L-Phe(3+)|L-glutaminyl-L-arginyl-L-prolyl-L-arginyl-L-leucyl-L-seryl-L-histidyl-L-lysylglycyl-L-prolyl-L-methionyl-L-prolyl-L-phenylalanine(3+)|N(2)-[(2S)-5-amino-2-azaniumyl-5-oxopentanoyl]-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-leucyl-L-seryl-L-histidyl-6-azaniumyl-L-norleucylglycyl-L-prolyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-prolinamide|apelin-13|apelin-13 peptide(3+) N(2)-[(2S)-5-amino-2-azaniumyl-5-oxopentanoyl]-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-leucyl-L-seryl-L-histidyl-6-azaniumyl-L-norleucylglycyl-L-prolyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-prolinamide Gln-Arg-Pro-Arg-Leu-Ser-His-Lys-Gly-Pro-Met-Pro-Phe(3+)|L-Gln-L-Arg-L-Pro-L-Arg-L-Leu-L-Ser-L-His-L-Lys-L-Gly-L-Pro-L-Met-L-Pro-L-Phe(3+)|L-glutaminyl-L-arginyl-L-prolyl-L-arginyl-L-leucyl-L-seryl-L-histidyl-L-lysylglycyl-L-prolyl-L-methionyl-L-prolyl-L-phenylalanine(3+)|N(2)-[(2S)-5-amino-2-azaniumyl-5-oxopentanoyl]-N(5)-[amino(iminio)methyl]-L-ornithyl-L-prolyl-N(5)-[amino(iminio)methyl]-L-ornithyl-L-leucyl-L-seryl-L-histidyl-6-azaniumyl-L-norleucylglycyl-L-prolyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-prolinamide|apelin-13|apelin-13 peptide(3+) http://purl.obolibrary.org/obo/CHEBI_147395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147398 biolink:ChemicalEntity tideglusib A member of the class of thiadiazolidines that is 1,2,4-thiadiazolidine-3,5-dione which is substituted by a naphthalen-1-yl group at position 2 and by a benzyl group at position 4. It is a non-ATP competitive inhibitor of glycogen synthase kinase 3β (GSK3β) and has neuroprotective effects. Currently under clinical investigation for the treatment of Alzheimer's disease and progressive supranuclear palsy. cas:865854-05-3|drugbank:DB12129|pubmed:17522320|pubmed:22936007|pubmed:24488721|pubmed:24532007|pubmed:25537011|pubmed:26289787|pubmed:26398371|pubmed:27378458|pubmed:27490211|pubmed:28982059|pubmed:29388174|pubmed:29431064|pubmed:29603837|pubmed:30574063|pubmed:30666199|pubmed:30965670|pubmed:31156177|pubmed:32195836|wikipedia.en:Tideglusib Graph 4-benzyl-2-(naphthalen-1-yl)-1,2,4-thiadiazolidine-3,5-dione|NP 031112|NP-031112|NP-12|NP031112|Nypta|Zentylor|tideglusib|tideglusibum 4-benzyl-2-(naphthalen-1-yl)-1,2,4-thiadiazolidine-3,5-dione 4-benzyl-2-(naphthalen-1-yl)-1,2,4-thiadiazolidine-3,5-dione|NP 031112|NP-031112|NP-12|NP031112|Nypta|Zentylor|tideglusib|tideglusibum http://purl.obolibrary.org/obo/CHEBI_147398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147411 biolink:ChemicalEntity TDZD-8 A member of the class of thiadiazolidines that is 1,2,4-thiadiazolidine-3,5-dione which is substituted by a methyl group at position 2 and by a benzyl group at position 4. It is a non-ATP competitive inhibitor of glycogen synthase kinase 3β (GSK3β). An experimental compound which was being developed for the potential treatment of Alzheimer's disease. cas:327036-89-5|patent:NZ574619|pubmed:11881998|pubmed:17785584|pubmed:18323734|pubmed:21079728|pubmed:21966423|pubmed:25394244|pubmed:25453207|pubmed:25735991|pubmed:28256059|pubmed:28624830|pubmed:28962480|pubmed:28965119|pubmed:30392874|pubmed:31399185|pubmed:32141492|pubmed:32181909|pubmed:32188325 Graph 4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione|NP 01139|thiadiazolidinone-8 4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione 4-benzyl-2-methyl-1,2,4-thiadiazolidine-3,5-dione|NP 01139|thiadiazolidinone-8 http://purl.obolibrary.org/obo/CHEBI_147411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14750 biolink:ChemicalEntity acetylacetone A β-diketone that is pentane in which the hydrogens at positions 2 and 4 are replaced by oxo groups. cas:123-54-6|gmelin:2537|hmdb:HMDB0031648|kegg.compound:C15499|metacyc.compound:CPD-8879|pubmed:24445259|reaxys:741937|wikipedia.en:Acetylacetone Graph 2,4-Dioxopentane|2,4-dioxopentane|2,4-pentadione|2,4-pentanedione|ACAC|Acetylacetone|CH3-CO-CH2-CO-CH3|Hacac|acetoacetone|acetyl 2-propanone|acetylacetone|pentan-2,4-dione|pentane-2,4-dione pentane-2,4-dione 2,4-Dioxopentane|2,4-dioxopentane|2,4-pentadione|2,4-pentanedione|ACAC|Acetylacetone|CH3-CO-CH2-CO-CH3|Hacac|acetoacetone|acetyl 2-propanone|acetylacetone|pentan-2,4-dione|pentane-2,4-dione http://purl.obolibrary.org/obo/CHEBI_14750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:147675 biolink:ChemicalEntity 5-iodo-2'-deoxyuridine A pyrimidine 2'-deoxyribonucleoside compound having 5-iodouracil as the nucleobase; used as an antiviral agent. cas:54-42-2|drugbank:DB03778|drugcentral:1417|lincs.smallmolecule:LSM-5836|pubmed:17341060|pubmed:17438061|pubmed:18555978|pubmed:3950402|reaxys:30397 Graph (+)-5-Iodo-2'-deoxyuridine|1-(2-Deoxy-beta-D-ribofuranosyl)-5-iodouracil|1-beta-D-2'-Deoxyribofuranosyl-5-iodouracil|1beta-D-2'-Deoxyribofuranosyl-5-iodouracil|2'-Deoxy-5-iodouridine|2'-deoxy-5-iodouridine|5-Iododeoxyuridine|5-Iodouracil deoxyriboside|IdU|Idoxuridin|Idoxuridinum|Iododeoxyridine|Iodoxuridine|Joddeoxiuridin|idoxuridina|idoxuridine 2'-deoxy-5-iodouridine (+)-5-Iodo-2'-deoxyuridine|1-(2-Deoxy-beta-D-ribofuranosyl)-5-iodouracil|1-beta-D-2'-Deoxyribofuranosyl-5-iodouracil|1beta-D-2'-Deoxyribofuranosyl-5-iodouracil|2'-Deoxy-5-iodouridine|2'-deoxy-5-iodouridine|5-Iododeoxyuridine|5-Iodouracil deoxyriboside|IdU|Idoxuridin|Idoxuridinum|Iododeoxyridine|Iodoxuridine|Joddeoxiuridin|idoxuridina|idoxuridine http://purl.obolibrary.org/obo/CHEBI_147675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:148869 biolink:ChemicalEntity alpha-D-galactosamine A 2-amino-2-deoxy-D-galactopyranose that has α- configuration at the anomeric centre. cas:14196-84-0|glytoucan:G24361QY|pdb-ccd:X6X Graph 2-amino-2-deoxy-alpha-D-galacto-hexopyranose|2-amino-2-deoxy-alpha-D-galactopyranose|a-GalN 2-amino-2-deoxy-alpha-D-galactopyranose|a-GalN 2-amino-2-deoxy-alpha-D-galacto-hexopyranose|2-amino-2-deoxy-alpha-D-galactopyranose|a-GalN http://purl.obolibrary.org/obo/CHEBI_148869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149071 biolink:ChemicalEntity beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->3)-alpha-D-Galp An amino trisaccharide consisting of β-D-galactopyranose, 2-acetamido-2-deoxy-β-D-galactopyranose and α-D-galactopyranose residues joined in sequence by (1→3) glycosidic linkages. glygen:G25129BT|glytoucan:G25129BT Graph Gal(b1-3)GalNAc(b1-3)a-Gal|N-[(2S,3R,4R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide|beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->3)-alpha-D-galacto-hexopyranose|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranose Gal(b1-3)GalNAc(b1-3)a-Gal|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranose Gal(b1-3)GalNAc(b1-3)a-Gal|N-[(2S,3R,4R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide|beta-D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1->3)-alpha-D-galacto-hexopyranose|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranose http://purl.obolibrary.org/obo/CHEBI_149071 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14919 biolink:ChemicalEntity N(6)-lipoyl-L-lysine residue Graph http://purl.obolibrary.org/obo/CHEBI_14919 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149226 biolink:ChemicalEntity fenoterol A member of the class resorcinols that is 5-(1-hydroxyethyl)benzene-1,3-diol in which one of the methyl hydrogens is replaced by a 1-(4-hydroxyphenyl)propan-2-amino group. A β2-adrenergic agonist, it is used (as the hydrobromide salt) as a bronchodilator in the management of reversible airway obstruction. cas:13392-18-2|drugbank:DB01288|drugcentral:1155|hmdb:HMDB0015405|kegg.drug:D04157|lincs.smallmolecule:LSM-1948|patent:BE640433|patent:US3341593|pubmed:17506540|pubmed:17845020|pubmed:19890360|reaxys:2157041|wikipedia.en:Fenoterol Graph 1-(3,5-dihydroxyphenyl)-1-hydroxy-2-((4-hydroxyphenyl)isopropylamino)ethane|1-(p-hydroxyphenyl)-2-((beta-hydroxy-beta-(3',5'-dihydroxyphenyl))ethyl)aminopropane|3,5-dihydroxy-alpha-(((p-hydroxy-alpha-methylphenethyl)amino)methyl)benzyl alcohol|5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol|5-{1-Hydroxy-2-[2-(4-hydroxy-phenyl)-1-methyl-ethylamino]-ethyl}-benzene-1,3-diol|fenoterol|fenoterolum|phenoterol 5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol 1-(3,5-dihydroxyphenyl)-1-hydroxy-2-((4-hydroxyphenyl)isopropylamino)ethane|1-(p-hydroxyphenyl)-2-((beta-hydroxy-beta-(3',5'-dihydroxyphenyl))ethyl)aminopropane|3,5-dihydroxy-alpha-(((p-hydroxy-alpha-methylphenethyl)amino)methyl)benzyl alcohol|5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol|5-{1-Hydroxy-2-[2-(4-hydroxy-phenyl)-1-methyl-ethylamino]-ethyl}-benzene-1,3-diol|fenoterol|fenoterolum|phenoterol http://purl.obolibrary.org/obo/CHEBI_149226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149304 biolink:ChemicalEntity L-galactofuranose The furanose form of L-galactose. glytoucan:G32871SU Graph (3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]oxolane-2,3,4-triol|L-Galf|L-galacto-hexofuranose L-Galf (3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]oxolane-2,3,4-triol|L-Galf|L-galacto-hexofuranose http://purl.obolibrary.org/obo/CHEBI_149304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149429 biolink:ChemicalEntity xylotriose Any trisaccharide composed of 3 xylose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_149429 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:149433 biolink:ChemicalEntity mannotetraose Any tetrasaccharide composed of 4 mannose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_149433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149465 biolink:ChemicalEntity glucopentaose Any pentasaccharide composed of 5 glucose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_149465 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149468 biolink:ChemicalEntity (8S)-8-amino-7-oxononanoic acid zwitterion metacyc.compound:8-AMINO-7-OXONONANOATE Graph (8S)-8-amino-7-oxononanoate (8S)-8-amino-7-oxononanoate http://purl.obolibrary.org/obo/CHEBI_149468 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149469 biolink:ChemicalEntity (7R,8S)-7,8-diammoniononanoate metacyc.compound:DIAMINONONANOATE Graph (7R,8S)-7,8-diammoniononanoate (7R,8S)-7,8-diammoniononanoate http://purl.obolibrary.org/obo/CHEBI_149469 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149471 biolink:ChemicalEntity pethidine(1+) An ammonium ion derivative that is the conjugate acid of pethidine, obtained from the protonation of the piperidine moiety. It is the major microspecies at pH 7.3. Graph 4-(ethoxycarbonyl)-1-methyl-4-phenylpiperidin-1-ium|4-(ethoxycarbonyl)-1-methyl-4-phenylpiperidinium 4-(ethoxycarbonyl)-1-methyl-4-phenylpiperidinium 4-(ethoxycarbonyl)-1-methyl-4-phenylpiperidin-1-ium|4-(ethoxycarbonyl)-1-methyl-4-phenylpiperidinium http://purl.obolibrary.org/obo/CHEBI_149471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149473 biolink:ChemicalEntity (4R,5S)-dethiobiotin(1-) A monocarboxylic acid anion that is the conjugate base of (4R,5S)-dethiobiotin, arising from the deprotonation of the carboxy group. Major species at pH 7.3. metacyc.compound:DETHIOBIOTIN Graph (4R,5S)-dethiobiotin|6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoate 6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoate (4R,5S)-dethiobiotin|6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoate http://purl.obolibrary.org/obo/CHEBI_149473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149484 biolink:ChemicalEntity chloroquine(2+) A quinolinium ion obtained by protonation of the quinoline nitrogen and tertiary amino group of the antimalarial drug chloroquine. It is the major species at pH 7.3. pubmed:25693996 Graph 7-chloro-4-{[5-(diethylazaniumyl)pentan-2-yl]amino}quinolinium|chloroquine dication|di-protonated chloroquine 7-chloro-4-{[5-(diethylazaniumyl)pentan-2-yl]amino}quinolinium 7-chloro-4-{[5-(diethylazaniumyl)pentan-2-yl]amino}quinolinium|chloroquine dication|di-protonated chloroquine http://purl.obolibrary.org/obo/CHEBI_149484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149489 biolink:ChemicalEntity 5,5-dimethyl-1-pyrroline N-oxide "A member of the class of 1-pyrroline nitrones (1-pyrroline N-oxides) resulting from the formal N-oxidation of 5,5-dimethyl-1-pyrroline. Used as a spin trap for the study of radicals formed by enzymatic acetaldehyde oxidation." cas:3317-61-1|pubmed:15704951|pubmed:16833945|pubmed:16833946|pubmed:17149843|pubmed:17214476|pubmed:17297236|pubmed:18303874|pubmed:19012384|pubmed:19425559|pubmed:19968309|pubmed:22285597|pubmed:22668066|pubmed:22975516|pubmed:23053730|pubmed:27132196|pubmed:28582898|pubmed:29589052|pubmed:30509064|pubmed:30684639|pubmed:31422198|pubmed:31843137 Graph 2,2-dimethyl-3,4-dihydro-2H-pyrrole 1-oxide|5,5-dimethyl-1-pyrroline N-oxide|5,5-dimethyl-1-pyrroline nitrone|5,5-dimethyl-1-pyrroline-1-oxide|5,5-dimethylpyrroline-N-oxide|DMPO 2,2-dimethyl-3,4-dihydro-2H-pyrrole 1-oxide 2,2-dimethyl-3,4-dihydro-2H-pyrrole 1-oxide|5,5-dimethyl-1-pyrroline N-oxide|5,5-dimethyl-1-pyrroline nitrone|5,5-dimethyl-1-pyrroline-1-oxide|5,5-dimethylpyrroline-N-oxide|DMPO http://purl.obolibrary.org/obo/CHEBI_149489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:14949 biolink:ChemicalEntity N(6)-(S(8)-aminomethyldihydrolipoyl)-L-lysine residue Graph http://purl.obolibrary.org/obo/CHEBI_14949 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149491 biolink:ChemicalEntity 1-pyrroline nitrones Any nitrone resulting from the oxidation of the ring nitrogen of 1-pyrroline or its substituted derivatives. Graph 1-pyrroline N-oxides 1-pyrroline N-oxides http://purl.obolibrary.org/obo/CHEBI_149491 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149492 biolink:ChemicalEntity 5,5-dimethyl-1-pyrroline A member of the class of pyrrolines that is 1-pyrroline in which the two hydrogens at position 5 are replaced by methyl groups. cas:2045-76-3|chemspider:9117576|pubmed:7960991|pubmed:9028868|pubmed:9720310 Graph 2,2-dimethyl-3,4-dihydro-2H-pyrrole 2,2-dimethyl-3,4-dihydro-2H-pyrrole 2,2-dimethyl-3,4-dihydro-2H-pyrrole http://purl.obolibrary.org/obo/CHEBI_149492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149497 biolink:ChemicalEntity spin trapping reagent A reagent used in electron paramagnetic resonance (EPR) spectroscopy to react covalently with radical products whose half-life is be too short to detect. The resulting adducts are more stable enabling their paramagnetic resonance spectra to be obtained. wikipedia.en:Spin_trapping Graph spin trap|spin trapping reagents|spin traps spin trap|spin trapping reagents|spin traps http://purl.obolibrary.org/obo/CHEBI_149497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149498 biolink:ChemicalEntity (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative An entity derived from (7Z,10Z,13Z,16Z)-docosatetraenoic acid where the R is not defined. pubmed:12911321 Graph a (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative|adrenoyl derivative a (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative|adrenoyl derivative http://purl.obolibrary.org/obo/CHEBI_149498 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149499 biolink:ChemicalEntity (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative An entity derived from (7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid where the R is not defined. pubmed:12911321 Graph DPA derivative|a (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative DPA derivative|a (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative http://purl.obolibrary.org/obo/CHEBI_149499 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149500 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative An entity derived from (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoic acid where the R is not defined. pubmed:12911321 Graph DHA derivative|a (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative DHA derivative|a (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative http://purl.obolibrary.org/obo/CHEBI_149500 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149502 biolink:ChemicalEntity (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative An entity derived from (4Z,7Z,10Z,13Z,16Z)-docosapentaenoic acid where the R is not defined. pubmed:11397798 Graph 22:5(4Z,7Z,10Z,13Z,16Z) derivative|a (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative 22:5(4Z,7Z,10Z,13Z,16Z) derivative|a (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative http://purl.obolibrary.org/obo/CHEBI_149502 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149504 biolink:ChemicalEntity losartan(1-) An organic anion that is the conjugate base of losartan, obtained from the deprotonation of the tetrazole NH group. Major species at pH 7.3. pubmed:18674515 Graph 5-(4'-{[2-butyl-4-chloro-5-(hydroxymethyl)-1H-imidazol-1-yl]methyl}[biphenyl]-2-yl)tetrazol-1-ide|losartan 5-(4'-{[2-butyl-4-chloro-5-(hydroxymethyl)-1H-imidazol-1-yl]methyl}[biphenyl]-2-yl)tetrazol-1-ide 5-(4'-{[2-butyl-4-chloro-5-(hydroxymethyl)-1H-imidazol-1-yl]methyl}[biphenyl]-2-yl)tetrazol-1-ide|losartan http://purl.obolibrary.org/obo/CHEBI_149504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149509 biolink:ChemicalEntity candesartan(2-) A monocarboxylic acid anion resulting from the deprotonation of the tetrazole NH group and carboxy group of candesartan. It is the major species at pH 7.3. pubmed:18674515 Graph 2-ethoxy-1-{[2'-(tetrazol-1-id-5-yl)[biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carboxylate|candesartan 2-ethoxy-1-{[2'-(tetrazol-1-id-5-yl)[biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carboxylate 2-ethoxy-1-{[2'-(tetrazol-1-id-5-yl)[biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carboxylate|candesartan http://purl.obolibrary.org/obo/CHEBI_149509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149520 biolink:ChemicalEntity polyhexamethylene biguanide A homopolymer macromolecule composed of repeating N-hexyltriimidodicarbonic diamide units. It is used as a disinfectant, antiseptic, and antifungal agent. Also commonly used as a swimming pool and spa water sanitizer. cas:28757-47-3|drugbank:DB12277|pubmed:24421812|pubmed:27608742|pubmed:29164688|pubmed:29305328|pubmed:29885293|pubmed:29939885|pubmed:30188388|pubmed:30879081|pubmed:31130579|pubmed:31179775|pubmed:31306828|pubmed:31624671|pubmed:31694998|pubmed:31724982|pubmed:31956437|pubmed:32183411|pubmed:32195752|pubmed:32304258|pubmed:6789045|wikipedia.en:Polyhexanide Graph Baquacil|NB 325|NB-325|PHMB|polihexanida|polihexanide|polihexanidum|poly(carbamimidoylcarbamimidamidohexane-1,6-diyl)|poly(hexamethylenebiguanide)|poly(iminocarbonimidoyliminocarbonimidoylimino-1,6-hexanediyl)|poly(iminoimidocarbonyl-iminoimidocarbonyl-iminohexamethylene)|polyhexamethylene guanide poly(carbamimidoylcarbamimidamidohexane-1,6-diyl) Baquacil|NB 325|NB-325|PHMB|polihexanida|polihexanide|polihexanidum|poly(carbamimidoylcarbamimidamidohexane-1,6-diyl)|poly(hexamethylenebiguanide)|poly(iminocarbonimidoyliminocarbonimidoylimino-1,6-hexanediyl)|poly(iminoimidocarbonyl-iminoimidocarbonyl-iminohexamethylene)|polyhexamethylene guanide http://purl.obolibrary.org/obo/CHEBI_149520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149532 biolink:ChemicalEntity laccaic acid D(1-) A monocarboxylic acid that is the conjugate base of laccaic acid D, obtained from the deprotonation of the carboxy group. Major species at pH 7.3. pubmed:29215010 Graph 3,6,8-trihydroxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate|flavokermesate|flavokermesic acid(1-)|laccaic acid D(1-) 3,6,8-trihydroxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate 3,6,8-trihydroxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylate|flavokermesate|flavokermesic acid(1-)|laccaic acid D(1-) http://purl.obolibrary.org/obo/CHEBI_149532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149538 biolink:ChemicalEntity polyhexamethylene biguanide(2+) A guanidinium ion resulting from the protonation of the two imine nitrogens of polyhexamethylene biguanide. It is the major species at pH 7.3 Graph polihexanide(2+)|poly[imino(iminiomethanediyl)imino(iminiomethanediyl)iminohexane-1,6-diyl] poly[imino(iminiomethanediyl)imino(iminiomethanediyl)iminohexane-1,6-diyl] polihexanide(2+)|poly[imino(iminiomethanediyl)imino(iminiomethanediyl)iminohexane-1,6-diyl] http://purl.obolibrary.org/obo/CHEBI_149538 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149548 biolink:ChemicalEntity emetine(2+) An ammonium ion derivative obtained from protonation of the nitrogens of emetine. It is the major species at pH 7.3. metacyc.compound:CPD-14817|pubmed:5985282 Graph (2S)-6',7',10,11-tetramethoxyemetan-2',5-diium|emetine|emetine dication (2S)-6',7',10,11-tetramethoxyemetan-2',5-diium (2S)-6',7',10,11-tetramethoxyemetan-2',5-diium|emetine|emetine dication http://purl.obolibrary.org/obo/CHEBI_149548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149552 biolink:ChemicalEntity emetic Any agent that induces nausea and vomiting. Graph emetics emetics http://purl.obolibrary.org/obo/CHEBI_149552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149553 biolink:ChemicalEntity anticoronaviral agent Any antiviral agent which inhibits the activity of coronaviruses. wikipedia.en:Coronavirus Graph anti-coronaviral agent|anti-coronaviral agents|anti-coronavirus agent|anti-coronavirus agents|anticoronaviral agent|anticoronaviral agents|anticoronaviral drug|anticoronaviral drugs|anticoronavirus agent|anticoronavirus agents|anticoronviral agent|anticoronviral agents anti-coronaviral agent|anti-coronaviral agents|anti-coronavirus agent|anti-coronavirus agents|anticoronaviral agent|anticoronaviral agents|anticoronaviral drug|anticoronaviral drugs|anticoronavirus agent|anticoronavirus agents|anticoronviral agent|anticoronviral agents http://purl.obolibrary.org/obo/CHEBI_149553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149554 biolink:ChemicalEntity C-terminal alpha-amino-acyl-L-glutamyl-L-glutamyl-L-tyrosinate(3-) residue metacyc.compound:Tyrosinated-Tubulins|pubmed:24022482 Graph C-terminal alpha-amino-acyl-L-glutamyl-L-glutamyl-L-tyrosinate residue C-terminal alpha-amino-acyl-L-glutamyl-L-glutamyl-L-tyrosinate residue http://purl.obolibrary.org/obo/CHEBI_149554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149555 biolink:ChemicalEntity C-terminal alpha-amino-acyl-L-glutamyl-L-glutamate(2-) residue metacyc.compound:Tubulins Graph C-terminal alpha-amino-acyl-L-glutamyl-L-glutamate residue C-terminal alpha-amino-acyl-L-glutamyl-L-glutamate residue http://purl.obolibrary.org/obo/CHEBI_149555 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149564 biolink:ChemicalEntity hydroxychloroquine(2+) A quinolinium ion obtained by protonation of the quinoline nitrogen and tertiary amino group of the antimalarial drug hydroxychloroquine. It is the major species at pH 7.3. pubmed:25693996 Graph 7-chloro-4-({5-[ethyl(2-hydroxyethyl)azaniumyl]pentan-2-yl}amino)quinolinium|hydroxychloroquine dication 7-chloro-4-({5-[ethyl(2-hydroxyethyl)azaniumyl]pentan-2-yl}amino)quinolinium 7-chloro-4-({5-[ethyl(2-hydroxyethyl)azaniumyl]pentan-2-yl}amino)quinolinium|hydroxychloroquine dication http://purl.obolibrary.org/obo/CHEBI_149564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149565 biolink:ChemicalEntity xylazine(1+) An organic cation that is the conjugate acid of xylazine, obtained by the protonation of the thiazine nitrogen. Graph 2-(2,6-dimethylanilino)-5,6-dihydro-4H-1,3-thiazin-3-ium 2-(2,6-dimethylanilino)-5,6-dihydro-4H-1,3-thiazin-3-ium 2-(2,6-dimethylanilino)-5,6-dihydro-4H-1,3-thiazin-3-ium http://purl.obolibrary.org/obo/CHEBI_149565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149591 biolink:ChemicalEntity (dihydroxyphenyl)propanoic acid A monocarboxylic acid that is propionic acid carrying a dihydroxyphenyl substituent at position 3. Graph (dihydroxyphenyl)propanoic acids (dihydroxyphenyl)propanoic acids http://purl.obolibrary.org/obo/CHEBI_149591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149634 biolink:ChemicalEntity dehydroemetine A pyridoisoquinoline which was developed in response to the cardiovascular toxicity associated with emetine and results from the dehydrogenation of the heterotricylic ring of emetine. It is an antiprotozoal agent and displays antimalarial, antiamoebic, and antileishmanial properties. cas:4914-30-1|drugbank:DB13865|drugcentral:3129|kegg.compound:C07996|kegg.drug:D00828|pubmed:13749080|pubmed:13990811|pubmed:13991475|pubmed:14040651|pubmed:14292163|pubmed:14482399|pubmed:16732|pubmed:19879|pubmed:2202709|pubmed:2565955|pubmed:2887439|pubmed:31964796|pubmed:4113710|pubmed:4394757|pubmed:4401314|pubmed:4716643|pubmed:4916834|pubmed:6041197|wikipedia.en:Dehydroemetine Graph (-)-2,3-dehydroemetine|(-)-R,S-dehydroemetine|2,3-didehydro-6',7',10,11-tetramethoxyemetan|2,3-didehydroemetine|2-dehydroemetine|6',7',10,11-tetramethoxy-2,3-didehydroemetan|BT 436|Dametin|Mebadin|Mebadine|Ro 1-9334|Ro 1-9334/19|Ro-1-9334/19|Ro-1933419|dehidroemetina|dehydroemetine|dehydroemetinum 6',7',10,11-tetramethoxy-2,3-didehydroemetan (-)-2,3-dehydroemetine|(-)-R,S-dehydroemetine|2,3-didehydro-6',7',10,11-tetramethoxyemetan|2,3-didehydroemetine|2-dehydroemetine|6',7',10,11-tetramethoxy-2,3-didehydroemetan|BT 436|Dametin|Mebadin|Mebadine|Ro 1-9334|Ro 1-9334/19|Ro-1-9334/19|Ro-1933419|dehidroemetina|dehydroemetine|dehydroemetinum http://purl.obolibrary.org/obo/CHEBI_149634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149673 biolink:ChemicalEntity (1S,2R)-ephedrine(1+) An organic cation obtained by protonation of the secondary amino function of (1S,2R)-ephedrine; major species at pH 7.3. metacyc.compound:CPD-22730 Graph (+)-ephedrinium|(1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium|(1S,2R)-ephedrine|(1S,2R)-ephedrinium (1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium (+)-ephedrinium|(1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium|(1S,2R)-ephedrine|(1S,2R)-ephedrinium http://purl.obolibrary.org/obo/CHEBI_149673 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149674 biolink:ChemicalEntity (1R,2R)-pseudoephedrine(1+) An organic cation obtained by protonation of the secondary amino function of (1R,2R)-pseudoephedrine; major species at pH 7.3. metacyc.compound:CPD-22732 Graph (1R,2R)-pseudoephedrine (1R,2R)-pseudoephedrine http://purl.obolibrary.org/obo/CHEBI_149674 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149682 biolink:ChemicalEntity O-diphosphonato-L-serine(3-) residue pubmed:19934039|pubmed:27789744|pubmed:31668836 Graph O-diphospho-L-serine residue O-diphospho-L-serine residue http://purl.obolibrary.org/obo/CHEBI_149682 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149689 biolink:ChemicalEntity D-dopa zwitterion An amino acid zwitterion obtained from the transfer of a proton from the carboxy group to the amino group of D-dopa. Major microspecies at pH 7.3. pubmed:17303072 Graph (2R)-2-ammonio-3-(3,4-dihydroxyphenyl)propanoate|(2R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)propanoate|D-dopa (2R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)propanoate (2R)-2-ammonio-3-(3,4-dihydroxyphenyl)propanoate|(2R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)propanoate|D-dopa http://purl.obolibrary.org/obo/CHEBI_149689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149690 biolink:ChemicalEntity N-(fatty acyl)-L-phenylalanine(1-) An N-acyl-L-phenylalanine where the acyl chain derives from a fatty acid, major species at pH 7.3. pubmed:32271712 Graph N-(fatty acyl)-L-phenylalaninate|an N-acyl-L-phenylalanine N-(fatty acyl)-L-phenylalaninate|an N-acyl-L-phenylalanine http://purl.obolibrary.org/obo/CHEBI_149690 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149714 biolink:ChemicalEntity N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-D-glucosaminide(2-) Graph alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->3)-[alpha-Neup5Ac-(2->6)]-D-GlcpNAc-R|an alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-(alpha-Neu5Ac-(2->6))-D-GlcNAc derivative alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->3)-[alpha-Neup5Ac-(2->6)]-D-GlcpNAc-R|an alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-(alpha-Neu5Ac-(2->6))-D-GlcNAc derivative http://purl.obolibrary.org/obo/CHEBI_149714 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:14973 biolink:ChemicalEntity pyrazole A monocyclic heteroarene that is a five-membered organic heterocycle containing two nitrogen atoms at positions 1 and 2. pubmed:24816008|wikipedia.en:Pyrazole Graph Pyrazol|pyrazole pyrazole Pyrazol|pyrazole http://purl.obolibrary.org/obo/CHEBI_14973 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149742 biolink:ChemicalEntity N-(fatty acyl)-glycine(1-) an N-acyl-glycine where the fatty acyl chain is not specified, major species at pH 7.3. pubmed:32271712 Graph N-(fatty acyl)-glycinate|N-fatty-acyl-Gly(1-)|an N-(fatty acyl)-glycine N-(fatty acyl)-glycinate|N-fatty-acyl-Gly(1-)|an N-(fatty acyl)-glycine http://purl.obolibrary.org/obo/CHEBI_149742 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149759 biolink:ChemicalEntity 2-methyl-L-serine zwitterion An amino acid zwitterion obtained from the transfer of a proton from the carboxy group to the amino group of 2-methyl-L-serine. Major species at pH 7.3. metacyc.compound:2-METHYL-L-SERINE Graph (2S)-2-azaniumyl-3-hydroxy-2-methylpropanoate|(S)-(+)-2-amino-3-hydroxy-2-methylpropionate|(S)-2-methylserine zwitterion|(S)-alpha-MeSer zwitterion|2-methyl-L-serine|alpha-methyl-L-serine zwitterion (2S)-2-azaniumyl-3-hydroxy-2-methylpropanoate (2S)-2-azaniumyl-3-hydroxy-2-methylpropanoate|(S)-(+)-2-amino-3-hydroxy-2-methylpropionate|(S)-2-methylserine zwitterion|(S)-alpha-MeSer zwitterion|2-methyl-L-serine|alpha-methyl-L-serine zwitterion http://purl.obolibrary.org/obo/CHEBI_149759 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149778 biolink:ChemicalEntity methyl-L-glutamic acid A non-proteinogenic L-α-amino acid that is L-glutamic acid substituted with a methyl group. Graph methyl-L-glutamic acid|methyl-L-glutamic acids methyl-L-glutamic acid|methyl-L-glutamic acids http://purl.obolibrary.org/obo/CHEBI_149778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149779 biolink:ChemicalEntity mannogen A mannose-containing polysaccharide that is a major energy reserve in Leishmania. It is comprised of linear chains of β-1,2-linked mannose residues (2-60 residues in length depending on development stage). pubmed:12902334|pubmed:16766650|pubmed:16841351|pubmed:21636575|pubmed:22393429|pubmed:25288791|pubmed:31513773|pubmed:31662278|pubmed:32133420|pubmed:34266735 Graph beta-1,2-mannan|beta1-2-mannan|mannan beta-1,2-mannan|beta1-2-mannan|mannan http://purl.obolibrary.org/obo/CHEBI_149779 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149836 biolink:ChemicalEntity tigecycline Tetracycline in which the hydroxy group at position 5 and the methyl group at position 6 are replaced by hydrogen, and with a dimethylamino substituent and an (N-tert-butylglycyl)amino substituent at positions 7 and 9, respectively. A glycylcycline antibiotic, it has activity against a broad range of Gram-positive and Gram-negative bacteria, including tetracycline-resistant organisms. It is used for the intravenous treatment of complicated skin and skin structure infections caused by susceptible organisms. cas:220620-09-7|drugbank:DB00560|drugcentral:2661|kegg.compound:C12012|kegg.drug:D01079|pubmed:17194827|pubmed:17210772|pubmed:17220399|pubmed:17307973|pubmed:17353238|pubmed:17353249|reaxys:8379453 Graph (4S,4aS,5aR,12aS)-9-(2-(tert-butylamino)acetamido)-4,7-bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxamide|(4S,4aS,5aR,12aS)-9-[(N-tert-butylglycyl)amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (4S,4aS,5aR,12aS)-9-[(N-tert-butylglycyl)amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (4S,4aS,5aR,12aS)-9-(2-(tert-butylamino)acetamido)-4,7-bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxamide|(4S,4aS,5aR,12aS)-9-[(N-tert-butylglycyl)amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_149836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:149837 biolink:ChemicalEntity Alisporivir cas:254435-95-5 Graph Alisporivir [USAN:INN] Alisporivir [USAN:INN] http://purl.obolibrary.org/obo/CHEBI_149837 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149838 biolink:ChemicalEntity Cryptotanshinone cas:35825-57-1 Graph http://purl.obolibrary.org/obo/CHEBI_149838 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149872 biolink:ChemicalEntity Dihydrotanshinone I cas:87205-99-0 Graph http://purl.obolibrary.org/obo/CHEBI_149872 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:149906 biolink:ChemicalEntity Tanshinone I cas:568-73-0 Graph Tanshinone Tanshinone http://purl.obolibrary.org/obo/CHEBI_149906 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:150013 biolink:ChemicalEntity emodin anthrone A member of the class of anthracenones that is anthracen-9(10H)-one which carries a methyl group at position 6 and hydroxy groups at positions 1, 3 and 8, respectively. It is an intermediate precursor in the synthesis of hypericin. cas:491-60-1|foodb.food:FDB015346|hmdb:HMDB0036457|knapsack:C00000569|metacyc.compound:RXN-14896|pubmed:1810248|pubmed:18647343|pubmed:29600721|pubmed:3019234|pubmed:32294787 Graph 1,3,8-trihydroxy-6-methylanthracen-9(10H)-one|1,3,8-trihydroxy-6-methylanthrone|emodin anthrone|emodin-9-anthrone|emodinanthrone 1,3,8-trihydroxy-6-methylanthracen-9(10H)-one 1,3,8-trihydroxy-6-methylanthracen-9(10H)-one|1,3,8-trihydroxy-6-methylanthrone|emodin anthrone|emodin-9-anthrone|emodinanthrone http://purl.obolibrary.org/obo/CHEBI_150013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:150018 biolink:ChemicalEntity 3-aminobutanoic acid zwitterion An amino acid zwitterion that is 3-aminobutanoic acid in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3. metacyc.compound:CPD-4748|pubmed:28316096 Graph 3-aminobutanoate|3-ammoniobutanoate|3-ammoniobutyrate|3-azaniumylbutanoate 3-azaniumylbutanoate 3-aminobutanoate|3-ammoniobutanoate|3-ammoniobutyrate|3-azaniumylbutanoate http://purl.obolibrary.org/obo/CHEBI_150018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15022 biolink:ChemicalEntity electron donor A molecular entity that can transfer an electron to another molecular entity. Graph Elektronendonator|donneur d'electron|electron donor electron donor Elektronendonator|donneur d'electron|electron donor http://purl.obolibrary.org/obo/CHEBI_15022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15031 biolink:ChemicalEntity dihydroriboflavins A flavin obtained by formal addition of dihydrogen to the benzopteridine ring system of riboflavin. Graph http://purl.obolibrary.org/obo/CHEBI_15031 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15033 biolink:ChemicalEntity thioredoxin cas:52500-60-4|kegg.compound:C00342 Graph Reduced thioredoxin|thioredoxins Reduced thioredoxin|thioredoxins http://purl.obolibrary.org/obo/CHEBI_15033 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15035 biolink:ChemicalEntity retinal An enal that consists of 3,7-dimethyl-9-nona-2,4,6,8-tetraenal (double bond geometry unspecified) carrying a 2,6,6-trimethylcyclohex-1-en-1-yl group at the 9-position. metacyc.compound:Retinals|reaxys:2055098 Graph 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|retinal 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|retinal http://purl.obolibrary.org/obo/CHEBI_15035 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15036 biolink:ChemicalEntity retinoate Graph 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate|retinoate 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate|retinoate http://purl.obolibrary.org/obo/CHEBI_15036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15040 biolink:ChemicalEntity retinyl palmitate A palmitate ester of retinol with undefined geometry about the C=C bonds. Graph 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate http://purl.obolibrary.org/obo/CHEBI_15040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15045 biolink:ChemicalEntity riboflavin cyclic 4',5'-phosphate A flavin mononucleotide that is riboflavin (vitamin B2) in which the 4' and 5' hydroxy groups have been converted into a cyclic hydrogen phosphate ester. hmdb:HMDB0059614|kegg.compound:C16071|metacyc.compound:CPD-12658|reaxys:65486 Graph 10-{(2S,3S)-2,3-dihydroxy-3-[(4R)-2-hydroxy-2-oxido-1,3,2-dioxaphospholan-4-yl]propyl}-7,8-dimethylbenzo[g]pteridine-2,4(3H,10H)-dione|cFMN|cyclic FMN|cyclic flavin mononucleotide 10-{(2S,3S)-2,3-dihydroxy-3-[(4R)-2-hydroxy-2-oxido-1,3,2-dioxaphospholan-4-yl]propyl}-7,8-dimethylbenzo[g]pteridine-2,4(3H,10H)-dione 10-{(2S,3S)-2,3-dihydroxy-3-[(4R)-2-hydroxy-2-oxido-1,3,2-dioxaphospholan-4-yl]propyl}-7,8-dimethylbenzo[g]pteridine-2,4(3H,10H)-dione|cFMN|cyclic FMN|cyclic flavin mononucleotide http://purl.obolibrary.org/obo/CHEBI_15045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1506 biolink:ChemicalEntity 3-fumarylpyruvic acid A 4,6-dioxohept-2-enedioic acid that is pyruvic acid substituted at position 3 by a fumaryl group. kegg.compound:C02514|reaxys:1725757 Graph (2E)-4,6-dioxohept-2-enedioic acid (2E)-4,6-dioxohept-2-enedioic acid (2E)-4,6-dioxohept-2-enedioic acid http://purl.obolibrary.org/obo/CHEBI_1506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15075 biolink:ChemicalEntity selenate A divalent inorganic anion obtained by removal of both protons from selenic acid. cas:14124-68-6|pdb-ccd:SE4 Graph SELENATE ION|Selenate|[SeO4](2-)|selenate|tetraoxidoselenate(2-) selenate|tetraoxidoselenate(2-) SELENATE ION|Selenate|[SeO4](2-)|selenate|tetraoxidoselenate(2-) http://purl.obolibrary.org/obo/CHEBI_15075 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:150865 biolink:ChemicalEntity 2,4,6-trihydroxyphenylhexan-1-one A 2-acylphloroglucinol in which the acyl group is specified as hexanoyl. It is the intermediate biosynthetic precursor for differentiation-inducing factor 1 (DIF-1). cas:5665-89-4|pubmed:10528134|pubmed:20231486|pubmed:27112454|pubmed:28285928|pubmed:6853502 Graph 1-(2,4,6-trihydroxyphenyl)-1-hexanone|1-(2,4,6-trihydroxyphenyl)hexan-1-one|2,4,6-trihydroxyphenylhexan-1-one|2-hexanoyl-1,3,5-benzenetriol|THPH|hexanoyl phloroglucinol|phlorocaprophenone 1-(2,4,6-trihydroxyphenyl)hexan-1-one 1-(2,4,6-trihydroxyphenyl)-1-hexanone|1-(2,4,6-trihydroxyphenyl)hexan-1-one|2,4,6-trihydroxyphenylhexan-1-one|2-hexanoyl-1,3,5-benzenetriol|THPH|hexanoyl phloroglucinol|phlorocaprophenone http://purl.obolibrary.org/obo/CHEBI_150865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:150869 biolink:ChemicalEntity GS-443902 An organic triphosphate that is GS-441524 in which the 5'-hydroxy group has been replaced by a triphosphate group. It is the active metabolite of remdesivir. cas:1355149-45-9|pmc:PMC7242921|pubmed:22446091|pubmed:26934220|pubmed:28124907|pubmed:32247927|pubmed:32358203|pubmed:32402130 Graph ((2R,3S,4R,5R)-5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate|GS-441524 triphosphate|RDV-TP|remdesivir triphosphate ((2R,3S,4R,5R)-5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate ((2R,3S,4R,5R)-5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate|GS-441524 triphosphate|RDV-TP|remdesivir triphosphate http://purl.obolibrary.org/obo/CHEBI_150869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:151 biolink:ChemicalEntity D-threo-isocitric acid The D-threo-diastereomer of isocitric acid. cas:6061-97-8|gmelin:1220309|hmdb:HMDB0001874|kegg.compound:C00451|knapsack:C00001188|metacyc.compound:THREO-DS-ISO-CITRATE|pdb-ccd:ICT|pubmed:17439666|reaxys:1727947 Graph (+)-threo-isocitric acid|(1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-L-threo-pentaric acid|D-threo-Isocitric acid|ISOCITRIC ACID (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-L-threo-pentaric acid (+)-threo-isocitric acid|(1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-L-threo-pentaric acid|D-threo-Isocitric acid|ISOCITRIC ACID http://purl.obolibrary.org/obo/CHEBI_151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15138 biolink:ChemicalEntity sulfide(2-) A divalent inorganic anion obtained by removal of both protons from hydrogen sulfide. cas:18496-25-8|umbbd.compound:c0569 Graph S(2-)|Sulfide|sulfanediide|sulfide(2-)|sulphide sulfanediide|sulfide(2-) S(2-)|Sulfide|sulfanediide|sulfide(2-)|sulphide http://purl.obolibrary.org/obo/CHEBI_15138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:151472 biolink:ChemicalEntity N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose An amino trisaccharide that comprises of a linear sequence of α-N-acetylneuraminyl, β-D-galactosyl and D-glucose residues linked (2→3) and (1→4). It is found in human milk. cas:35890-38-1|foodb.food:FDB021795|glygen:G56516VH|glytoucan:G56516VH|hmdb:HMDB0000825|kegg.glycan:G00436|pubmed:11117332|pubmed:15158661|pubmed:26613816|pubmed:35304182|pubmed:35802806|pubmed:36372185|pubmed:3652076|pubmed:36838693|pubmed:36986193|pubmed:37341636|reaxys:75357 Graph 3'-SL|3'-sialyllactose|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-D-gluco-hexopyranose|NeuAc(a2-3)Gal(b1-4)Glc|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-D-Glc|alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-Glc 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 3'-SL|3'-sialyllactose|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose|5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-D-gluco-hexopyranose|NeuAc(a2-3)Gal(b1-4)Glc|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-D-Glc|alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-Glc http://purl.obolibrary.org/obo/CHEBI_151472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15172 biolink:ChemicalEntity tRNA(Asx) Graph http://purl.obolibrary.org/obo/CHEBI_15172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15176 biolink:ChemicalEntity tRNA(Glx) Graph http://purl.obolibrary.org/obo/CHEBI_15176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15193 biolink:ChemicalEntity DL-tartrate(2-) A racemate comprising equimolar amounts of D- and L-tartrate(2−). beilstein:5740673 Graph rac-(2R,3R)-2,3-dihydroxybutanedioate rac-(2R,3R)-2,3-dihydroxybutanedioate rac-(2R,3R)-2,3-dihydroxybutanedioate http://purl.obolibrary.org/obo/CHEBI_15193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15208 biolink:ChemicalEntity taxuyunnanin C kegg.compound:C15537|knapsack:C00000901 Graph Taxuyunnanin C|taxa-4(20),11-diene-2alpha,5alpha,10beta,14beta-tetrayl tetraacetate|taxuyunnanin C taxa-4(20),11-diene-2alpha,5alpha,10beta,14beta-tetrayl tetraacetate Taxuyunnanin C|taxa-4(20),11-diene-2alpha,5alpha,10beta,14beta-tetrayl tetraacetate|taxuyunnanin C http://purl.obolibrary.org/obo/CHEBI_15208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15226 biolink:ChemicalEntity tetrathionate(2-) cas:15536-54-6|gmelin:3301|kegg.compound:C02084 Graph 2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catenate(2-)|Tetrathionat|Tetrathionate|[O3SSSSO3](2-)|[S4O6](2-)|bis[(trioxidosulfato)sulfate](S--S)(2-)|disulfanedisulfonate|tetrathionate|tetrathionate ion(2-) 2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catenate(2-)|bis[(trioxidosulfato)sulfate](S--S)(2-)|disulfanedisulfonate 2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catenate(2-)|Tetrathionat|Tetrathionate|[O3SSSSO3](2-)|[S4O6](2-)|bis[(trioxidosulfato)sulfate](S--S)(2-)|disulfanedisulfonate|tetrathionate|tetrathionate ion(2-) http://purl.obolibrary.org/obo/CHEBI_15226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15243 biolink:ChemicalEntity threonate A 2,3,4-trihydroxybutanoate that is the conjugate base of threonic acid. Graph http://purl.obolibrary.org/obo/CHEBI_15243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15245 biolink:ChemicalEntity thymidine 5'-monophosphate Graph http://purl.obolibrary.org/obo/CHEBI_15245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:152555 biolink:ChemicalEntity (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one(1-) A phenolate anion resulting from the removal of a proton from the phenolic hydroxy group of (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one that is para to the hexanoyl group. It is the major species at pH 7.3. pubmed:9446571 Graph (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one|2-chloro-4-hexanoyl-3,5-dihydroxyphenolate|Cl-THPH(1-)|chloro-THPH(1-) 2-chloro-4-hexanoyl-3,5-dihydroxyphenolate (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one|2-chloro-4-hexanoyl-3,5-dihydroxyphenolate|Cl-THPH(1-)|chloro-THPH(1-) http://purl.obolibrary.org/obo/CHEBI_152555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:152563 biolink:ChemicalEntity glycosylglucopyranuronic acid A disaccharide having glucopyranuronic acid at the reducing end with a glycosyl residue attached at an unspecified position via a glycosidic bond. Graph http://purl.obolibrary.org/obo/CHEBI_152563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15258 biolink:ChemicalEntity trichlorophenols Any chlorophenol derivative that contains three covalently bonded chlorine atoms. Graph http://purl.obolibrary.org/obo/CHEBI_15258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15266 biolink:ChemicalEntity triphosphate ion Graph Triphosphat|triphosphate ions Triphosphat|triphosphate ions http://purl.obolibrary.org/obo/CHEBI_15266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:153066 biolink:ChemicalEntity (S)-oxalatosuccinate(3-) An oxalatosuccinate(3−) in which the carboxy group at position 2 adopts an S-configuration. pubmed:18203822 Graph (2S)-1-oxopropane-1,2,3-tricarboxylate|(S)-oxalosuccinate (2S)-1-oxopropane-1,2,3-tricarboxylate (2S)-1-oxopropane-1,2,3-tricarboxylate|(S)-oxalosuccinate http://purl.obolibrary.org/obo/CHEBI_153066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:153067 biolink:ChemicalEntity 2-[(E)-caffeoyl]-D-threo-isocitrate(3-) Graph 2-[(E)-caffeoyl]-D-threo-isocitrate(3-) 2-[(E)-caffeoyl]-D-threo-isocitrate(3-) http://purl.obolibrary.org/obo/CHEBI_153067 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15318 biolink:ChemicalEntity xanthine A purine nucleobase found in humans and other organisms. ecmdb:ECMDB00292|knapsack:C00019660|pubmed:1557408|pubmed:24629268|pubmed:9007687|ymdb:YMDB00263 Graph 2,6-dioxopurine|2,6-dioxopurines|xanthine|xanthines 2,6-dioxopurine|2,6-dioxopurines|xanthine|xanthines http://purl.obolibrary.org/obo/CHEBI_15318 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15333 biolink:ChemicalEntity zeatin beilstein:1217241 Graph 2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol|zeatin 2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol 2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol|zeatin http://purl.obolibrary.org/obo/CHEBI_15333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15335 biolink:ChemicalEntity 5,7-dihydroxy-4'-methoxyflavone A monomethoxyflavone that is the 4'-methyl ether derivative of apigenin. cas:480-44-4|kegg.compound:C01470|knapsack:C00003820|lincs.smallmolecule:LSM-6662|lipidmaps:LMPK12110468|metacyc.compound:CPD-1095|pubmed:19693651|pubmed:21993665|pubmed:22360797|pubmed:23325489|reaxys:277879|wikipedia.en:Acacetin Graph 4'-Methoxy-5,7-dihydroxyflavone|5,7-Dihydroxy-2-(4-methoxyphenyl)-4-benzopyrone|5,7-Dihydroxy-4'-methoxyflavone|5,7-dihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one|5,7-dihydroxy-4'-methoxyflavone|Acacetin|Linarigenin 5,7-dihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one 4'-Methoxy-5,7-dihydroxyflavone|5,7-Dihydroxy-2-(4-methoxyphenyl)-4-benzopyrone|5,7-Dihydroxy-4'-methoxyflavone|5,7-dihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one|5,7-dihydroxy-4'-methoxyflavone|Acacetin|Linarigenin http://purl.obolibrary.org/obo/CHEBI_15335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15337 biolink:ChemicalEntity beta-alanopine beilstein:1773072|kegg.compound:C02207 Graph 2-[(2-carboxyethyl)amino]propanoic acid|N-(2-carboxyethyl)alanine|beta-Alanopine N-(2-carboxyethyl)alanine 2-[(2-carboxyethyl)amino]propanoic acid|N-(2-carboxyethyl)alanine|beta-Alanopine http://purl.obolibrary.org/obo/CHEBI_15337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15339 biolink:ChemicalEntity acceptor A molecular entity that can accept an electron, a pair of electrons, an atom or a group from another molecular entity. kegg.compound:C00028|kegg.compound:C16722 Graph A|Acceptor|Akzeptor|Hydrogen-acceptor|Oxidized donor|accepteur A|Acceptor|Akzeptor|Hydrogen-acceptor|Oxidized donor|accepteur http://purl.obolibrary.org/obo/CHEBI_15339 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15341 biolink:ChemicalEntity beta-D-glucosiduronic acid A glucosiduronic acid resulting from the formal condensation of any substance with β-D-glucuronic acid to form a glycosidic bond. kegg.compound:C03033 Graph Acceptor beta-D-glucuronoside|Glucuronide|beta-D-Glucuronide|beta-D-Glucuronoside|beta-D-glucosiduronic acids|beta-D-glucuronides|beta-D-glucuronosides Acceptor beta-D-glucuronoside|Glucuronide|beta-D-Glucuronide|beta-D-Glucuronoside|beta-D-glucosiduronic acids|beta-D-glucuronides|beta-D-glucuronosides http://purl.obolibrary.org/obo/CHEBI_15341 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15342 biolink:ChemicalEntity acenaphthoquinone An orthoquinone that is the 1,2-dioxo derivative of acenaphthene. cas:82-86-0|gmelin:143091|kegg.compound:C02807|pdb-ccd:ANQ|pdb:1OAX|pubmed:14500876|pubmed:1650428|pubmed:17082565|pubmed:17925309|pubmed:21941409|pubmed:22010712|pubmed:22779655|reaxys:879172|wikipedia.en:Acenaphthoquinone Graph 1,2-Diketoacenaphthene|1,2-acenaphthenedione|1,2-acenaphthenequinone|1,2-acenaphthylenedione|ACENAPHTHENEQUINONE|AcQ|Acenaphthenequinone|Acenaphthoquinone|Aq|acenaphthene quinone|acenaphthene-1,2-dione|acenaphthodione|acenaphthylene-1,2-dione|acenaphthylene-1,2-quinone|acenaphthylenedione|diketoacenaphthene acenaphthene-1,2-dione|acenaphthylene-1,2-dione 1,2-Diketoacenaphthene|1,2-acenaphthenedione|1,2-acenaphthenequinone|1,2-acenaphthylenedione|ACENAPHTHENEQUINONE|AcQ|Acenaphthenequinone|Acenaphthoquinone|Aq|acenaphthene quinone|acenaphthene-1,2-dione|acenaphthodione|acenaphthylene-1,2-dione|acenaphthylene-1,2-quinone|acenaphthylenedione|diketoacenaphthene http://purl.obolibrary.org/obo/CHEBI_15342 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15343 biolink:ChemicalEntity acetaldehyde The aldehyde formed from acetic acid by reduction of the carboxy group. It is the most abundant carcinogen in tobacco smoke. cas:75-07-0|gmelin:779|hmdb:HMDB0000990|kegg.compound:C00084|knapsack:C00007392|lincs.smallmolecule:LSM-37193|pdb-ccd:ACE|pubmed:11058591|pubmed:110589|pubmed:11087437|pubmed:11290854|pubmed:15239123|pubmed:15833031|pubmed:16404561|pubmed:16485909|pubmed:18001279|pubmed:19396661|pubmed:2233695|pubmed:24282063|pubmed:24326678|pubmed:24503565|pubmed:4239189|pubmed:5526694|pubmed:6036728|pubmed:7163973|pubmed:9171333|reaxys:505984|umbbd.compound:c0160|wikipedia.en:Acetaldehyde Graph ACETALDEHYDE|Acetaldehyd|Acetaldehyde|Azetaldehyd|Ethanal|acetaldehyde|acetaldehydes|acetic aldehyde|ethyl aldehyde ACETALDEHYDE|Acetaldehyde|acetaldehyde ACETALDEHYDE|Acetaldehyd|Acetaldehyde|Azetaldehyd|Ethanal|acetaldehyde|acetaldehydes|acetic aldehyde|ethyl aldehyde http://purl.obolibrary.org/obo/CHEBI_15343 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15344 biolink:ChemicalEntity acetoacetic acid A 3-oxo monocarboxylic acid that is butyric acid bearing a 3-oxo substituent. cas:541-50-4|drugbank:DB01762|hmdb:HMDB0000060|kegg.compound:C00164|knapsack:C00007458|lipidmaps:LMFA01060003|metacyc.compound:3-KETOBUTYRATE|pubmed:17190852|pubmed:20444635|pubmed:21806064|pubmed:22382897|pubmed:3884391|reaxys:1747690|umbbd.compound:c0069|wikipedia.en:Acetoacetic_acid Graph 3-Ketobutyric acid|3-Oxobutanoic acid|3-Oxobutyric acid|3-ketobutanoic acid|3-oxobutanoic acid|Acetoacetic acid|beta-Ketobutyric acid 3-Oxobutanoic acid|3-oxobutanoic acid 3-Ketobutyric acid|3-Oxobutanoic acid|3-Oxobutyric acid|3-ketobutanoic acid|3-oxobutanoic acid|Acetoacetic acid|beta-Ketobutyric acid http://purl.obolibrary.org/obo/CHEBI_15344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15345 biolink:ChemicalEntity acetoacetyl-CoA A 3-oxoacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of acetoacetic acid. cas:1420-36-6|drugbank:DB03059|foodb.food:FDB022648|hmdb:HMDB0001484|kegg.compound:C00332|knapsack:C00007269|lipidmaps:LMFA07050030|pdb-ccd:CAA|pubmed:10806397|pubmed:11137815|pubmed:11451959|pubmed:12501183|pubmed:1682408|pubmed:16887802|pubmed:239468|pubmed:24211201|pubmed:26527136|pubmed:27093562|pubmed:27124816|pubmed:28062645|pubmed:29226071|pubmed:32218776|pubmed:6118268|pubmed:6150478|pubmed:7857927|reaxys:78273|umbbd.compound:c0229|wikipedia.en:Acetoacetyl-CoA Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxobutanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Acetoacetyl-CoA|Acetoacetyl coenzyme A|Acetoacetyl-CoA|S-Acetoacetyl-coenzym A|S-acetoacetyl-CoA|S-acetoacetyl-coenzyme A|acetoacetyl CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxobutanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxobutanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Acetoacetyl-CoA|Acetoacetyl coenzyme A|Acetoacetyl-CoA|S-Acetoacetyl-coenzym A|S-acetoacetyl-CoA|S-acetoacetyl-coenzyme A|acetoacetyl CoA http://purl.obolibrary.org/obo/CHEBI_15345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15346 biolink:ChemicalEntity coenzyme A A thiol comprising a panthothenate unit in phosphoric anhydride linkage with a 3',5'-adenosine diphosphate unit; and an aminoethanethiol unit. beilstein:77809|cas:85-61-0|drugbank:DB01992|kegg.compound:C00010|knapsack:C00007258|pdb-ccd:COA|pdb-ccd:COZ|pubmed:11923312|pubmed:13025483|pubmed:15014152|pubmed:15893380|pubmed:18407920|pubmed:19666462|pubmed:20351285|pubmed:2981478|pubmed:7310833|wikipedia.en:Coenzyme_A Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|3'-phosphoadenosine-(5')diphospho(4')pantatheine|COENZYME A|CoA|CoA-SH|CoASH|Coenzym A|Coenzyme A|HSCoA|Koenzym A|[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|3'-phosphoadenosine-(5')diphospho(4')pantatheine|COENZYME A|CoA|CoA-SH|CoASH|Coenzym A|Coenzyme A|HSCoA|Koenzym A|[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-3-hydroxy-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_15346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15347 biolink:ChemicalEntity acetone A methyl ketone that consists of propane bearing an oxo group at C2. cas:67-64-1|gmelin:1466|hmdb:HMDB0001659|kegg.compound:C00207|kegg.drug:D02311|lipidmaps:LMFA12000057|metacyc.compound:ACETONE|pdb-ccd:ACN|pubmed:17190852|pubmed:17347819|reaxys:635680|umbbd.compound:c0556|wikipedia.en:Acetone Graph 2-Propanone|ACETONE|Aceton|Acetone|Azeton|Dimethyl ketone|Dimethylketon|Propanon|Pyroacetic ether|acetone|beta-Ketopropane|dimethylcetone|dimethylketone|methyl ketone|propan-2-one|propanone propan-2-one 2-Propanone|ACETONE|Aceton|Acetone|Azeton|Dimethyl ketone|Dimethylketon|Propanon|Pyroacetic ether|acetone|beta-Ketopropane|dimethylcetone|dimethylketone|methyl ketone|propan-2-one|propanone http://purl.obolibrary.org/obo/CHEBI_15347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15348 biolink:ChemicalEntity 2-hydroxy-2-methylpropanenitrile cas:75-86-5|drugbank:DB02203|kegg.compound:C02659 Graph 2-Hydroxy-2-methylpropanenitrile|2-Hydroxyisobutyronitrile|2-Methyllactonitrile|2-hydroxy-2-methylpropanenitrile|Acetone cyanhydrin|Acetone cyanohydrin|acetone-cyanohydrin|alpha-Hydroxyisobutyronitrile 2-Hydroxy-2-methylpropanenitrile|2-hydroxy-2-methylpropanenitrile 2-Hydroxy-2-methylpropanenitrile|2-Hydroxyisobutyronitrile|2-Methyllactonitrile|2-hydroxy-2-methylpropanenitrile|Acetone cyanhydrin|Acetone cyanohydrin|acetone-cyanohydrin|alpha-Hydroxyisobutyronitrile http://purl.obolibrary.org/obo/CHEBI_15348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15349 biolink:ChemicalEntity acetone oxime cas:127-06-0|kegg.compound:C01995 Graph Acetone oxime|Acetoxime|acetone oxime|propan-2-one oxime propan-2-one oxime Acetone oxime|Acetoxime|acetone oxime|propan-2-one oxime http://purl.obolibrary.org/obo/CHEBI_15349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15350 biolink:ChemicalEntity acetyl dihydrogen phosphate An acyl monophosphate in which the acyl group specified is acetyl. cas:590-54-5|drugbank:DB02897|hmdb:HMDB0001494|kegg.compound:C00227|knapsack:C00019559|pdb-ccd:UVW|pubmed:18430561|pubmed:18863815|pubmed:19026742|reaxys:1764251 Graph (acetyloxy)phosphonic acid|ACETYLPHOSPHATE|Acetyl phosphate|acetic acid, monoanhydride with phosphoric acid|acetic phosphoric monoanhydride|acetyl dihydrogen phosphate|acetylphosphoric acid|monoacetyl phosphate (acetyloxy)phosphonic acid|Acetyl phosphate|acetic phosphoric monoanhydride (acetyloxy)phosphonic acid|ACETYLPHOSPHATE|Acetyl phosphate|acetic acid, monoanhydride with phosphoric acid|acetic phosphoric monoanhydride|acetyl dihydrogen phosphate|acetylphosphoric acid|monoacetyl phosphate http://purl.obolibrary.org/obo/CHEBI_15350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15351 biolink:ChemicalEntity acetyl-CoA An acyl-CoA having acetyl as its S-acetyl component. cas:72-89-9|ecmdb:ECMDB01206|hmdb:HMDB0001206|kegg.compound:C00024|knapsack:C00007259|pdb-ccd:ACO|pubmed:12527305|pubmed:12739170|pubmed:15247244|pubmed:16101314|pubmed:16667687|pubmed:16708165|pubmed:17189273|pubmed:17242360|pubmed:17631502|pubmed:18613815|pubmed:19356710|pubmed:19596230|pubmed:19914586|pubmed:3950616|reaxys:78145|umbbd.compound:c0031|wikipedia.en:Acetyl-CoA|ymdb:YMDB00312 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(acetylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|AcCoA|Acetyl coenzyme A|Acetyl-CoA|S-acetyl-CoA|S-acetyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(acetylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(acetylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|AcCoA|Acetyl coenzyme A|Acetyl-CoA|S-acetyl-CoA|S-acetyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15353 biolink:ChemicalEntity blasticidin S A blasticidin that is an antibiotic obtained from Streptomyces griseochromogene. cas:2079-00-7|hmdb:HMDB0030452|kegg.compound:C02010|knapsack:C00016063|knapsack:C00027948|metacyc.compound:blasticidin-s|pdb-ccd:BLS|pesticides:blasticidin-s|pubmed:12964155|pubmed:13525246|pubmed:16659097|pubmed:23377931|pubmed:23824292|pubmed:23879927|pubmed:23880034|pubmed:24782309|pubmed:3824882|pubmed:5842139|reaxys:68255|wikipedia.en:Blasticidin_S Graph 4-amino-1-(4-{[(3S)-3-amino-5-(N-methylcarbamimidamido)pentanoyl]amino}-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl)pyrimidin-2(1H)-one|Blasticidin S|Blasticidin-S 4-amino-1-(4-{[(3S)-3-amino-5-(N-methylcarbamimidamido)pentanoyl]amino}-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl)pyrimidin-2(1H)-one 4-amino-1-(4-{[(3S)-3-amino-5-(N-methylcarbamimidamido)pentanoyl]amino}-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl)pyrimidin-2(1H)-one|Blasticidin S|Blasticidin-S http://purl.obolibrary.org/obo/CHEBI_15353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15354 biolink:ChemicalEntity choline A choline that is the parent compound of the cholines class, consisting of ethanolamine having three methyl substituents attached to the amino function. cas:62-49-7|drugbank:DB00122|drugcentral:3097|ecmdb:ECMDB00097|gmelin:324597|hmdb:HMDB0000097|kegg.compound:C00114|kegg.drug:D07690|knapsack:C00007298|metacyc.compound:CHOLINE|pdb-ccd:CHT|pubmed:10930630|pubmed:12826235|pubmed:12946691|pubmed:14972364|pubmed:16210714|pubmed:17087106|pubmed:17283071|pubmed:17344490|pubmed:18204095|pubmed:18230680|pubmed:18786517|pubmed:18786520|pubmed:19246089|pubmed:20038853|pubmed:20446114|pubmed:22770225|pubmed:22961562|pubmed:23095202|pubmed:23616508|pubmed:23637565|pubmed:23733158|pubmed:6420466|pubmed:7590654|pubmed:9517478|reaxys:1736748|wikipedia.en:Choline|ymdb:YMDB00227 Graph 2-hydroxy-N,N,N-trimethylethanaminium|Bilineurine|CHOLINE ION|Choline|N,N,N-trimethylethanol-ammonium|N-trimethylethanolamine|choline|trimethylethanolamine 2-hydroxy-N,N,N-trimethylethanaminium 2-hydroxy-N,N,N-trimethylethanaminium|Bilineurine|CHOLINE ION|Choline|N,N,N-trimethylethanol-ammonium|N-trimethylethanolamine|choline|trimethylethanolamine http://purl.obolibrary.org/obo/CHEBI_15354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15355 biolink:ChemicalEntity acetylcholine Actylcholine is an ester of acetic acid and choline, which acts as a neurotransmitter. beilstein:1764436|cas:51-84-3|drugbank:DB03128|drugcentral:65|gmelin:326108|kegg.compound:C01996|lincs.smallmolecule:LSM-5888|pdb-ccd:ACH|pubmed:14764638|pubmed:15014918|pubmed:15231705|pubmed:15361288|pubmed:18050502|pubmed:18407448|pubmed:19255787|pubmed:20963497|pubmed:21130809|pubmed:21246223|pubmed:21545631|pubmed:21601579|wikipedia.en:Acetylcholine Graph 2-acetyloxy-N,N,N-trimethylethanaminium|ACETYLCHOLINE|ACh|Acetylcholine|Azetylcholin|O-Acetylcholine|acetylcholine|choline acetate 2-acetyloxy-N,N,N-trimethylethanaminium 2-acetyloxy-N,N,N-trimethylethanaminium|ACETYLCHOLINE|ACh|Acetylcholine|Azetylcholin|O-Acetylcholine|acetylcholine|choline acetate http://purl.obolibrary.org/obo/CHEBI_15355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15356 biolink:ChemicalEntity cysteine A sulfur-containing amino acid that is propanoic acid with an amino group at position 2 and a sulfanyl group at position 3. cas:3374-22-9|gmelin:2933|kegg.compound:C00736|knapsack:C00001351|knapsack:C00007323|pubmed:17439666|pubmed:25181601|reaxys:1721406|wikipedia.en:Cysteine Graph 2-Amino-3-mercaptopropionic acid|2-amino-3-mercaptopropanoic acid|2-amino-3-sulfanylpropanoic acid|C|Cys|Cystein|Cysteine|Hcys|Zystein|cisteina|cysteine Cysteine|cysteine 2-Amino-3-mercaptopropionic acid|2-amino-3-mercaptopropanoic acid|2-amino-3-sulfanylpropanoic acid|C|Cys|Cystein|Cysteine|Hcys|Zystein|cisteina|cysteine http://purl.obolibrary.org/obo/CHEBI_15356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:153569 biolink:ChemicalEntity (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one An aromatic ketone that is phloroglucinol in which two of the hydrogens attached to the benzene ring have been replaced by a chloro and hexanoyl groups. It is an intermediate biosynthetic precursor for differentiation-inducing factor 1 (DIF-1) which is a major inducer of stalk cell differentiation. pubmed:16545913|pubmed:17259634|pubmed:18402932|pubmed:20231486|pubmed:9446571 Graph 1-(2,4,6-trihydroxy-3-chlorophenyl)-1-hexanone|1-(3-chloro-2,4,6-trihydroxyphenyl)-1-hexanone|1-(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one|Cl-THPH|chloro-THPH 1-(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one 1-(2,4,6-trihydroxy-3-chlorophenyl)-1-hexanone|1-(3-chloro-2,4,6-trihydroxyphenyl)-1-hexanone|1-(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one|Cl-THPH|chloro-THPH http://purl.obolibrary.org/obo/CHEBI_153569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15357 biolink:ChemicalEntity acetylenedicarboxylate(2-) A dicarboxylic acid dianion obtained by the deprotonation of both the carboxy groups of acetylenedicarboxylic acid. gmelin:325291|kegg.compound:C03248|reaxys:3662972 Graph 2-butynedioate|acetylenedicarboxylate|but-2-ynedioate but-2-ynedioate 2-butynedioate|acetylenedicarboxylate|but-2-ynedioate http://purl.obolibrary.org/obo/CHEBI_15357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15358 biolink:ChemicalEntity histone cas:37244-51-2|kegg.compound:C01429 Graph Histone Histone http://purl.obolibrary.org/obo/CHEBI_15358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15360 biolink:ChemicalEntity acetylpyruvate cas:5699-58-1|kegg.compound:C02132|umbbd.compound:c0158 Graph 2,4-dioxopentanoate|acetylpyruvate 2,4-dioxopentanoate 2,4-dioxopentanoate|acetylpyruvate http://purl.obolibrary.org/obo/CHEBI_15360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15361 biolink:ChemicalEntity pyruvate A 2-oxo monocarboxylic acid anion that is the conjugate base of pyruvic acid, arising from deprotonation of the carboxy group. cas:57-60-3|gmelin:2502|kegg.compound:C00022|pubmed:17190852|pubmed:21603897|pubmed:21823181|pubmed:21854850|pubmed:22006570|pubmed:22016370|pubmed:22215378|pubmed:22311625|pubmed:22451307|pubmed:22458763|reaxys:3587721|umbbd.compound:c0159 Graph 2-oxopropanoate|2-oxopropanoic acid, ion(1-)|pyruvate 2-oxopropanoate 2-oxopropanoate|2-oxopropanoic acid, ion(1-)|pyruvate http://purl.obolibrary.org/obo/CHEBI_15361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15362 biolink:ChemicalEntity hydroxyacetone phosphate kegg.compound:C03505 Graph 2-oxopropyl dihydrogen phosphate|Acetol phosphate|Hydroxyacetone phosphate 2-oxopropyl dihydrogen phosphate 2-oxopropyl dihydrogen phosphate|Acetol phosphate|Hydroxyacetone phosphate http://purl.obolibrary.org/obo/CHEBI_15362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15363 biolink:ChemicalEntity N-acetylindoxyl A hydroxyindole that is indoxyl in which the hydrogen attached to the nitrogen is replaced by an acetyl group. cas:33025-60-4|chemspider:388767|kegg.compound:C02298|metacyc.compound:N-ACETYLINDOXYL|pubmed:13159343|pubmed:3941406 Graph 1-(3-hydroxy-1H-indol-1-yl)ethan-1-one|1-acetyl-1H-indol-3-ol|Acetylindoxyl|N-Acetylindoxyl|N-acetylindoxyl 1-(3-hydroxy-1H-indol-1-yl)ethan-1-one 1-(3-hydroxy-1H-indol-1-yl)ethan-1-one|1-acetyl-1H-indol-3-ol|Acetylindoxyl|N-Acetylindoxyl|N-acetylindoxyl http://purl.obolibrary.org/obo/CHEBI_15363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15364 biolink:ChemicalEntity propynoate An acetylenic fatty acid anion and the conjugate base of propynoic acid, arising from deprotonation of the carboxylic acid group. gmelin:323514|kegg.compound:C00804|reaxys:3903650 Graph Acetylenemonocarboxylate|Propiolat|acetylenecarboxylate|prop-2-ynoate|propiolate|propynoate prop-2-ynoate Acetylenemonocarboxylate|Propiolat|acetylenecarboxylate|prop-2-ynoate|propiolate|propynoate http://purl.obolibrary.org/obo/CHEBI_15364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15365 biolink:ChemicalEntity acetylsalicylic acid A member of the class of benzoic acids that is salicylic acid in which the hydrogen that is attached to the phenolic hydroxy group has been replaced by an acetoxy group. A non-steroidal anti-inflammatory drug with cyclooxygenase inhibitor activity. cas:50-78-2|drugbank:DB00945|drugcentral:74|gmelin:218864|hmdb:HMDB0001879|kegg.compound:C01405|kegg.drug:D00109|lincs.smallmolecule:LSM-5288|metacyc.compound:CPD-524|pdb-ccd:AIN|pubmed:11203441|pubmed:11402787|pubmed:11597554|pubmed:11733186|pubmed:12852484|pubmed:14753751|pubmed:15542410|pubmed:15590729|pubmed:1650428|pubmed:18226435|pubmed:18335236|pubmed:18631321|pubmed:19010312|pubmed:19386367|pubmed:19706045|pubmed:21699808|pubmed:22866967|pubmed:445303|reaxys:779271|wikipedia.en:Aspirin Graph 2-(ACETYLOXY)BENZOIC ACID|2-(acetyloxy)benzoic acid|2-Acetoxybenzenecarboxylic acid|2-acetoxybenzoic acid|ASA|Acetylsalicylate|Acetylsalicylic acid|Acetylsalicylsaeure|Aspirin|Azetylsalizylsaeure|Easprin|O-acetylsalicylic acid|acide 2-(acetyloxy)benzoique|acide acetylsalicylique|acido acetilsalicilico|acidum acetylsalicylicum|o-acetoxybenzoic acid|o-carboxyphenyl acetate|salicylic acid acetate 2-(ACETYLOXY)BENZOIC ACID|2-(acetyloxy)benzoic acid 2-(ACETYLOXY)BENZOIC ACID|2-(acetyloxy)benzoic acid|2-Acetoxybenzenecarboxylic acid|2-acetoxybenzoic acid|ASA|Acetylsalicylate|Acetylsalicylic acid|Acetylsalicylsaeure|Aspirin|Azetylsalizylsaeure|Easprin|O-acetylsalicylic acid|acide 2-(acetyloxy)benzoique|acide acetylsalicylique|acido acetilsalicilico|acidum acetylsalicylicum|o-acetoxybenzoic acid|o-carboxyphenyl acetate|salicylic acid acetate http://purl.obolibrary.org/obo/CHEBI_15365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15366 biolink:ChemicalEntity acetic acid A simple monocarboxylic acid containing two carbons. cas:64-19-7|drugcentral:4211|gmelin:1380|hmdb:HMDB0000042|kegg.compound:C00033|kegg.drug:D00010|knapsack:C00001176|lipidmaps:LMFA01010002|metacyc.compound:ACET|pdb-ccd:ACT|pdb-ccd:ACY|ppdb:1333|pubmed:12005138|pubmed:15107950|pubmed:16630552|pubmed:16774200|pubmed:17190852|pubmed:19416101|pubmed:19469536|pubmed:22153255|pubmed:22173419|reaxys:506007|wikipedia.en:Acetic_acid Graph ACETIC ACID|AcOH|Acetic acid|CH3-COOH|CH3CO2H|E 260|E-260|E260|Essigsaeure|Ethanoic acid|Ethylic acid|HOAc|INS No. 260|MeCO2H|MeCOOH|Methanecarboxylic acid|acetic acid|acide acetique|ethoic acid ACETIC ACID|Acetic acid|acetic acid ACETIC ACID|AcOH|Acetic acid|CH3-COOH|CH3CO2H|E 260|E-260|E260|Essigsaeure|Ethanoic acid|Ethylic acid|HOAc|INS No. 260|MeCO2H|MeCOOH|Methanecarboxylic acid|acetic acid|acide acetique|ethoic acid http://purl.obolibrary.org/obo/CHEBI_15366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15367 biolink:ChemicalEntity all-trans-retinoic acid A retinoic acid in which all four exocyclic double bonds have E- (trans-) geometry. cas:302-79-4|drugbank:DB00755|drugcentral:2722|foodb.food:FDB022710|hmdb:HMDB0001852|kegg.compound:C00777|kegg.drug:D00094|lipidmaps:LMPR01090019|pdb-ccd:REA|pubmed:10022884|pubmed:10970886|pubmed:11073974|pubmed:11214352|pubmed:11332619|pubmed:11343416|pubmed:11437362|pubmed:11556813|pubmed:11722649|pubmed:11896294|pubmed:11904404|pubmed:12958591|pubmed:14581379|pubmed:14605492|pubmed:14627725|pubmed:14704332|pubmed:14705145|pubmed:14978018|pubmed:15194426|pubmed:15318809|pubmed:15327395|pubmed:15359008|pubmed:15376324|pubmed:15476854|pubmed:15537748|pubmed:15539337|pubmed:15675886|pubmed:15839997|pubmed:16569247|pubmed:16685080|pubmed:16688769|pubmed:16720557|pubmed:16819260|pubmed:16847436|pubmed:16920920|pubmed:17073551|pubmed:17166212|pubmed:17204142|pubmed:17447762|pubmed:18052213|pubmed:18085670|pubmed:18162363|pubmed:18183617|pubmed:18318655|pubmed:18322276|pubmed:18400206|pubmed:18404486|pubmed:18440196|pubmed:18678272|pubmed:18800767|pubmed:18819820|pubmed:18977311|pubmed:19018099|pubmed:19112091|pubmed:19144697|pubmed:19427305|pubmed:19587328|pubmed:19597529|pubmed:19814868|pubmed:19841174|pubmed:21898109|pubmed:21924320|pubmed:21993673|pubmed:22134377|pubmed:22177959|pubmed:22180426|pubmed:22244299|pubmed:22261335|pubmed:22428994|pubmed:22514600|pubmed:22532966|pubmed:22534100|pubmed:22538278|pubmed:22741806|pubmed:27759097|pubmed:29492455|pubmed:33662750|pubmed:33820492|pubmed:34050114|pubmed:34050360|pubmed:34091189|pubmed:7501014|pubmed:7704533|pubmed:7961949|reaxys:2057223|wikipedia.en:Retinoic_acid|wikipedia.en:Tretinoin Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(all-E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-all-trans-tetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2E,4E,6E,8E-tetraenoic acid|AGN 100335|Acide retinoique (French)|Altreno|Atralin|Avita|Betarretin|Biacna|Cordes vas|Dermairol|Refissa|Renova|Retin-A|Retisol-A|Ro 1-5488|Stieva-A|Tretin M|Tri-luma|Veltin|Vesanoid|all-(E)-retinoic acid|all-trans retinoic acid|all-trans-beta-Retinoic acid|all-trans-retinoic acid|all-trans-tretinoin|all-trans-vitamin A acid|all-trans-vitamin A1 acid|beta-Retinoic acid|retinoic acid|trans-retinoic acid|tretinoin|tretinoina|tretinoine|tretinoinum|vitamin A acid (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(all-E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-all-trans-tetraenoic acid|3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2E,4E,6E,8E-tetraenoic acid|AGN 100335|Acide retinoique (French)|Altreno|Atralin|Avita|Betarretin|Biacna|Cordes vas|Dermairol|Refissa|Renova|Retin-A|Retisol-A|Ro 1-5488|Stieva-A|Tretin M|Tri-luma|Veltin|Vesanoid|all-(E)-retinoic acid|all-trans retinoic acid|all-trans-beta-Retinoic acid|all-trans-retinoic acid|all-trans-tretinoin|all-trans-vitamin A acid|all-trans-vitamin A1 acid|beta-Retinoic acid|retinoic acid|trans-retinoic acid|tretinoin|tretinoina|tretinoine|tretinoinum|vitamin A acid http://purl.obolibrary.org/obo/CHEBI_15367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15368 biolink:ChemicalEntity acrolein An enal that is prop-2-ene with an oxo group at position 1. cas:107-02-8|hmdb:HMDB0041822|kegg.compound:C01471|metacyc.compound:ACROLEIN|ppdb:1016|pubmed:11888018|pubmed:16725382|pubmed:18023956|pubmed:18234483|pubmed:18686065|pubmed:18823586|reaxys:741856|wikipedia.en:Acrolein Graph Acrolein|Acrylaldehyde|Acrylic aldehyde|Propenal|acrolein|acrylaldehyde Acrylaldehyde|acrylaldehyde Acrolein|Acrylaldehyde|Acrylic aldehyde|Propenal|acrolein|acrylaldehyde http://purl.obolibrary.org/obo/CHEBI_15368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15369 biolink:ChemicalEntity actinomycin A large group of antibiotics isolated from various species of Streptomyces and characterised by having a substituted phenoxazine ring linked to two cyclic heterodetic peptides. cas:1402-38-6|kegg.compound:C01775 Graph Actinomycin|actinomycins Actinomycin|actinomycins http://purl.obolibrary.org/obo/CHEBI_15369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15371 biolink:ChemicalEntity 3-oxopristanoyl-CoA A multi-methyl-branched fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-oxopristanic acid. kegg.compound:C07297 Graph 2,6,10,14-3-oxotetramethylpentadecanoyl-CoA|2,6,10,14-3-oxotetramethylpentadecanoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2,6,10,14-tetramethyl-3-oxopentadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxopristanoyl-CoA|3-ketopristanoyl-CoA|3-ketopristanoyl-coenzyme A|3-oxopristanoyl-CoA|3-oxopristanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2,6,10,14-tetramethyl-3-oxopentadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 2,6,10,14-3-oxotetramethylpentadecanoyl-CoA|2,6,10,14-3-oxotetramethylpentadecanoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2,6,10,14-tetramethyl-3-oxopentadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxopristanoyl-CoA|3-ketopristanoyl-CoA|3-ketopristanoyl-coenzyme A|3-oxopristanoyl-CoA|3-oxopristanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15372 biolink:ChemicalEntity 5,6,7,8-tetrahydrobiopterin beilstein:544742|cas:17528-72-2|drugbank:DB00360|kegg.compound:C00272|pdb-ccd:H4B Graph 2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydoro-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one|5,6,7,8-TETRAHYDROBIOPTERIN|5,6,7,8-Tetrahydrobiopterin|5,6,7,8-tetrahydrobiopterin|BH4|Tetrahydrobiopterin 2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one 2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydoro-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one|5,6,7,8-TETRAHYDROBIOPTERIN|5,6,7,8-Tetrahydrobiopterin|5,6,7,8-tetrahydrobiopterin|BH4|Tetrahydrobiopterin http://purl.obolibrary.org/obo/CHEBI_15372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15373 biolink:ChemicalEntity biopterin A pterin derivative that consists of pterin bearing amino, oxo and 1,2-dihydroxypropyl substituents at positions 2, 4 and 6 respectively. The parent of the class of biopterins; the L-erythro isomer occurs widely in nature. cas:22150-76-1|drugbank:DB03886|kegg.compound:C06313|pubmed:22770225|reaxys:234314|wikipedia.en:Biopterin Graph 2-Amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)pteridin-4(3H)-one|Biopterin 2-amino-6-(1,2-dihydroxypropyl)pteridin-4(3H)-one 2-Amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone|2-amino-6-(1,2-dihydroxypropyl)pteridin-4(3H)-one|Biopterin http://purl.obolibrary.org/obo/CHEBI_15373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15374 biolink:ChemicalEntity 4a-hydroxytetrahydrobiopterin A tetrahydropterin that is 5,6,7,8-tetrahydrobiopterin carrying an additional hydroxy substituent at the 4a-position. cas:70110-58-6|metacyc.compound:CPD-5881|pubmed:18644344|pubmed:18937498|pubmed:1988938|pubmed:36915513|pubmed:8304232 Graph 2-amino-6-(1,2-dihydroxypropyl)-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one|4a-Hydroxy-5,6,4,8-tetrahydrobiopterin 2-amino-6-(1,2-dihydroxypropyl)-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one 2-amino-6-(1,2-dihydroxypropyl)-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one|4a-Hydroxy-5,6,4,8-tetrahydrobiopterin http://purl.obolibrary.org/obo/CHEBI_15374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15375 biolink:ChemicalEntity D-erythro-7,8-dihydrobiopterin A 7,8-dihydrobiopterin in which the 1,2-dihydroxypropyl group has (1S,2R)-configuration. drugbank:DB04400 Graph 2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-7,8-dihydropteridin-4(1H)-one|7,8-Dihydrobiopterin|D-erythro-7,8-dihydrobiopterin 2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-7,8-dihydropteridin-4(1H)-one 2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-7,8-dihydropteridin-4(1H)-one|7,8-Dihydrobiopterin|D-erythro-7,8-dihydrobiopterin http://purl.obolibrary.org/obo/CHEBI_15375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15377 biolink:ChemicalEntity water An oxygen hydride consisting of an oxygen atom that is covalently bonded to two hydrogen atoms cas:7732-18-5|gmelin:117|hmdb:HMDB0002111|kegg.compound:C00001|kegg.drug:D00001|metacyc.compound:WATER|molbase:1|pdb-ccd:HOH|reaxys:3587155|wikipedia.en:Water Graph BOUND WATER|H(2)O|H2O|HOH|WATER|Wasser|Water|[OH2]|acqua|agua|aqua|dihydridooxygen|dihydrogen oxide|eau|hydrogen hydroxide|oxidane|water WATER|Water|oxidane|water BOUND WATER|H(2)O|H2O|HOH|WATER|Wasser|Water|[OH2]|acqua|agua|aqua|dihydridooxygen|dihydrogen oxide|eau|hydrogen hydroxide|oxidane|water http://purl.obolibrary.org/obo/CHEBI_15377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15378 biolink:ChemicalEntity hydron The general name for the hydrogen nucleus, to be used without regard to the hydrogen nuclear mass (either for hydrogen in its natural abundance or where it is not desired to distinguish between the isotopes). kegg.compound:C00080 Graph H(+)|H+|Hydron|hydrogen(1+)|hydron hydrogen(1+)|hydron H(+)|H+|Hydron|hydrogen(1+)|hydron http://purl.obolibrary.org/obo/CHEBI_15378 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15379 biolink:ChemicalEntity dioxygen cas:7782-44-7|gmelin:485|hmdb:HMDB0001377|kegg.compound:C00007|kegg.drug:D00003|metacyc.compound:OXYGEN-MOLECULE|molbase:750|pdb-ccd:OXY|pubmed:10906528|pubmed:16977326|pubmed:18210929|pubmed:18638417|pubmed:19840863|pubmed:7710549|pubmed:9463773|wikipedia.en:Oxygen Graph Disauerstoff|E 948|E-948|E948|O(2)|O2|OXYGEN MOLECULE|Oxygen|[OO]|dioxygen|dioxygene|molecular oxygen Oxygen|dioxygen Disauerstoff|E 948|E-948|E948|O(2)|O2|OXYGEN MOLECULE|Oxygen|[OO]|dioxygen|dioxygene|molecular oxygen http://purl.obolibrary.org/obo/CHEBI_15379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15380 biolink:ChemicalEntity succinyl-CoA An ω-carboxyacyl-CoA having succinoyl as the S-acyl component. cas:604-98-8|drugbank:DB03699|kegg.compound:C00091|knapsack:C00019546|pdb-ccd:SCA|pubmed:15627487|pubmed:17259607|pubmed:38930|pubmed:7462221|reaxys:78365|umbbd.compound:c0344 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Coenzyme A, S-(hydrogen butanedioate)|S-(3-Carboxy-propionyl)-coenzym-A|S-(3-carboxy-propionyl)-CoA|S-(3-carboxypropionyl)-coenzyme-A|S-(Hydrogen succinyl)coenzyme A|S-(hydrogen succinyl)-CoA|SUCCINYL-COENZYME A|Succinyl coenzyme A|Succinyl-CoA|Succinyl-coenzyme A|succinyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Coenzyme A, S-(hydrogen butanedioate)|S-(3-Carboxy-propionyl)-coenzym-A|S-(3-carboxy-propionyl)-CoA|S-(3-carboxypropionyl)-coenzyme-A|S-(Hydrogen succinyl)coenzyme A|S-(hydrogen succinyl)-CoA|SUCCINYL-COENZYME A|Succinyl coenzyme A|Succinyl-CoA|Succinyl-coenzyme A|succinyl-CoA http://purl.obolibrary.org/obo/CHEBI_15380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15382 biolink:ChemicalEntity (4R)-limonene An optically active form of limonene having (4R)-configuration. bpdb:418|cas:5989-27-5|gmelin:363573|kegg.compound:C06099|kegg.drug:D00194|knapsack:C00010868|lipidmaps:LMPR0102090013|pubmed:24160248|pubmed:24183592|reaxys:2204754|umbbd.compound:c0685|vsdb:418 Graph (+)-(4R)-Limonene|(+)-(R)-Limonene|(+)-4-isopropenyl-1-methylcyclohexene|(+)-Limonene|(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|(4R)-1-methyl-4-isopropenylcyclohex-1-ene|(4R)-4-isopropenyl-1-methylcyclohexene|(4R)-limonene|(R)-(+)-limonene|(R)-(+)-p-mentha-1,8-diene|(R)-1-methyl-4-(1-methylethenyl)cyclohexene|(R)-4-isopropenyl-1-methyl-1-cyclohexene|(R)-p-mentha-1,8-diene|4betaH-p-mentha-1,8-diene|D-(+)-limonene|D-Limonen|D-limonene|d-limonene (4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene (+)-(4R)-Limonene|(+)-(R)-Limonene|(+)-4-isopropenyl-1-methylcyclohexene|(+)-Limonene|(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|(4R)-1-methyl-4-isopropenylcyclohex-1-ene|(4R)-4-isopropenyl-1-methylcyclohexene|(4R)-limonene|(R)-(+)-limonene|(R)-(+)-p-mentha-1,8-diene|(R)-1-methyl-4-(1-methylethenyl)cyclohexene|(R)-4-isopropenyl-1-methyl-1-cyclohexene|(R)-p-mentha-1,8-diene|4betaH-p-mentha-1,8-diene|D-(+)-limonene|D-Limonen|D-limonene|d-limonene http://purl.obolibrary.org/obo/CHEBI_15382 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15383 biolink:ChemicalEntity (4S)-limonene An optically active form of limonene having (4S)-configuration. beilstein:2323991|cas:5989-54-8|gmelin:363574|kegg.compound:C00521|knapsack:C00000803|lipidmaps:LMPR0102090002 Graph (-)-(4S)-Limonene|(-)-(S)-Limonene|(-)-(S)-limonene|(-)-Limonene|(4S)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|(4S)-1-methyl-4-isopropenylcyclohex-1-ene|(4S)-4-isopropenyl-1-methylcyclohexene|(4S)-limonene|(S)-(-)-p-mentha-1,8-diene|(S)-1-methyl-4-(1-methylethenyl)cyclohexene|(S)-p-mentha-1,8-diene|4alphaH-p-mentha-1,8-diene|L-Limonen|L-limonene (4S)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene (-)-(4S)-Limonene|(-)-(S)-Limonene|(-)-(S)-limonene|(-)-Limonene|(4S)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|(4S)-1-methyl-4-isopropenylcyclohex-1-ene|(4S)-4-isopropenyl-1-methylcyclohexene|(4S)-limonene|(S)-(-)-p-mentha-1,8-diene|(S)-1-methyl-4-(1-methylethenyl)cyclohexene|(S)-p-mentha-1,8-diene|4alphaH-p-mentha-1,8-diene|L-Limonen|L-limonene http://purl.obolibrary.org/obo/CHEBI_15383 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15384 biolink:ChemicalEntity limonene A monoterpene that is cyclohex-1-ene substituted by a methyl group at position 1 and a prop-1-en-2-yl group at position 4 respectively. cas:138-86-3|cas:7705-14-8|kegg.compound:C06078|knapsack:C00000823|knapsack:C00003043|reaxys:774123|umbbd.compound:c0626 Graph (+-)-(RS)-limonene|(+/-)-limonene|1,8-p-menthadiene|1-methyl-4-(1-methylethenyl)cyclohexene|1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|4-isopropenyl-1-methylcyclohexene|Cajeputene|Dipentene|Kautschin|Limonene|dl-Limonene|limonene|p-mentha-1,8-diene 1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|p-mentha-1,8-diene (+-)-(RS)-limonene|(+/-)-limonene|1,8-p-menthadiene|1-methyl-4-(1-methylethenyl)cyclohexene|1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene|4-isopropenyl-1-methylcyclohexene|Cajeputene|Dipentene|Kautschin|Limonene|dl-Limonene|limonene|p-mentha-1,8-diene http://purl.obolibrary.org/obo/CHEBI_15384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15385 biolink:ChemicalEntity (+)-delta-cadinene A member of the cadinene family of sesquiterpenes in which the double bonds are located at the 4-4a and 7-8 positions, and in which the isopropyl group at position 1 is cis to the hydrogen at the adjacent bridgehead carbon (the 1S,8aR-enantiomer). cas:483-76-1|kegg.compound:C06394|knapsack:C00007636|lipidmaps:LMPR0103330001|metacyc.compound:CPD-1722 Graph (+)-delta-Cadinene|(1S,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene|(1S,8aR)-delta-cadinene|cadina-1(10),4-diene|delta-amorphene|delta-cadinene cadina-1(10),4-diene (+)-delta-Cadinene|(1S,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene|(1S,8aR)-delta-cadinene|cadina-1(10),4-diene|delta-amorphene|delta-cadinene http://purl.obolibrary.org/obo/CHEBI_15385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15386 biolink:ChemicalEntity (3S,4R)-3,4-dihydrophenanthrene-3,4-diol beilstein:1912842|beilstein:5264943|kegg.compound:C04468 Graph (+)-cis-3,4-Dihydrophenanthrene-3,4-diol|(+)-cis-3,4-dihydrophenanthrene-3,4-diol|(3S,4R)-3,4-dihydrophenanthrene-3,4-diol|cis-3,4-Dihydroxy-3,4-dihydrophenanthrene (+)-cis-3,4-Dihydrophenanthrene-3,4-diol|(+)-cis-3,4-dihydrophenanthrene-3,4-diol|(3S,4R)-3,4-dihydrophenanthrene-3,4-diol (+)-cis-3,4-Dihydrophenanthrene-3,4-diol|(+)-cis-3,4-dihydrophenanthrene-3,4-diol|(3S,4R)-3,4-dihydrophenanthrene-3,4-diol|cis-3,4-Dihydroxy-3,4-dihydrophenanthrene http://purl.obolibrary.org/obo/CHEBI_15386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15387 biolink:ChemicalEntity (+)-cis-sabinol cas:471-16-9|kegg.compound:C02213|knapsack:C00000831 Graph (+)-cis-Sabinol|(+)-cis-sabinol|(1S,3R,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol|(1S,3R,5S)-sabinol|Sabinol (1S,3R,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol (+)-cis-Sabinol|(+)-cis-sabinol|(1S,3R,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol|(1S,3R,5S)-sabinol|Sabinol http://purl.obolibrary.org/obo/CHEBI_15387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15388 biolink:ChemicalEntity (+)-trans-carveol beilstein:2206717|kegg.compound:C11409 Graph (+)-trans-Carveol|(1R,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1R,5S)-carveol|(4S,6R)-trans-Carveol (1R,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol (+)-trans-Carveol|(1R,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1R,5S)-carveol|(4S,6R)-trans-Carveol http://purl.obolibrary.org/obo/CHEBI_15388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15389 biolink:ChemicalEntity (-)-trans-carveol beilstein:2206715|cas:2102-58-1|kegg.compound:C00964|knapsack:C00000814|lipidmaps:LMPR0102090005|umbbd.compound:c0628 Graph (-)-(4R,6S)-trans-carveol|(-)-trans-Carveol|(1S,5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1S,5R)-carveol|(4R,6S)-p-mentha-1,8-dien-6-ol (1S,5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(4R,6S)-p-mentha-1,8-dien-6-ol (-)-(4R,6S)-trans-carveol|(-)-trans-Carveol|(1S,5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1S,5R)-carveol|(4R,6S)-p-mentha-1,8-dien-6-ol http://purl.obolibrary.org/obo/CHEBI_15389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15390 biolink:ChemicalEntity (+)-bisdechlorogeodin cas:59092-96-5|kegg.compound:C03036 Graph (+)-Bisdechlorogeodin|(2S)-bisdechlorogeodin|methyl (2S)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate methyl (2S)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate (+)-Bisdechlorogeodin|(2S)-bisdechlorogeodin|methyl (2S)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate http://purl.obolibrary.org/obo/CHEBI_15390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15391 biolink:ChemicalEntity (-)-bisdechlorogeodin cas:59187-35-8|kegg.compound:C03040 Graph (-)-Bisdechlorogeodin|(2R)-bisdechlorogeodin|methyl (2R)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate methyl (2R)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate (-)-Bisdechlorogeodin|(2R)-bisdechlorogeodin|methyl (2R)-4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate http://purl.obolibrary.org/obo/CHEBI_15391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15392 biolink:ChemicalEntity (1R)-bornane-2,5-dione beilstein:3196616|kegg.compound:C03037 Graph (+)-Bornane-2,5-dione|(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione|(1R,4R)-bornane-2,5-dione|2,5-Diketocamphane (1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione (+)-Bornane-2,5-dione|(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione|(1R,4R)-bornane-2,5-dione|2,5-Diketocamphane http://purl.obolibrary.org/obo/CHEBI_15392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15393 biolink:ChemicalEntity (+)-borneol beilstein:2038056|cas:464-43-7|kegg.compound:C01765|knapsack:C00011023 Graph (+)-Borneol|(1R,2S,4R)-(+)-Borneol|(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|(1R,2S,4R)-borneol|(1R-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|Borneocamphor|D-borneol|Sumatra camphor|d-Borneol|d-borneol|endo-2-Bornanol (1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol (+)-Borneol|(1R,2S,4R)-(+)-Borneol|(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|(1R,2S,4R)-borneol|(1R-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|Borneocamphor|D-borneol|Sumatra camphor|d-Borneol|d-borneol|endo-2-Bornanol http://purl.obolibrary.org/obo/CHEBI_15393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15394 biolink:ChemicalEntity (-)-borneol beilstein:2038053|beilstein:3587558|cas:464-45-9|kegg.compound:C01766|knapsack:C00011024 Graph (-)-Borneol|(1S,2R,4S)-(-)-Borneol|(1S,2R,4S)-(-)-borneol|(1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|(1S,2R,4S)-borneol|(1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|L-Borneol|L-borneol|Linderol|l-borneol (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol (-)-Borneol|(1S,2R,4S)-(-)-Borneol|(1S,2R,4S)-(-)-borneol|(1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|(1S,2R,4S)-borneol|(1S-endo)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|L-Borneol|L-borneol|Linderol|l-borneol http://purl.obolibrary.org/obo/CHEBI_15394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15395 biolink:ChemicalEntity (+)-bornyl diphosphate A monoterpenyl phosphate that is the O-diphospho derivative of (+)-borneol. kegg.compound:C03190|lipidmaps:LMPR0102120009|pdb-ccd:BP2|pubmed:3759972|pubmed:3997807|pubmed:4084562 Graph (+)-Bornyl diphosphate|(+)-Bornyl-diphosphate|(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl trihydrogen diphosphate (1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl trihydrogen diphosphate (+)-Bornyl diphosphate|(+)-Bornyl-diphosphate|(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_15395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15396 biolink:ChemicalEntity (R)-camphor The (R)- enantiomer of camphor. cas:464-49-3|cas:76-22-2|gmelin:83276|hmdb:HMDB0059838|kegg.compound:C00808|kegg.drug:D06392|knapsack:C00000819|metacyc.compound:CPD-862|pdb-ccd:CAM|pubmed:12231778|pubmed:24288289|reaxys:2042745|umbbd.compound:c0407 Graph (+)-Camphor|(+)-bornan-2-one|(1R)-(+)-camphor|(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1R,4R)-camphor|(R)-(+)-camphor|(R)-camphor|CAMPHOR|Camphor(D)|D-Camphor (1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (+)-Camphor|(+)-bornan-2-one|(1R)-(+)-camphor|(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1R,4R)-camphor|(R)-(+)-camphor|(R)-camphor|CAMPHOR|Camphor(D)|D-Camphor http://purl.obolibrary.org/obo/CHEBI_15396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15397 biolink:ChemicalEntity (S)-camphor The S-enantiomer of camphor. beilstein:4291747|cas:464-48-2|gmelin:874917|kegg.compound:C00809|reaxys:1907612 Graph (-)-Camphor|(-)-bornan-2-one|(-)-camphor|(1S)-(-)-camphor|(1S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1S,4S)-camphor|l-camphor (1S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (-)-Camphor|(-)-bornan-2-one|(-)-camphor|(1S)-(-)-camphor|(1S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1S,4S)-camphor|l-camphor http://purl.obolibrary.org/obo/CHEBI_15397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15398 biolink:ChemicalEntity (+)-exo-5-hydroxycamphor beilstein:2044882|drugbank:DB02817|kegg.compound:C03448|lipidmaps:LMPR0102120010|pdb-ccd:CAH|umbbd.compound:c0408 Graph (+)-exo-5-Hydroxycamphor|(1R,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1R,4R,5R)-5-hydroxycamphor|5-EXO-HYDROXYCAMPHOR (1R,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (+)-exo-5-Hydroxycamphor|(1R,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|(1R,4R,5R)-5-hydroxycamphor|5-EXO-HYDROXYCAMPHOR http://purl.obolibrary.org/obo/CHEBI_15398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15399 biolink:ChemicalEntity (+)-carvone A carvone having (S) configuration. beilstein:3588498|beilstein:6767373|cas:2244-16-8|gmelin:637294|kegg.compound:C11383|knapsack:C00010891|pubmed:11380545|reaxys:2042970 Graph (+)-(4S)-carvone|(+)-(S)-Carvone|(+)-Carvone|(4S)-p-mentha-1(6),8-dien-2-one|(5S)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one|(S)-(+)-carvone|(S)-(+)-p-mentha-6,8-dien-2-one|(S)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(S)-2-methyl-5-(1-methylvinyl)cyclohex-2-en-1-one|(S)-5-isopropenyl-2-methylcyclohex-2-en-1-one|(S)-carvone|Carvol|Carvone|d-(+)-carvone|d-carvone (4S)-p-mentha-1(6),8-dien-2-one|(5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one (+)-(4S)-carvone|(+)-(S)-Carvone|(+)-Carvone|(4S)-p-mentha-1(6),8-dien-2-one|(5S)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one|(S)-(+)-carvone|(S)-(+)-p-mentha-6,8-dien-2-one|(S)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(S)-2-methyl-5-(1-methylvinyl)cyclohex-2-en-1-one|(S)-5-isopropenyl-2-methylcyclohex-2-en-1-one|(S)-carvone|Carvol|Carvone|d-(+)-carvone|d-carvone http://purl.obolibrary.org/obo/CHEBI_15399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15400 biolink:ChemicalEntity (-)-carvone A carvone having (R) configuration. beilstein:3588497|cas:6485-40-1|gmelin:83213|kegg.compound:C01767|knapsack:C00000807|lipidmaps:LMPR0102090007|ppdb:125|pubmed:11380545|reaxys:2206714|umbbd.compound:c0627 Graph (-)-(4R)-carvone|(-)-(R)-carvone|(-)-Carvone|(-)-p-mentha-6,8-dien-2-one|(4R)-Carvone|(4R)-p-mentha-1(6),8-dien-2-one|(5R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one|(R)-(-)-carvone|(R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(R)-5-isopropenyl-2-methylcyclohex-2-en-1-one|(R)-carvone|l-1-methyl-4-isopropenyl-6-cyclohexen-2-one|l-carvone|l-p-mentha-1(6),8-dien-2-one|levo-carvone (4R)-p-mentha-1(6),8-dien-2-one|(5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one (-)-(4R)-carvone|(-)-(R)-carvone|(-)-Carvone|(-)-p-mentha-6,8-dien-2-one|(4R)-Carvone|(4R)-p-mentha-1(6),8-dien-2-one|(5R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(5R)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-one|(R)-(-)-carvone|(R)-2-methyl-5-(1-methylethenyl)-2-cyclohexen-1-one|(R)-5-isopropenyl-2-methylcyclohex-2-en-1-one|(R)-carvone|l-1-methyl-4-isopropenyl-6-cyclohexen-2-one|l-carvone|l-p-mentha-1(6),8-dien-2-one|levo-carvone http://purl.obolibrary.org/obo/CHEBI_15400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15402 biolink:ChemicalEntity (+)-neomenthol cas:2216-52-6|kegg.compound:C00553|knapsack:C00000825|lipidmaps:LMPR0102090003 Graph (+)-Neomenthol|(+)-neomenthol|(1S,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol (1S,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol (+)-Neomenthol|(+)-neomenthol|(1S,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol http://purl.obolibrary.org/obo/CHEBI_15402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15403 biolink:ChemicalEntity (+)-sabinone kegg.compound:C01868|knapsack:C00000828 Graph (+)-Sabinone|(1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one|(1S,5S)-sabinone (1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one (+)-Sabinone|(1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one|(1S,5S)-sabinone http://purl.obolibrary.org/obo/CHEBI_15403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15404 biolink:ChemicalEntity (-)-homoisocitrate(3-) kegg.compound:C05662 Graph (-)-1-Hydroxy-1,2,4-butanetricarboxylate|(1R,2S)-1-Hydroxybutane-1,2,4-tricarboxylate|(1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate|(2R,3S)-homoisocitrate (1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate (-)-1-Hydroxy-1,2,4-butanetricarboxylate|(1R,2S)-1-Hydroxybutane-1,2,4-tricarboxylate|(1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate|(2R,3S)-homoisocitrate http://purl.obolibrary.org/obo/CHEBI_15404 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15405 biolink:ChemicalEntity (-)-endo-fenchol A fenchane monoterpenoid that is bicyclo[2.2.1]heptane substituted by methyl groups at positions 1, 3 and 3 and a hydroxy group at position 2 (the 1S,2S,4R stereoisomer). beilstein:3648192|cas:1632-73-1|cas:512-13-0|gmelin:2094057|hmdb:HMDB0034932|kegg.compound:C02344|knapsack:C00035801|lipidmaps:LMPR0102120005|metacyc.compound:CPD-685|pubmed:20334144|pubmed:22455514|reaxys:2038083 Graph (-)-endo-Fenchol|(1S,2-endo)-1,3,3-trimethylnorbornan-2-ol|(1S,2S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol|(1S,2S,4R)-endo-fenchol|1,3,3-trimethyl-2-norbornanol|2-Fenchanol|Fenchyl alcohol|alpha-fenchol|alpha-fenchyl alcohol|endo-alpha-fenchol|endo-fenchol (1S,2S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol (-)-endo-Fenchol|(1S,2-endo)-1,3,3-trimethylnorbornan-2-ol|(1S,2S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol|(1S,2S,4R)-endo-fenchol|1,3,3-trimethyl-2-norbornanol|2-Fenchanol|Fenchyl alcohol|alpha-fenchol|alpha-fenchyl alcohol|endo-alpha-fenchol|endo-fenchol http://purl.obolibrary.org/obo/CHEBI_15405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15406 biolink:ChemicalEntity (-)-trans-isopiperitenol beilstein:2554977|kegg.compound:C01123|knapsack:C00000815|lipidmaps:LMPR0102090006|umbbd.compound:c0670 Graph (-)-trans-Isopiperitenol|(-)-trans-isopiperitenol|(1S,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1S,6R)-isopiperitenol|(1S,6R)-p-mentha-1,8-dien-3-ol|3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-ol (1S,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1S,6R)-p-mentha-1,8-dien-3-ol (-)-trans-Isopiperitenol|(-)-trans-isopiperitenol|(1S,6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1S,6R)-isopiperitenol|(1S,6R)-p-mentha-1,8-dien-3-ol|3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-ol http://purl.obolibrary.org/obo/CHEBI_15406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15407 biolink:ChemicalEntity (-)-ephedrine A phenethylamine alkaloid that is 2-phenylethanamine substituted by a methyl group at the amino nitrogen and a methyl and a hydroxy group at position 2 and 1 respectively. cas:299-42-3|chemspider:4856|drugbank:DB01364|drugcentral:1024|gmelin:261389|kegg.compound:C01575|kegg.drug:D00124|knapsack:C00001409|pubmed:13359219|pubmed:13809594|pubmed:21465337|pubmed:25660335|pubmed:27662264|pubmed:27846433|reaxys:2208730|vsdb:2959|wikipedia.en:Ephedrine Graph (-)-Ephedrine|(1R,2S)-1-phenyl-1-hydroxy-2-methylaminopropane|(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol|Ephedrine|L(-)-ephedrine|L-Ephedrine|L-erythro-2-(methylamino)-1-phenylpropan-1-ol|l-ephedrine (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol (-)-Ephedrine|(1R,2S)-1-phenyl-1-hydroxy-2-methylaminopropane|(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol|Ephedrine|L(-)-ephedrine|L-Ephedrine|L-erythro-2-(methylamino)-1-phenylpropan-1-ol|l-ephedrine http://purl.obolibrary.org/obo/CHEBI_15407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15408 biolink:ChemicalEntity (-)-isopiperitenone beilstein:5849572|cas:80995-97-7|kegg.compound:C02485|knapsack:C00000809|lipidmaps:LMPR01020030|lipidmaps:LMPR0102090009|umbbd.compound:c0671 Graph (-)-(4R)-Isopiperitenone|(-)-Isopiperitenone|(-)-isopiperitenone|(4R)-p-mentha-1,8-dien-3-one|(6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-one|(6R)-isopiperitenone (4R)-p-mentha-1,8-dien-3-one|(6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-one (-)-(4R)-Isopiperitenone|(-)-Isopiperitenone|(-)-isopiperitenone|(4R)-p-mentha-1,8-dien-3-one|(6R)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-one|(6R)-isopiperitenone http://purl.obolibrary.org/obo/CHEBI_15408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15409 biolink:ChemicalEntity (-)-menthol A p-menthan-3-ol which has (1R,2S,5R)-stereochemistry. It is the most common naturally occurring enantiomer. cas:2216-51-5|drugbank:DB00825|drugcentral:934|hmdb:HMDB0003352|kegg.compound:C00400|kegg.drug:D00064|knapsack:C00000810|lipidmaps:LMPR0102090001|metacyc.compound:--MENTHOL|patent:CN101602651|patent:US2011313205|pubmed:17021997|pubmed:17498839|pubmed:18640225|pubmed:21353674|pubmed:22218824|pubmed:22348831|pubmed:23800946|pubmed:23963768|pubmed:7974298|reaxys:1902293|wikipedia.en:Menthol Graph (-)-(1R,3R,4S)-menthol|(-)-Menthol|(-)-menthol|(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol|(1R,3R,4S)-(-)-menthol|(1R-(1-alpha,2-beta,5-alpha))-5-methyl-2-(1-methylethyl)cyclohexanol|(1alpha,2beta,5alpha)-5-methyl-2(1-methylethyl)cyclohexanol|L-Menthol|l-menthol|levomenthol|levomentholum|levomentol (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol (-)-(1R,3R,4S)-menthol|(-)-Menthol|(-)-menthol|(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol|(1R,3R,4S)-(-)-menthol|(1R-(1-alpha,2-beta,5-alpha))-5-methyl-2-(1-methylethyl)cyclohexanol|(1alpha,2beta,5alpha)-5-methyl-2(1-methylethyl)cyclohexanol|L-Menthol|l-menthol|levomenthol|levomentholum|levomentol http://purl.obolibrary.org/obo/CHEBI_15409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15410 biolink:ChemicalEntity (-)-menthone A menthone that is cyclohexanone substituted by a methyl and an isopropyl group at positions 5 and 2 respectively (the 2S,5R-stereoisomer). beilstein:2041368|beilstein:3648743|beilstein:3648744|cas:14073-97-3|kegg.compound:C00843|knapsack:C00000811|lipidmaps:LMPR0102090004 Graph (-)-Menthone|(1R,4S)-menthone|(1R,4S)-p-menthan-3-one|(2S,5R)-2-isopropyl-5-methylcyclohexanone|(2S,5R)-5-methyl-2-(1-methylethyl)cyclohexanone|(2S,5R)-5-methyl-2-(propan-2-yl)cyclohexanone|(2S-trans)-5-methyl-2-(1-methylethyl)cyclohexanone|l-Menthone|l-menthone|p-Menthan-3-one (2S,5R)-5-methyl-2-(propan-2-yl)cyclohexanone (-)-Menthone|(1R,4S)-menthone|(1R,4S)-p-menthan-3-one|(2S,5R)-2-isopropyl-5-methylcyclohexanone|(2S,5R)-5-methyl-2-(1-methylethyl)cyclohexanone|(2S,5R)-5-methyl-2-(propan-2-yl)cyclohexanone|(2S-trans)-5-methyl-2-(1-methylethyl)cyclohexanone|l-Menthone|l-menthone|p-Menthan-3-one http://purl.obolibrary.org/obo/CHEBI_15410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15411 biolink:ChemicalEntity (-)-menthyl beta-D-glucoside kegg.compound:C03962 Graph (-)-Menthyl O-beta-D-glucoside|(-)-menthyl O-beta-D-glucoside|(-)-menthyl O-beta-glucopyranoside|(-)-menthyl beta-D-glucoside|(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl beta-D-glucopyranoside (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl beta-D-glucopyranoside (-)-Menthyl O-beta-D-glucoside|(-)-menthyl O-beta-D-glucoside|(-)-menthyl O-beta-glucopyranoside|(-)-menthyl beta-D-glucoside|(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_15411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15412 biolink:ChemicalEntity (-)-ureidoglycolic acid The (−)-enantiomer of ureidoglycolic acid. kegg.compound:C00603|knapsack:C00007466 Graph (-)-Ureidoglycolate|(2S)-(carbamoylamino)(hydroxy)acetic acid|(S)-Ureidoglycolate (2S)-(carbamoylamino)(hydroxy)acetic acid (-)-Ureidoglycolate|(2S)-(carbamoylamino)(hydroxy)acetic acid|(S)-Ureidoglycolate http://purl.obolibrary.org/obo/CHEBI_15412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15413 biolink:ChemicalEntity 2',4,4',6'-tetrahydroxychalcone A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 2' ,4, 4', and 6' respectively. cas:73692-50-9|kegg.compound:C06561|knapsack:C00007233|lipidmaps:LMPK12120264|pubmed:15322354|pubmed:17915259|pubmed:20035147|pubmed:20363289|pubmed:20815398|reaxys:2335724 Graph (2E)-3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one|2',4',6',4-tetrahydroxychalcone|2',4,4',6'-Tetrahydroxychalcone|2',4,4',6'-tetrahydroxychalcone|2'4'6'4-Tetrahydroxychalcone|Chalconaringenin|Isosalipurpol|Naringenin chalcone (2E)-3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one (2E)-3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one|2',4',6',4-tetrahydroxychalcone|2',4,4',6'-Tetrahydroxychalcone|2',4,4',6'-tetrahydroxychalcone|2'4'6'4-Tetrahydroxychalcone|Chalconaringenin|Isosalipurpol|Naringenin chalcone http://purl.obolibrary.org/obo/CHEBI_15413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15414 biolink:ChemicalEntity S-adenosyl-L-methionine A sulfonium compound that is the S-adenosyl derivative of L-methionine. It is an intermediate in the metabolic pathway of methionine. beilstein:3576439|cas:29908-03-0|drugbank:DB00118|hmdb:HMDB0001185|kegg.compound:C00019|knapsack:C00007347|metacyc.compound:S-ADENOSYLMETHIONINE|pubmed:11017945|pubmed:17439666|reaxys:3919754|wikipedia.en:S-Adenosyl_methionine Graph (3S)-5'-[(3-amino-3-carboxypropyl)methylsulfonio]-5'-deoxyadenosine, inner salt|Acylcarnitine|AdoMet|S-(5'-deoxyadenosin-5'-yl)-L-methionine|S-Adenosyl-L-methionine|S-Adenosylmethionine|S-adenosyl-L-methionine|S-adenosylmethionine|SAM|SAMe|[(3S)-3-amino-3-carboxypropyl](5'-deoxyadenosin-5'-yl)(methyl)sulfonium|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl][(3S)-3-amino-3-carboxypropyl](methyl)sulfonium [(3S)-3-amino-3-carboxypropyl](5'-deoxyadenosin-5'-yl)(methyl)sulfonium (3S)-5'-[(3-amino-3-carboxypropyl)methylsulfonio]-5'-deoxyadenosine, inner salt|Acylcarnitine|AdoMet|S-(5'-deoxyadenosin-5'-yl)-L-methionine|S-Adenosyl-L-methionine|S-Adenosylmethionine|S-adenosyl-L-methionine|S-adenosylmethionine|SAM|SAMe|[(3S)-3-amino-3-carboxypropyl](5'-deoxyadenosin-5'-yl)(methyl)sulfonium|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl][(3S)-3-amino-3-carboxypropyl](methyl)sulfonium http://purl.obolibrary.org/obo/CHEBI_15414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15415 biolink:ChemicalEntity ent-kaurene A tetracyclic diterpene consisting of ent-kaurane, where the 6-methyl group is replaced by methylene. cas:562-28-7|kegg.compound:C06090|knapsack:C00007253|lipidmaps:LMPR0104130002|pubmed:16714024|pubmed:21122070|pubmed:21228464|reaxys:2050704 Graph (5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-ene|Ent-kaur-16-ene|ent-Kaur-16-ene|ent-Kaurene|ent-kaur-16-ene ent-Kaur-16-ene|ent-kaur-16-ene (5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-ene|Ent-kaur-16-ene|ent-Kaur-16-ene|ent-Kaurene|ent-kaur-16-ene http://purl.obolibrary.org/obo/CHEBI_15415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15417 biolink:ChemicalEntity ent-kaur-16-en-19-oic acid An ent-kaurane diterpenoid that is ent-kauran-19-oic acid in which a double bond is present at position 16(17); exhibits anticancer and anti-HIV 1 activity. cas:6730-83-2|kegg.compound:C11874|knapsack:C00000881|lipidmaps:LMPR0104130004|metacyc.compound:CPD1F-132|pubmed:20013639|pubmed:20496227|pubmed:20552528|pubmed:21823454|pubmed:21884778|pubmed:22832886|pubmed:23314342|reaxys:10784819 Graph (-)-Kaur-16-en-19-oic acid|(5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-en-18-oic acid|Kaur-16-en-18-oic acid|Kauren-19-oic acid|Kaurenic acid|Kaurenoic acid|ent-Kaur-16(17)-en-19-oic acid|ent-Kaurenoic acid|ent-kaur-16-en-19-oic acid ent-kaur-16-en-19-oic acid (-)-Kaur-16-en-19-oic acid|(5beta,8alpha,9beta,10alpha,13alpha)-kaur-16-en-18-oic acid|Kaur-16-en-18-oic acid|Kauren-19-oic acid|Kaurenic acid|Kaurenoic acid|ent-Kaur-16(17)-en-19-oic acid|ent-Kaurenoic acid|ent-kaur-16-en-19-oic acid http://purl.obolibrary.org/obo/CHEBI_15417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15420 biolink:ChemicalEntity perillyl alcohol A limonene monoterpenoid consists of a cyclohexene ring substituted by a hydroxymethyl and a prop-1-en-2-yl group at positions 1 and 4 respectively. It is a constituent of a variety of essential oils including lavender. cas:536-59-4|hmdb:HMDB0003634|metacyc.compound:Perillyl-Alcohols|pubmed:10379660|pubmed:11840288|pubmed:15210838|pubmed:23727191|reaxys:2044612 Graph 1-Hydroxymethyl-4-isopropenyl-1-cyclohexene|1-perillalcohol|4-(1-Methylethenyl)-1-cyclohexene-1-methanol|4-Isopropenyl-1-cyclohexene carbinol|4-Isopropenylcyclohex-1-en-1-ylmethanol|Isocarveol|Perilla alcohol|Perillol|[4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|dihydrocuminyl alcoholn|p-Mentha-1,8-dien-7-ol|perillyl alcohol [4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol 1-Hydroxymethyl-4-isopropenyl-1-cyclohexene|1-perillalcohol|4-(1-Methylethenyl)-1-cyclohexene-1-methanol|4-Isopropenyl-1-cyclohexene carbinol|4-Isopropenylcyclohex-1-en-1-ylmethanol|Isocarveol|Perilla alcohol|Perillol|[4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol|dihydrocuminyl alcoholn|p-Mentha-1,8-dien-7-ol|perillyl alcohol http://purl.obolibrary.org/obo/CHEBI_15420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15421 biolink:ChemicalEntity perillyl aldehyde An aldehyde that is cyclohex-1-ene-1-carbaldehyde substituted by a prop-1-en-2-yl group at position 4. cas:2111-75-3|kegg.compound:C02576|knapsack:C00003050|lipidmaps:LMPR0102090010|pubmed:23413567|umbbd.compound:c0666 Graph 4-(1-methylethenyl)-1-cyclohexene1-carboxyaldehyde|4-(prop-1-en-2-yl)cyclohex-1-ene-1-carbaldehyde|Perillaldehyde|Perillyl aldehyde|p-mentha-1,8-dien-7-al|perillal|perillic aldehyde|perillyl aldehyde|perillylaldehyde 4-(prop-1-en-2-yl)cyclohex-1-ene-1-carbaldehyde 4-(1-methylethenyl)-1-cyclohexene1-carboxyaldehyde|4-(prop-1-en-2-yl)cyclohex-1-ene-1-carbaldehyde|Perillaldehyde|Perillyl aldehyde|p-mentha-1,8-dien-7-al|perillal|perillic aldehyde|perillyl aldehyde|perillylaldehyde http://purl.obolibrary.org/obo/CHEBI_15421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15422 biolink:ChemicalEntity ATP An adenosine 5'-phosphate in which the 5'-phosphate is a triphosphate group. It is involved in the transportation of chemical energy during metabolic pathways. cas:56-65-5|drugbank:DB00171|drugcentral:91|gmelin:34857|hmdb:HMDB0000538|kegg.compound:C00002|kegg.drug:D08646|knapsack:C00001491|patent:US3079379|pdb-ccd:ATP|reaxys:73010|wikipedia.en:Adenosine_triphosphate Graph ADENOSINE-5'-TRIPHOSPHATE|ATP|Adenosine 5'-triphosphate|Adenosine triphosphate|H4atp|adenosine 5'-(tetrahydrogen triphosphate) adenosine 5'-(tetrahydrogen triphosphate) ADENOSINE-5'-TRIPHOSPHATE|ATP|Adenosine 5'-triphosphate|Adenosine triphosphate|H4atp|adenosine 5'-(tetrahydrogen triphosphate) http://purl.obolibrary.org/obo/CHEBI_15422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15425 biolink:ChemicalEntity proclavaminic acid cas:112240-59-2|kegg.compound:C06658|pdb-ccd:PCV|reaxys:3651348 Graph (2S,3R)-5-amino-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoic acid|5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-1-YL)-PENTANOIC ACID|5-amino-2,4,5-trideoxy-2-(2-oxo-1-azetidinyl)-D-threo-pentonic acid|5-amino-2,4,5-trideoxy-2-(2-oxoazetidin-1-yl)-D-threo-pentonic acid|Proclavaminate|Proclavaminic acid (2S,3R)-5-amino-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoic acid|5-amino-2,4,5-trideoxy-2-(2-oxoazetidin-1-yl)-D-threo-pentonic acid (2S,3R)-5-amino-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoic acid|5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-1-YL)-PENTANOIC ACID|5-amino-2,4,5-trideoxy-2-(2-oxo-1-azetidinyl)-D-threo-pentonic acid|5-amino-2,4,5-trideoxy-2-(2-oxoazetidin-1-yl)-D-threo-pentonic acid|Proclavaminate|Proclavaminic acid http://purl.obolibrary.org/obo/CHEBI_15425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15426 biolink:ChemicalEntity deoxyamidinoproclavaminic acid beilstein:6145950|drugbank:DB02475|kegg.compound:C06656|pdb-ccd:PCX Graph (2S)-5-carbamimidamido-2-(2-oxoazetidin-1-yl)pentanoic acid|DEOXYGUANIDINOPROCLAVAMINIC ACID|Deoxyamidinoproclavaminate|Deoxyguanidinoproclavaminate|Deoxyguanidinoproclavaminic acid (2S)-5-carbamimidamido-2-(2-oxoazetidin-1-yl)pentanoic acid (2S)-5-carbamimidamido-2-(2-oxoazetidin-1-yl)pentanoic acid|DEOXYGUANIDINOPROCLAVAMINIC ACID|Deoxyamidinoproclavaminate|Deoxyguanidinoproclavaminate|Deoxyguanidinoproclavaminic acid http://purl.obolibrary.org/obo/CHEBI_15426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15427 biolink:ChemicalEntity N(2)-(2-carboxyethyl)-L-arginine drugbank:DB04189|kegg.compound:C06655|pdb-ccd:CMA|pubmed:11473258|pubmed:14623876 Graph L-N2-(2-Carboxyethyl)arginine|N(2)-(2-carboxyethyl)-L-arginine|N2-(2-Carboxyethyl)-L-arginine|N2-(2-carboxyethyl)arginine N(2)-(2-carboxyethyl)-L-arginine L-N2-(2-Carboxyethyl)arginine|N(2)-(2-carboxyethyl)-L-arginine|N2-(2-Carboxyethyl)-L-arginine|N2-(2-carboxyethyl)arginine http://purl.obolibrary.org/obo/CHEBI_15427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15428 biolink:ChemicalEntity glycine The simplest (and the only achiral) proteinogenic amino acid, with a hydrogen atom as its side chain. cas:56-40-6|drugbank:DB00145|drugcentral:1319|ecmdb:ECMDB00123|gmelin:1808|hmdb:HMDB0000123|kegg.compound:C00037|kegg.drug:D00011|knapsack:C00001361|metacyc.compound:GLY|pdb-ccd:GLY|pubmed:10930630|pubmed:11019925|pubmed:11174716|pubmed:11542461|pubmed:11806864|pubmed:12631515|pubmed:12754315|pubmed:12770151|pubmed:12921899|pubmed:15331688|pubmed:15388434|pubmed:15710237|pubmed:16105183|pubmed:16151895|pubmed:16214212|pubmed:16417482|pubmed:16444815|pubmed:16664855|pubmed:16901953|pubmed:16918424|pubmed:16986325|pubmed:16998855|pubmed:17154252|pubmed:17383967|pubmed:17582620|pubmed:17970719|pubmed:18079355|pubmed:18396796|pubmed:18440992|pubmed:18593588|pubmed:18816054|pubmed:18840508|pubmed:19028609|pubmed:19120667|pubmed:19449910|pubmed:19526731|pubmed:19544666|pubmed:19738917|pubmed:19916621|pubmed:19924257|pubmed:21751272|pubmed:22044190|pubmed:22079563|pubmed:22234938|pubmed:22264337|pubmed:22293292|pubmed:22401276|pubmed:22434786|reaxys:635782|wikipedia.en:Glycine|ymdb:YMDB00016 Graph Aminoacetic acid|Aminoessigsaeure|G|GLYCINE|Gly|Glycin|Glycine|Glycocoll|Glykokoll|Glyzin|H2N-CH2-COOH|Hgly|Leimzucker|aminoacetic acid|aminoethanoic acid|glycine Aminoacetic acid|GLYCINE|Glycine|aminoacetic acid|glycine Aminoacetic acid|Aminoessigsaeure|G|GLYCINE|Gly|Glycin|Glycine|Glycocoll|Glykokoll|Glyzin|H2N-CH2-COOH|Hgly|Leimzucker|aminoacetic acid|aminoethanoic acid|glycine http://purl.obolibrary.org/obo/CHEBI_15428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15429 biolink:ChemicalEntity hydroxylamine The simplest hydroxylamine, consisting of ammonia bearing a hydroxy substituent. It is an intermediate in the biological nitrification by microbes like bacteria. cas:7803-49-8|gmelin:478|hmdb:HMDB0003338|kegg.compound:C00192|metacyc.compound:HYDROXYLAMINE|pdb-ccd:HOA|pubmed:11053303|pubmed:11160411|pubmed:11226629|pubmed:11750265|pubmed:12962703|pubmed:17385063|pubmed:18399918|pubmed:18515490|pubmed:21185448|reaxys:3587190|wikipedia.en:Hydroxylamine Graph H2NHO|HYDROXYAMINE|Hydroxylamin|Hydroxylamine|[NH2OH]|dihydridohydroxidonitrogen|hydroxylamine|oxyammonia Hydroxylamine|dihydridohydroxidonitrogen|hydroxylamine H2NHO|HYDROXYAMINE|Hydroxylamin|Hydroxylamine|[NH2OH]|dihydridohydroxidonitrogen|hydroxylamine|oxyammonia http://purl.obolibrary.org/obo/CHEBI_15429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15430 biolink:ChemicalEntity protoporphyrin A cyclic tetrapyrrole that consists of porphyrin bearing four methyl substituents at positions 3, 8, 13 and 17, two vinyl substituents at positions 7 and 12 and two 2-carboxyethyl substituents at positions 2 and 18. The parent of the class of protoporphyrins. beilstein:635160|beilstein:635161|cas:553-12-8|drugbank:DB02285|drugcentral:3500|gmelin:251232|hmdb:HMDB0000241|kegg.compound:C02191|knapsack:C00007370|metacyc.compound:PROTOPORPHYRIN_IX|pdb-ccd:PP9|pubmed:18625294|pubmed:19005892|pubmed:20961864|pubmed:21146529|pubmed:21167148|pubmed:21668870|pubmed:21760730|pubmed:21913427|pubmed:23533060|reaxys:380795|wikipedia.en:Protoporphyrin_IX Graph 3,3'-(3,7,12,17-tetramethyl-8,13-divinyl-21H,23H-porphine-2,18-diyl)-bis-propionic acid|3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoic acid|7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoic acid|H2ppIX|Kammerer's prophyrin|PROTOPORPHYRIN IX|Porphyrinogen IX|Protoporphyrin|Protoporphyrin IX|ooporphyrin 7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoic acid 3,3'-(3,7,12,17-tetramethyl-8,13-divinyl-21H,23H-porphine-2,18-diyl)-bis-propionic acid|3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoic acid|7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoic acid|H2ppIX|Kammerer's prophyrin|PROTOPORPHYRIN IX|Porphyrinogen IX|Protoporphyrin|Protoporphyrin IX|ooporphyrin http://purl.obolibrary.org/obo/CHEBI_15430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15431 biolink:ChemicalEntity magnesium protoporphyrin beilstein:6365239|cas:14947-11-6|kegg.compound:C03516|knapsack:C00007369|pdb-ccd:HEG Graph (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)magnesium(II)|(protoporphyrinato)magnesium(II)|Magnesium protoporphyrin|Magnesium protoporphyrin IX|Mg(ppIX)|Mg-protoporphyrin IX|PROTOPORPHYRIN IX CONTAINING MG|[Mg(ppIX)] (protoporphyrinato)magnesium(II) (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)magnesium(II)|(protoporphyrinato)magnesium(II)|Magnesium protoporphyrin|Magnesium protoporphyrin IX|Mg(ppIX)|Mg-protoporphyrin IX|PROTOPORPHYRIN IX CONTAINING MG|[Mg(ppIX)] http://purl.obolibrary.org/obo/CHEBI_15431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15432 biolink:ChemicalEntity magnesium protoporphyrin 13-monomethyl ester kegg.compound:C04536|knapsack:C00007372 Graph Magnesium protoporphyrin IX 13-methyl ester|Magnesium protoporphyrin monomethyl ester|Magnesium-protoporphyrin IX 13-monomethyl ester|Mg-Protoporphyrin IX 13-monomethyl ester|[7,12-diethenyl-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-2-propanoato]magnesium(II) Magnesium protoporphyrin IX 13-methyl ester|Magnesium protoporphyrin monomethyl ester|Magnesium-protoporphyrin IX 13-monomethyl ester|Mg-Protoporphyrin IX 13-monomethyl ester|[7,12-diethenyl-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-2-propanoato]magnesium(II) http://purl.obolibrary.org/obo/CHEBI_15432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15435 biolink:ChemicalEntity protoporphyrinogen beilstein:1201533|cas:7412-77-3|kegg.compound:C01079|knapsack:C00007371 Graph 7,12-diethenyl-3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,18-dipropanoic acid|Protoporphyrinogen IX 7,12-diethenyl-3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,18-dipropanoic acid|Protoporphyrinogen IX http://purl.obolibrary.org/obo/CHEBI_15435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15437 biolink:ChemicalEntity uroporphyrinogen III beilstein:605190|cas:1976-85-8|gmelin:1166130|kegg.compound:C01051|knapsack:C00007373 Graph 3,3',3'',3'''-[3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid|3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydro-21H,23H-porphine-2,7,12,18-tetrapropanoic acid|3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropionic acid|Uroporphyrinogen III|uro'gen III 3,3',3'',3'''-[3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid|3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydro-21H,23H-porphine-2,7,12,18-tetrapropanoic acid|3,8,13,17-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropionic acid|Uroporphyrinogen III|uro'gen III http://purl.obolibrary.org/obo/CHEBI_15437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15438 biolink:ChemicalEntity coproporphyrinogen kegg.compound:C02667 Graph Coproporphyrinogen|coproporphyrinogens Coproporphyrinogen|coproporphyrinogens http://purl.obolibrary.org/obo/CHEBI_15438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15439 biolink:ChemicalEntity coproporphyrinogen III beilstein:1208502|cas:2624-63-7|kegg.compound:C03263|knapsack:C00007284|pdb-ccd:CP3 Graph 3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropanoic acid|3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropionic acid|5,10,15,20,22,24-hexahydro-3,8,13,17-tetramethyl-21H,23H-porphine-2,7,12,18-tetrapropanoic acid|COPROPORPHYRIN III|Coproporphyrinogen III 3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropanoic acid 3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropanoic acid|3,8,13,17-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,18-tetrapropionic acid|5,10,15,20,22,24-hexahydro-3,8,13,17-tetramethyl-21H,23H-porphine-2,7,12,18-tetrapropanoic acid|COPROPORPHYRIN III|Coproporphyrinogen III http://purl.obolibrary.org/obo/CHEBI_15439 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15440 biolink:ChemicalEntity squalene A triterpene consisting of 2,6,10,15,19,23-hexamethyltetracosane having six double bonds at the 2-, 6-, 10-, 14-, 18- and 22-positions with (all-E)-configuration. beilstein:1728920|cas:111-02-4|hmdb:HMDB0000256|kegg.compound:C00751|knapsack:C00003755|lipidmaps:LMPR0106010002|metacyc.compound:SQUALENE|pdb-ccd:SQL|pubmed:16341241|pubmed:23625688|pubmed:24362891|pubmed:25286851|pubmed:25286853|pubmed:25987292|wikipedia.en:Squalene Graph (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene|(all-E)-2,6,10,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaene|Spinacene|Squalene|Supraene|squalene (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene|(all-E)-2,6,10,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaene|Spinacene|Squalene|Supraene|squalene http://purl.obolibrary.org/obo/CHEBI_15440 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15441 biolink:ChemicalEntity (S)-2,3-epoxysqualene A 2,3-epoxysqualene in which the chiral centre has S configuration. It is converted into lanosterol by lanosterol synthase (EC 5.4.99.7) in a key rate-limiting step in the biosynthesis of chloesterol, steroid hormones, and vitamin D. hmdb:HMDB0001188|hmdb:HMDB0059621|kegg.compound:C01054|knapsack:C00007282|lipidmaps:LMPR0106010010|metacyc.compound:EPOXYSQUALENE|pdb-ccd:2TX|pubmed:19951700|pubmed:26058429|reaxys:4710524 Graph (3S)-2,2-dimethyl-3-[(3E,7E,11E,15E)-3,7,12,16,20-pentamethylhenicosa-3,7,11,15,19-pentaen-1-yl]oxirane|(3S)-2,3-dihydro-2,3-epoxysqualene|(3S)-2,3-epoxy-2,3-dihydrosqualene|(S)-2,3-Epoxysqualene|(S)-2,3-dihydro-2,3-epoxysqualene|(S)-2,3-epoxy-2,3-dihydrosqualene|(S)-2,3-epoxysqualene|(S)-2,3-oxidosqualene|(S)-Squalene-2,3-epoxide|(S)-squalene-2,3-epoxide|2,3-EDSQ|2,3-epoxisqualene|2,3-oxidosqualene|Squalene 2,3-epoxide|Squalene 2,3-oxide|oxidosqualene (3S)-2,2-dimethyl-3-[(3E,7E,11E,15E)-3,7,12,16,20-pentamethylhenicosa-3,7,11,15,19-pentaen-1-yl]oxirane (3S)-2,2-dimethyl-3-[(3E,7E,11E,15E)-3,7,12,16,20-pentamethylhenicosa-3,7,11,15,19-pentaen-1-yl]oxirane|(3S)-2,3-dihydro-2,3-epoxysqualene|(3S)-2,3-epoxy-2,3-dihydrosqualene|(S)-2,3-Epoxysqualene|(S)-2,3-dihydro-2,3-epoxysqualene|(S)-2,3-epoxy-2,3-dihydrosqualene|(S)-2,3-epoxysqualene|(S)-2,3-oxidosqualene|(S)-Squalene-2,3-epoxide|(S)-squalene-2,3-epoxide|2,3-EDSQ|2,3-epoxisqualene|2,3-oxidosqualene|Squalene 2,3-epoxide|Squalene 2,3-oxide|oxidosqualene http://purl.obolibrary.org/obo/CHEBI_15441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15442 biolink:ChemicalEntity presqualene diphosphate A triterpenyl phosphate that is presqualene in which the hydroxy hydrogen has been replaced by a diphosphate group. kegg.compound:C03428 Graph Presqualene diphosphate|[(1S,2S,3S)-2-[(E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropan-1-yl]methyl diphosphate|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl trihydrogen diphosphate {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl trihydrogen diphosphate Presqualene diphosphate|[(1S,2S,3S)-2-[(E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropan-1-yl]methyl diphosphate|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(2E,6E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropan-1-yl}methyl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_15442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15443 biolink:ChemicalEntity inulin cas:9005-80-5|drugbank:DB00638|kegg.compound:C03323|kegg.drug:D00171|kegg.glycan:G10497 Graph (1,2-beta-D-Fructosyl)n|(1,2-beta-D-fructosyl)n|(2,1-beta-D-Fructosyl)n|(2,1-beta-D-fructosyl)n|(2->1)-beta-D-fructofuranan|Inulin (2->1)-beta-D-fructofuranan (1,2-beta-D-Fructosyl)n|(1,2-beta-D-fructosyl)n|(2,1-beta-D-Fructosyl)n|(2,1-beta-D-fructosyl)n|(2->1)-beta-D-fructofuranan|Inulin http://purl.obolibrary.org/obo/CHEBI_15443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15444 biolink:ChemicalEntity (1->4)-alpha-D-glucan Graph (1,4-alpha-D-Glucosyl)n|(1,4-alpha-D-Glucosyl)n+1|(1,4-alpha-D-Glucosyl)n-1|(1,4-alpha-D-glucosyl)(n)|(1,4-alpha-D-glucosyl)n|(1,4-alpha-D-glucosyl)n+1|(1,4-alpha-D-glucosyl)n-1|1,4-alpha-D-Glucan|1,4-alpha-D-glucan|4-{(1,4)-alpha-D-Glucosyl}(n-1)-D-glucose|4-{(1,4)-alpha-D-glucosyl}(n-1)-D-glucose (1,4-alpha-D-Glucosyl)n|(1,4-alpha-D-Glucosyl)n+1|(1,4-alpha-D-Glucosyl)n-1|(1,4-alpha-D-glucosyl)(n)|(1,4-alpha-D-glucosyl)n|(1,4-alpha-D-glucosyl)n+1|(1,4-alpha-D-glucosyl)n-1|1,4-alpha-D-Glucan|1,4-alpha-D-glucan|4-{(1,4)-alpha-D-Glucosyl}(n-1)-D-glucose|4-{(1,4)-alpha-D-glucosyl}(n-1)-D-glucose http://purl.obolibrary.org/obo/CHEBI_15444 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15446 biolink:ChemicalEntity [(1->4)-alpha-D-galacturonosyl]n kegg.compound:C00470|kegg.glycan:G10506 Graph (1,4-alpha-D-Galacturonosyl)n|(1,4-alpha-D-Galacturonosyl)n+1|(1,4-alpha-D-galacturonosyl)n (1,4-alpha-D-Galacturonosyl)n|(1,4-alpha-D-Galacturonosyl)n+1|(1,4-alpha-D-galacturonosyl)n http://purl.obolibrary.org/obo/CHEBI_15446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15447 biolink:ChemicalEntity (1->4)-beta-D-xylan A xylan compound with β-(1→4)-linkages between each xylose. cas:9014-63-5|kegg.compound:C02352|kegg.compound:C06016 Graph (1,4-beta-D-Xylan)n|(1,4-beta-D-xylan)(n)|(1,4-beta-D-xylan)n|(1->4)-beta-D-xylopyranan|1,4-beta-D-Xylan|1,4beta-D-xylan|pentosan (1->4)-beta-D-xylopyranan (1,4-beta-D-Xylan)n|(1,4-beta-D-xylan)(n)|(1,4-beta-D-xylan)n|(1->4)-beta-D-xylopyranan|1,4-beta-D-Xylan|1,4beta-D-xylan|pentosan http://purl.obolibrary.org/obo/CHEBI_15447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15448 biolink:ChemicalEntity (1-hydroxycyclohexyl)acetyl-CoA A 3-hydroxyacyl-CoA having (1-hydroxycyclohexyl)acetyl as the S-acyl group. kegg.compound:C04316 Graph (1-Hydroxycyclohexan-1-yl)acetyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(1-hydroxycyclohexyl)acetyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(1-hydroxycyclohexyl)acetyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (1-Hydroxycyclohexan-1-yl)acetyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(1-hydroxycyclohexyl)acetyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15449 biolink:ChemicalEntity (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA An (S)-3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (2S,3S)-3-hydroxy-2-methylbutanoic acid. kegg.compound:C04405|pubmed:23351063 Graph (2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA|(2S,3S)-3-hydroxy-2-methylbutanoyl-coenzyme A|(S)-3-Hydroxy-2-methylbutyryl-CoA|(S,S)-3-hydroxy-2-methylbutanoyl-coenzyme A|(S,S)-3-hydroxy-2-methylbutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S,3S)-3-hydroxy-2-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S,3S)-3-hydroxy-2-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA|(2S,3S)-3-hydroxy-2-methylbutanoyl-coenzyme A|(S)-3-Hydroxy-2-methylbutyryl-CoA|(S,S)-3-hydroxy-2-methylbutanoyl-coenzyme A|(S,S)-3-hydroxy-2-methylbutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S,3S)-3-hydroxy-2-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15450 biolink:ChemicalEntity (2R)-2-methylacyl-CoA kegg.compound:C05329 Graph (2R)-2-Methylacyl-CoA|(2R)-2-methylacyl-CoAs (2R)-2-Methylacyl-CoA|(2R)-2-methylacyl-CoAs http://purl.obolibrary.org/obo/CHEBI_15450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15451 biolink:ChemicalEntity (2S)-2-methylacyl-CoA kegg.compound:C05232 Graph (2S)-2-Methylacyl-CoA|(2S)-2-methylacyl-CoAs (2S)-2-Methylacyl-CoA|(2S)-2-methylacyl-CoAs http://purl.obolibrary.org/obo/CHEBI_15451 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15452 biolink:ChemicalEntity (R)-3-hydroxybutanoyl-CoA The (R)-enantiomer of 3-hydroxybutanoyl-CoA. kegg.compound:C03561 Graph (3R)-3-Hydroxybutanoyl-CoA|(R)-3-Hydroxybutanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3R)-3-Hydroxybutanoyl-CoA|(R)-3-Hydroxybutanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15453 biolink:ChemicalEntity (S)-3-hydroxybutanoyl-CoA kegg.compound:C01144|umbbd.compound:c0030 Graph (3S)-3-hydroxybutanoyl-CoA|(S)-3-Hydroxybutanoyl-CoA|(S)-3-Hydroxybutyryl-CoA|(S)-3-hydroxybutyroyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L(+)-3-hydroxybutyroyl-CoA|L(+)-beta-hydroxybutyroyl-CoA|L-3-hydroxybutanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3S)-3-hydroxybutanoyl-CoA|(S)-3-Hydroxybutanoyl-CoA|(S)-3-Hydroxybutyryl-CoA|(S)-3-hydroxybutyroyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L(+)-3-hydroxybutyroyl-CoA|L(+)-beta-hydroxybutyroyl-CoA|L-3-hydroxybutanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15454 biolink:ChemicalEntity (3S)-3-carboxy-3-hydroxypropanoyl-CoA A 3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the 3-carboxy group of (3S)-3-carboxy-3-hydroxypropanoic acid. kegg.compound:C04348|pubmed:11418572|pubmed:18083850|pubmed:20047909|pubmed:6381479|pubmed:8354269 Graph (3S)-3-Carboxy-3-hydroxypropanoyl-CoA|(3S)-3-Carboxy-3-hydroxypropionyl-CoA|(3S)-3-carboxy-3-hydroxypropanoyl-coenzyme A|(3S)-3-carboxy-3-hydroxypropionyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3-carboxy-3-hydroxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L-Malyl-CoA|Malyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3-carboxy-3-hydroxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3S)-3-Carboxy-3-hydroxypropanoyl-CoA|(3S)-3-Carboxy-3-hydroxypropionyl-CoA|(3S)-3-carboxy-3-hydroxypropanoyl-coenzyme A|(3S)-3-carboxy-3-hydroxypropionyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3-carboxy-3-hydroxypropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L-Malyl-CoA|Malyl-CoA http://purl.obolibrary.org/obo/CHEBI_15454 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15455 biolink:ChemicalEntity (S)-3-hydroxyacyl-CoA kegg.compound:C00640 Graph (3S)-3-Hydroxyacyl-CoA|(3S)-3-hydroxyacyl-CoAs|(S)-3-Hydroxyacyl-CoA (3S)-3-Hydroxyacyl-CoA|(3S)-3-hydroxyacyl-CoAs|(S)-3-Hydroxyacyl-CoA http://purl.obolibrary.org/obo/CHEBI_15455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15456 biolink:ChemicalEntity (R)-3-hydroxyacyl-CoA kegg.compound:C01086 Graph (3R)-3-Hydroxyacyl-CoA|(R)-3-Hydroxyacyl-CoA (3R)-3-Hydroxyacyl-CoA|(R)-3-Hydroxyacyl-CoA http://purl.obolibrary.org/obo/CHEBI_15456 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15457 biolink:ChemicalEntity citramalyl-CoA An acyl-CoA having citramalyl as the S-acyl group. kegg.compound:C00904 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxy-3-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Citramalyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxy-3-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxy-3-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Citramalyl-CoA http://purl.obolibrary.org/obo/CHEBI_15457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15459 biolink:ChemicalEntity (3S)-citryl-CoA An (S)-3-hydroxyacyl-CoA having (3S)-citryl as the S-acyl group kegg.compound:C00566|lipidmaps:LMFA07050120|pubmed:6812626|pubmed:6838572|pubmed:6861748|pubmed:7227518 Graph (3S)-Citryl-CoA|(3S)-citryl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3S)-Citryl-CoA|(3S)-citryl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-3,4-dicarboxy-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15459 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15463 biolink:ChemicalEntity cinnamoyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of cinnamic acid. kegg.compound:C00540|knapsack:C00007263|pubmed:11851410|pubmed:1426272|pubmed:15870094|pubmed:8136368|reaxys:18909906 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-phenylprop-2-enoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-phenylacryloyl-CoA|3-phenylacryloyl-coenzyme A|3-phenylprop-2-enoyl-coenzyme A|Cinnamoyl-CoA|benzylideneacetyl-CoA|benzylideneacetyl-coenzyme A|beta-phenylacryloyl-CoA|beta-phenylacryloyl-coenzyme A|cinnamoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-phenylprop-2-enoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-phenylprop-2-enoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-phenylacryloyl-CoA|3-phenylacryloyl-coenzyme A|3-phenylprop-2-enoyl-coenzyme A|Cinnamoyl-CoA|benzylideneacetyl-CoA|benzylideneacetyl-coenzyme A|beta-phenylacryloyl-CoA|beta-phenylacryloyl-coenzyme A|cinnamoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15463 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15464 biolink:ChemicalEntity (E,E)-piperonyl-CoA kegg.compound:C02611 Graph (E,E)-Piperoyl-CoA|(E,E)-piperoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,4E)-5-(2H-1,3-benzodioxol-5-yl)penta-2,4-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,4E)-5-(2H-1,3-benzodioxol-5-yl)penta-2,4-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (E,E)-Piperoyl-CoA|(E,E)-piperoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,4E)-5-(2H-1,3-benzodioxol-5-yl)penta-2,4-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15464 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15465 biolink:ChemicalEntity (R)-methylmalonyl-CoA The (R)-enantiomer of methylmalonyl-CoA. drugbank:DB04045|kegg.compound:C01213|pdb-ccd:MCA Graph (R)-2-Methyl-3-oxopropanoyl-CoA|(R)-2-Methyl-3-oxopropionyl-CoA|(R)-3-Oxo-2-methylpropanoyl-CoA|(R)-Methylmalonyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2R)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|METHYLMALONYL-COENZYME A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2R)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (R)-2-Methyl-3-oxopropanoyl-CoA|(R)-2-Methyl-3-oxopropionyl-CoA|(R)-3-Oxo-2-methylpropanoyl-CoA|(R)-Methylmalonyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2R)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|METHYLMALONYL-COENZYME A http://purl.obolibrary.org/obo/CHEBI_15465 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15466 biolink:ChemicalEntity (S)-methylmalonyl-CoA The (S)-enantiomer of methylmalonyl-CoA. kegg.compound:C00683 Graph (S)-2-Methyl-3-oxopropanoyl-CoA|(S)-2-Methyl-3-oxopropionyl-CoA|(S)-3-oxo-2-methylpropanoyl-CoA|(S)-Methylmalonyl-CoA|(S)-Methylmalonyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (S)-2-Methyl-3-oxopropanoyl-CoA|(S)-2-Methyl-3-oxopropionyl-CoA|(S)-3-oxo-2-methylpropanoyl-CoA|(S)-Methylmalonyl-CoA|(S)-Methylmalonyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15466 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15467 biolink:ChemicalEntity (3S)-3-hydroxy-3-methylglutaryl-CoA A 3-hydroxy-3-methylglutaryl-CoA where the 3-hydroxy-3-methylglutaryl component has (S)-configuration. cas:1553-55-5|kegg.compound:C00356|knapsack:C00007270|pdb-ccd:HMG|pubmed:20640529|pubmed:4052443|pubmed:6135457|pubmed:9160173 Graph (3S)-3-hydroxy-3-methylglutaryl-coenzyme A|(S)-3-Hydroxy-3-methylglutaryl-CoA|(S)-3-hydroxy-3-methylglutaryl-CoA|(S)-3-hydroxy-3-methylglutaryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-4-carboxy-3-hydroxy-3-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxy-3-methylglutaryl-CoA|HMG-CoA|HMG-coenzyme A|Hydroxymethylglutaroyl coenzyme A|Hydroxymethylglutaryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-4-carboxy-3-hydroxy-3-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3S)-3-hydroxy-3-methylglutaryl-coenzyme A|(S)-3-Hydroxy-3-methylglutaryl-CoA|(S)-3-hydroxy-3-methylglutaryl-CoA|(S)-3-hydroxy-3-methylglutaryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3S)-4-carboxy-3-hydroxy-3-methylbutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxy-3-methylglutaryl-CoA|HMG-CoA|HMG-coenzyme A|Hydroxymethylglutaroyl coenzyme A|Hydroxymethylglutaryl-CoA http://purl.obolibrary.org/obo/CHEBI_15467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15468 biolink:ChemicalEntity 3'-dephospho-CoA An adenosine 5'-phosphate that is coenzyme A in which the phosphate group at position 3' has been replaced by a hydrogen atom. It is an intermediate metabolite in pantothenate and CoA biosynthesis. cas:3633-59-8|drugbank:DB03170|ecmdb:ECMDB01373|foodb.food:FDB022585|hmdb:HMDB0001373|kegg.compound:C00882|knapsack:C00007257|lipidmaps:LMFA07050315|pdb-ccd:COD|pubmed:10205156|pubmed:11052675|pubmed:15526298|pubmed:19876400|pubmed:21264299|pubmed:21904046|pubmed:24817720|pubmed:25449315|pubmed:27383794|pubmed:28648615|pubmed:30018019|pubmed:31337720|pubmed:4880|ymdb:YMDB00664 Graph Dephospho-CoA|Dephosphocoenzyme A|adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|dephospho coenzyme A adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} Dephospho-CoA|Dephosphocoenzyme A|adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|dephospho coenzyme A http://purl.obolibrary.org/obo/CHEBI_15468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15469 biolink:ChemicalEntity alk-2-enoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any α,β-unsaturated fatty acid. kegg.compound:C00605 Graph 2,3-Dehydroacyl-CoA|2,3-dehydroacyl-CoAs|2,3-didehydroacyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(alk-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Dehydroacyl-CoA|alk-2-enoyl-CoAs 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(alk-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2,3-Dehydroacyl-CoA|2,3-dehydroacyl-CoAs|2,3-didehydroacyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(alk-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Dehydroacyl-CoA|alk-2-enoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_15469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1547 biolink:ChemicalEntity 3-hydroxykynurenine A hydroxykynurenine that is kynurenine substituted by a hydroxy group at position 3. cas:484-78-6|hmdb:HMDB0000732|kegg.compound:C02794|pubmed:11477208|pubmed:15206726|reaxys:2697635 Graph 2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid|3-(2-amino-3-hydroxybenzoyl)alanine|3-(3-hydroxyanthraniloyl)alanine|3-Hydroxy-DL-kynurenine|3-Hydroxykynurenine 3-(2-amino-3-hydroxybenzoyl)alanine 2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid|3-(2-amino-3-hydroxybenzoyl)alanine|3-(3-hydroxyanthraniloyl)alanine|3-Hydroxy-DL-kynurenine|3-Hydroxykynurenine http://purl.obolibrary.org/obo/CHEBI_1547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15470 biolink:ChemicalEntity 2,4-dichlorobenzoyl-CoA A dichlorobenzoyl-CoA having 2,4-dichlorobenzoyl as the S-acyl group. kegg.compound:C06671|pubmed:8626335|umbbd.compound:c0189 Graph 2,4-Dichlorobenzoyl-CoA|2,4-dichlorobenzoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2,4-dichlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2,4-dichlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2,4-Dichlorobenzoyl-CoA|2,4-dichlorobenzoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2,4-dichlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15471 biolink:ChemicalEntity trans-dodec-2-enoyl-CoA An acyl-CoA having trans-dodec-2-enoyl as the S-acyl group. kegg.compound:C03221 Graph (2E)-Dodec-2-enoyl-CoA|(2E)-Dodecenoyl-CoA|2-trans-Dodecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (2E)-Dodec-2-enoyl-CoA|(2E)-Dodecenoyl-CoA|2-trans-Dodecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-dodec-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15472 biolink:ChemicalEntity anthraniloyl-CoA A member of the class of benzoyl-CoAs having 2-aminobenzoyl as the S-acyl group. kegg.compound:C02247|pdb-ccd:COW|pubmed:12054436|pubmed:18083812|pubmed:19694421|pubmed:7607242|reaxys:11086248 Graph 2-Aminobenzoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-aminobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Anthranilyl-CoA|anthraniloyl-coenzyme A|anthranilyl-CoA|anthranilyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-aminobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-Aminobenzoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-aminobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Anthranilyl-CoA|anthraniloyl-coenzyme A|anthranilyl-CoA|anthranilyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15473 biolink:ChemicalEntity crotonoyl-CoA The (E)-isomer of but-2-enoyl-CoA. kegg.compound:C00877|pdb-ccd:COO|umbbd.compound:c0032 Graph (E)-but-2-enoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-but-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Crotonoyl-CoA|Crotonyl-CoA|trans-But-2-enoyl-CoA|trans-butyr-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-but-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (E)-but-2-enoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-but-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Crotonoyl-CoA|Crotonyl-CoA|trans-But-2-enoyl-CoA|trans-butyr-2-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15474 biolink:ChemicalEntity 2-furoyl-CoA An acyl-CoA having 2-furoyl as the S-acyl group. kegg.compound:C00845|pubmed:16347977|pubmed:2170335|pubmed:4318274|pubmed:4655411|reaxys:20380491 Graph 2-Furoyl-CoA|2-furoyl-coenzyme A|2-furylformyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(furan-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(furan-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-Furoyl-CoA|2-furoyl-coenzyme A|2-furylformyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(furan-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15475 biolink:ChemicalEntity 2-hydroxyphytanoyl-CoA A multi-methyl-branched fatty acyl-CoA having 2-hydroxyphytanoyl as the S-acyl group. hmdb:HMDB0001295|kegg.compound:C07343|pubmed:11341778|pubmed:16796018|pubmed:7556205|pubmed:8954107|pubmed:9266824|pubmed:9374128|pubmed:9375802 Graph 2-Hydroxyphytanoyl-CoA|2-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA|2-hydroxy-3,7,11,15-tetramethylhexadecanoyl-coenzyme A|2-hydroxyphytanoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|alpha-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA|alpha-hydroxy-3,7,11,15-tetramethylhexadecanoyl-coenzyme A|alpha-hydroxyphytanoyl-CoA|alpha-hydroxyphytanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-Hydroxyphytanoyl-CoA|2-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA|2-hydroxy-3,7,11,15-tetramethylhexadecanoyl-coenzyme A|2-hydroxyphytanoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|alpha-hydroxy-3,7,11,15-tetramethylhexadecanoyl-CoA|alpha-hydroxy-3,7,11,15-tetramethylhexadecanoyl-coenzyme A|alpha-hydroxyphytanoyl-CoA|alpha-hydroxyphytanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15476 biolink:ChemicalEntity 2-methylacetoacetyl-CoA A 3-oxoacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-methylacetoacetic acid. kegg.compound:C03344|pubmed:1861461|pubmed:8849116|pubmed:9323571 Graph 2-Methyl-3-acetoacetyl-CoA|2-Methylacetoacetyl-CoA|2-methyl-3-acetoacetyl-CoA|2-methyl-3-acetoacetyl-coenzyme A|2-methylacetoacetyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 2-Methyl-3-acetoacetyl-CoA|2-Methylacetoacetyl-CoA|2-methyl-3-acetoacetyl-CoA|2-methyl-3-acetoacetyl-coenzyme A|2-methylacetoacetyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15476 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15477 biolink:ChemicalEntity 2-methylbutanoyl-CoA A short-chain, methyl-branched fatty acyl-CoA having 2-methylbutanoyl as the S-acyl group. hmdb:HMDB0001041|kegg.compound:C01033|metacyc.compound:2-METHYL-BUTYRYL-COA|pubmed:17335222 Graph 2-Methylbutanoyl-CoA|2-Methylbutyryl-CoA|2-methylbutanoyl-coenzyme A|2-methylbutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|S-(2-methylbutanoyl)-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 2-Methylbutanoyl-CoA|2-Methylbutyryl-CoA|2-methylbutanoyl-coenzyme A|2-methylbutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|S-(2-methylbutanoyl)-CoA http://purl.obolibrary.org/obo/CHEBI_15477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15478 biolink:ChemicalEntity 2-methylcrotonoyl-CoA kegg.compound:C03345 Graph (E)-2-Methylcrotonoyl-CoA|2-Methylcrotanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-2-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|Methylcrotonoyl-CoA|Methylcrotonyl-CoA|Tigloyl-CoA|Tiglyl-CoA|trans-2-Methylbut-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-2-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (E)-2-Methylcrotonoyl-CoA|2-Methylcrotanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-2-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|Methylcrotonoyl-CoA|Methylcrotonyl-CoA|Tigloyl-CoA|Tiglyl-CoA|trans-2-Methylbut-2-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15479 biolink:ChemicalEntity isobutyryl-CoA A short-chain, methyl-branched fatty acyl-CoA that is the S-isobutyryl derivative of coenzyme A. cas:15621-60-0|hmdb:HMDB0001243|kegg.compound:C00630|metacyc.compound:ISOBUTYRYL-COA|pdb-ccd:CO6|pubmed:12359132|pubmed:17304052|pubmed:17955482|pubmed:3756180|pubmed:8557569|reaxys:78216|wikipedia.en:Isobutyryl-CoA Graph 2-Methylpropanoyl-CoA|2-Methylpropionyl-CoA|2-methylpropionyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|Isobutyryl-CoA|isobutanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 2-Methylpropanoyl-CoA|2-Methylpropionyl-CoA|2-methylpropionyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|Isobutyryl-CoA|isobutanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15480 biolink:ChemicalEntity 3-(4-methylpent-3-en-1-yl)pent-2-enedioyl-CoA kegg.compound:C01291 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[7-methyl-3-(2-oxoethyl)octa-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|3-(4-Methylpent-3-en-1-yl)-pent-2-enedioyl-CoA|Isohexenyl-glutaconyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[7-methyl-3-(2-oxoethyl)octa-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[7-methyl-3-(2-oxoethyl)octa-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|3-(4-Methylpent-3-en-1-yl)-pent-2-enedioyl-CoA|Isohexenyl-glutaconyl-CoA http://purl.obolibrary.org/obo/CHEBI_15480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15481 biolink:ChemicalEntity 3-hydroxy-2-methylpropanoyl-CoA kegg.compound:C04047 Graph 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|3-Hydroxy-2-methylpropanoyl-CoA|3-Hydroxy-2-methylpropionyl-CoA|3-Hydroxyisobutyryl coenzyme A|3-Hydroxyisobutyryl-CoA 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxy-2-methylpropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|3-Hydroxy-2-methylpropanoyl-CoA|3-Hydroxy-2-methylpropionyl-CoA|3-Hydroxyisobutyryl coenzyme A|3-Hydroxyisobutyryl-CoA http://purl.obolibrary.org/obo/CHEBI_15481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15483 biolink:ChemicalEntity 3-hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA The S-3-hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl derivative of CoA. kegg.compound:C04675 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-(carboxymethyl)-3-hydroxy-7-methyloct-6-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-(carboxymethyl)-3-hydroxy-7-methyloct-6-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-(carboxymethyl)-3-hydroxy-7-methyloct-6-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA http://purl.obolibrary.org/obo/CHEBI_15483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15484 biolink:ChemicalEntity 3-hydroxybenzoyl-CoA A hydroxybenzoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 3-hydroxybenzoic acid. kegg.compound:C05195|pubmed:10816048|pubmed:11222587|pubmed:12076800|pubmed:12846828|pubmed:18156265|pubmed:19710020|pubmed:8335640 Graph 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|3-Hydroxybenzoyl-CoA|3-hydroxybenzoyl-coenzyme A|m-hydroxybenzoyl-CoA|m-hydroxybenzoyl-coenzyme A 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate] 3'-phosphoadenosine 5'-[3-(3-hydroxy-4-{[3-({2-[(3-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate]|3-Hydroxybenzoyl-CoA|3-hydroxybenzoyl-coenzyme A|m-hydroxybenzoyl-CoA|m-hydroxybenzoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15485 biolink:ChemicalEntity 3-hydroxypimeloyl-CoA A 3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-hydroxypimelic acid. kegg.compound:C06714|umbbd.compound:c0220 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxypimeloyl-CoA|3-Hydroxypimelyl-CoA|3-hydroxypimeloyl-coenzyme A|3-hydroxypimelyl-coenzyme A|S-(6-carboxy-3-hydroxyhexanoyl)-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-hydroxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxypimeloyl-CoA|3-Hydroxypimelyl-CoA|3-hydroxypimeloyl-coenzyme A|3-hydroxypimelyl-coenzyme A|S-(6-carboxy-3-hydroxyhexanoyl)-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15486 biolink:ChemicalEntity 3-methylbut-2-enoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-methylbut-2-enoic acid. kegg.compound:C03069|pubmed:15619721|reaxys:78242 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|3,3-dimethacrylyl-CoA|3,3-dimethacrylyl-coenzyme A|3-Methylbut-2-enoyl-CoA|3-Methylcrotonoyl-CoA|3-Methylcrotonyl-CoA|DMA-CoA|Dimethylacryloyl-CoA|S-(3-Methyl-crotonoyl)-coenzym-A|S-(3-methylcrotonoyl)-coenzyme-A|beta,beta-dimethacrylyl-CoA|beta,beta-dimethacrylyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|3,3-dimethacrylyl-CoA|3,3-dimethacrylyl-coenzyme A|3-Methylbut-2-enoyl-CoA|3-Methylcrotonoyl-CoA|3-Methylcrotonyl-CoA|DMA-CoA|Dimethylacryloyl-CoA|S-(3-Methyl-crotonoyl)-coenzym-A|S-(3-methylcrotonoyl)-coenzyme-A|beta,beta-dimethacrylyl-CoA|beta,beta-dimethacrylyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15486 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15487 biolink:ChemicalEntity isovaleryl-CoA A methylbutanoyl-CoA is the S-isovaleryl derivative of coenzyme A. cas:6244-91-3|chemspider:145017|foodb.food:FDB022430|hmdb:HMDB0001113|kegg.compound:C02939|lipidmaps:LMFA07050336|pdb-ccd:IVC|pubmed:11402190|pubmed:15619721|pubmed:15698607|pubmed:18846531|pubmed:25450250|pubmed:26134562|pubmed:26318610|pubmed:27271456|pubmed:27940564|pubmed:28784791|pubmed:6928646|reaxys:78268|wikipedia.en:Isovaleryl-CoA Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|3-Methylbutanoyl-CoA|3-methylbutanoyl-coenzyme A|3-methylbutyryl-CoA|3-methylbutyryl-coenzyme A|Isovaleryl-CoA|S-(3-methylbutanoyl)-coenzyme A|beta-methylbutanoyl-CoA|beta-methylbutanoyl-coenzyme A|beta-methylbutyryl-CoA|beta-methylbutyryl-coenzyme A|isovaleryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|3-Methylbutanoyl-CoA|3-methylbutanoyl-coenzyme A|3-methylbutyryl-CoA|3-methylbutyryl-coenzyme A|Isovaleryl-CoA|S-(3-methylbutanoyl)-coenzyme A|beta-methylbutanoyl-CoA|beta-methylbutanoyl-coenzyme A|beta-methylbutyryl-CoA|beta-methylbutyryl-coenzyme A|isovaleryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15488 biolink:ChemicalEntity trans-3-methylglutaconyl-CoA The S-(trans-3-methylglutaconyl) derivative of coenzyme A. cas:6247-73-0|foodb.food:FDB022396|hmdb:HMDB0001057|kegg.compound:C03231|lipidmaps:LMFA07050388|pubmed:10896289|pubmed:15192029|pubmed:16482430|pubmed:16640564|pubmed:23225771|pubmed:27271456|pubmed:29742810|pubmed:3071703|pubmed:32431008|pubmed:32914510|pubmed:33280817|pubmed:3841150|wikipedia.en:3-Methylglutaconyl-CoA Graph (E)-3-methylglutaconyl-1-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxy-3-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Methylglutaconyl-CoA|3-methylglutaconyl CoA|S-3-methylglutaconyl-coenzyme A|trans-3-Methylglutaconyl-CoA|trans-3-methylglutaconyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxy-3-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (E)-3-methylglutaconyl-1-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxy-3-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Methylglutaconyl-CoA|3-methylglutaconyl CoA|S-3-methylglutaconyl-coenzyme A|trans-3-Methylglutaconyl-CoA|trans-3-methylglutaconyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15489 biolink:ChemicalEntity 3-oxo-fatty acyl-CoA An oxo fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any 3-oxo-fatty acid.. kegg.compound:C00264|pubmed:11315193|pubmed:11418601|pubmed:11879205|pubmed:7957058|pubmed:8541311 Graph 3-Oxoacyl-CoA|3-oxo fatty acyl-CoAs|3-oxo fatty acyl-coenzyme A 3-Oxoacyl-CoA|3-oxo fatty acyl-CoAs|3-oxo fatty acyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1549 biolink:ChemicalEntity 3-hydroxymonocarboxylic acid kegg.compound:C03834 Graph 3-Hydroxymonocarboxylic acid 3-Hydroxymonocarboxylic acid http://purl.obolibrary.org/obo/CHEBI_1549 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15490 biolink:ChemicalEntity 3-oxoadipyl-CoA The S-(3-oxoadipyl) derivative of coenzyme A. kegg.compound:C02232 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-oxopentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Oxoadipyl-CoA|S-(5-carboxy-3-oxopentanoyl)-coenzyme A|beta-Ketoadipyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-oxopentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-oxopentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Oxoadipyl-CoA|S-(5-carboxy-3-oxopentanoyl)-coenzyme A|beta-Ketoadipyl-CoA http://purl.obolibrary.org/obo/CHEBI_15490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15491 biolink:ChemicalEntity 3-oxopalmitoyl-CoA The S-(3-oxopalmitoyl) derivative of coenzyme A. kegg.compound:C05259 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Ketopalmitoyl-CoA|3-Oxohexadecanoyl-CoA|3-Oxopalmitoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Ketopalmitoyl-CoA|3-Oxohexadecanoyl-CoA|3-Oxopalmitoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15491 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15492 biolink:ChemicalEntity 3-oxopimeloyl-CoA The S-(3-oxopimeloyl) derivative of coenzyme A. kegg.compound:C06715|umbbd.compound:c0221 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-oxohexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Ketopimelyl-CoA|3-Oxopimeloyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-oxohexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxy-3-oxohexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Ketopimelyl-CoA|3-Oxopimeloyl-CoA http://purl.obolibrary.org/obo/CHEBI_15492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15493 biolink:ChemicalEntity 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α,12α-trihydroxy-5β-cholestan-26-oic acid and coenzyme A. cas:57458-60-3|kegg.compound:C04760|pubmed:12966071|pubmed:1351423|pubmed:3183523|pubmed:8301225|pubmed:8694830 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3,7,12-Trihydroxy-5beta-cholestanoyl-CoA|3,7,12-Trihydroxycholestan-26-oyl-coa|3,7,12-trihydroxycoprostanoyl-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-oyl-|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-coenzyme A|3alpha,7alpha,12alpha-trihydroxycoprostanoyl-CoA|S-(3alpha,5beta,7alpha,12alpha)-3,7,12-Trihydroxycholestane-26-thioate|S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl)-coenzyme A|THCA-CoA|Thca-CoA|trihydroxycoprostanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3,7,12-Trihydroxy-5beta-cholestanoyl-CoA|3,7,12-Trihydroxycholestan-26-oyl-coa|3,7,12-trihydroxycoprostanoyl-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-oyl-|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-coenzyme A|3alpha,7alpha,12alpha-trihydroxycoprostanoyl-CoA|S-(3alpha,5beta,7alpha,12alpha)-3,7,12-Trihydroxycholestane-26-thioate|S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl)-coenzyme A|THCA-CoA|Thca-CoA|trihydroxycoprostanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15494 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α-dihydroxy-5β-cholestan-26-oic acid and coenzyme A. kegg.compound:C04644|pubmed:3183523 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15495 biolink:ChemicalEntity 4,8,12-trimethyltridecanoyl-CoA A multi-methyl-branched fatty acyl-CoA that is the S-(4,8,12-trimethyltridecanoyl) derivative of coenzyme A. kegg.compound:C07296 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(4,8,12-trimethyltridecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|4,8,12-TMTD-CoA|4,8,12-Trimethyltridecanoyl-CoA|4,8,12-trimethyltridecanoyl-coenzyme A|4,8,12-trimethyltridecylyl-CoA|4,8,12-trimethyltridecylyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(4,8,12-trimethyltridecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(4,8,12-trimethyltridecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|4,8,12-TMTD-CoA|4,8,12-Trimethyltridecanoyl-CoA|4,8,12-trimethyltridecanoyl-coenzyme A|4,8,12-trimethyltridecylyl-CoA|4,8,12-trimethyltridecylyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15496 biolink:ChemicalEntity 4-aminobutanoyl-CoA An aminobutanoyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 4-aminobutanoic acid. kegg.compound:C02801 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Aminobutanoyl-CoA|4-aminobutanoyl-coenzyme A|4-butyryl-CoA|4-butyryl-coenzyme A|GABA-CoA|GABA-coenzyme A|gamma-aminobutanoyl-CoA|gamma-aminobutanoyl-coenzyme A|gamma-aminobutyryl-CoA|gamma-aminobutyryl-coenzyme A|omega-aminobutyryl-CoA|omega-aminobutyryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Aminobutanoyl-CoA|4-aminobutanoyl-coenzyme A|4-butyryl-CoA|4-butyryl-coenzyme A|GABA-CoA|GABA-coenzyme A|gamma-aminobutanoyl-CoA|gamma-aminobutanoyl-coenzyme A|gamma-aminobutyryl-CoA|gamma-aminobutyryl-coenzyme A|omega-aminobutyryl-CoA|omega-aminobutyryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15496 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15497 biolink:ChemicalEntity trans-4-carboxybut-2-enoyl-CoA The S-(trans-4-carboxybut-2-enoyl) derivative of coenzyme A. kegg.compound:C02411|umbbd.compound:c0227 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxybut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Carboxybut-2-enoyl-CoA|Glutaconyl-1-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxybut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-4-carboxybut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Carboxybut-2-enoyl-CoA|Glutaconyl-1-CoA http://purl.obolibrary.org/obo/CHEBI_15497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15498 biolink:ChemicalEntity 4-chlorobenzoyl-CoA A chlorobenzoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 4-chlorobenzoic acid cas:117380-98-0|kegg.compound:C06387|pubmed:8218302|umbbd.compound:c0190 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-chlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Cba-coa|4-Chlorobenzoyl coa|4-Chlorobenzoyl coenzyme A|4-Chlorobenzoyl-CoA|Coenzyme A, S-(4-chlorobenzoate) 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-chlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-chlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Cba-coa|4-Chlorobenzoyl coa|4-Chlorobenzoyl coenzyme A|4-Chlorobenzoyl-CoA|Coenzyme A, S-(4-chlorobenzoate) http://purl.obolibrary.org/obo/CHEBI_15498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15499 biolink:ChemicalEntity 4-coumaroyl-CoA The S-(4-coumaroyl) derivative of coenzyme A. kegg.compound:C00223|knapsack:C00007280|reaxys:7683149 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Coumaroyl-CoA|4-Coumaroyl-coa|4-Coumaroyl-coenzyme A|4-Hydroxycinnamoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Coumaroyl-CoA|4-Coumaroyl-coa|4-Coumaroyl-coenzyme A|4-Hydroxycinnamoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15500 biolink:ChemicalEntity 4-hydroxybenzoyl-CoA A hydroxybenzoyl-CoA that is the S-(4-hydroxybenzoyl) derivative of coenzyme A. cas:27718-41-8|drugbank:DB01652|kegg.compound:C02949|pubmed:12232327|pubmed:17449613|pubmed:18539747|pubmed:9047322|reaxys:8399070|umbbd.compound:c0124 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Hydroxybenzoyl-CoA|4-Hydroxybenzoyl-coa|4-Hydroxybenzoyl-coenzyme A|Coenzyme A, S-(4-hydroxybenzoate)|S-(4-hydroxybenzoyl)-CoA|p-hydroxybenzoyl-CoA|p-hydroxybenzoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Hydroxybenzoyl-CoA|4-Hydroxybenzoyl-coa|4-Hydroxybenzoyl-coenzyme A|Coenzyme A, S-(4-hydroxybenzoate)|S-(4-hydroxybenzoyl)-CoA|p-hydroxybenzoyl-CoA|p-hydroxybenzoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15501 biolink:ChemicalEntity 5-hydroxypentanoyl-CoA An acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 5-hydroxypentanoic acid. kegg.compound:C03237|pubmed:2029896|pubmed:2085413|pubmed:3597403 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|5-Hydroxy-pentanoyl-CoA|5-hydroxypentanoyl-coenzyme A|5-hydroxyvaleryl-CoA|5-hydroxyvaleryl-coenzyme A|delta-hydroxypentanoyl-CoA|delta-hydroxypentanoyl-coenzyme A|delta-hydroxyvaleryl-CoA|delta-hydroxyvaleryl-coenzyme A|omega-hydroxypentanoyl-CoA|omega-hydroxypentanoylcoenzyme A|omega-hydroxyvaleryl-CoA|omega-hydroxyvaleryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|5-Hydroxy-pentanoyl-CoA|5-hydroxypentanoyl-coenzyme A|5-hydroxyvaleryl-CoA|5-hydroxyvaleryl-coenzyme A|delta-hydroxypentanoyl-CoA|delta-hydroxypentanoyl-coenzyme A|delta-hydroxyvaleryl-CoA|delta-hydroxyvaleryl-coenzyme A|omega-hydroxypentanoyl-CoA|omega-hydroxypentanoylcoenzyme A|omega-hydroxyvaleryl-CoA|omega-hydroxyvaleryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15502 biolink:ChemicalEntity 5-hydroxythiophene-2-carbonyl-CoA An acyl-CoA that is the S-(5-hydroxythiophene-2-carbonyl) derivative of coenzyme A. kegg.compound:C07348 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxythiophene-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|5-Hydroxythiophene-2-carbonyl-CoA|5-hydroxythiophene-2-carbonyl-coenzyme A|S-(5-hydroxythiophene-2-carbonyl)-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxythiophene-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(5-hydroxythiophene-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|5-Hydroxythiophene-2-carbonyl-CoA|5-hydroxythiophene-2-carbonyl-coenzyme A|S-(5-hydroxythiophene-2-carbonyl)-CoA http://purl.obolibrary.org/obo/CHEBI_15502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15503 biolink:ChemicalEntity 2,3-didehydropimeloyl-CoA The S-(2,3-didehydropimeloyl) derivative of coenzyme A. kegg.compound:C06723|umbbd.compound:c0219 Graph 2,3-Didehydro-pimeloyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhex-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Carboxyhex-2-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhex-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2,3-Didehydro-pimeloyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhex-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Carboxyhex-2-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15504 biolink:ChemicalEntity pimeloyl-CoA An ω carboxyacyl-CoA that is the S-pimeloyl derivative of coenzyme A. cas:18907-20-5|kegg.compound:C01063|knapsack:C00019680|pubmed:11320134|pubmed:11322938|pubmed:11904168|pubmed:1445232|pubmed:18396082|pubmed:7383976|pubmed:8125118|reaxys:11263685|umbbd.compound:c0218 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Carboxyhexanoyl-CoA|Coenzyme A, S-(hydrogen heptanedioate)|Pimeloyl-CoA|Pimeloyl-coa|Pimeloyl-coenzyme A|Pimelyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(6-carboxyhexanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Carboxyhexanoyl-CoA|Coenzyme A, S-(hydrogen heptanedioate)|Pimeloyl-CoA|Pimeloyl-coa|Pimeloyl-coenzyme A|Pimelyl-CoA http://purl.obolibrary.org/obo/CHEBI_15504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15505 biolink:ChemicalEntity 6-hydroxycyclohex-1-ene-1-carbonyl-CoA The S-(6-hydroxycyclohex-1-ene-1-carbonyl) derivative of coenzyme A. kegg.compound:C06749|umbbd.compound:c0230 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(6-hydroxycyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Hydroxycyclohex-1-ene-1-carboxyl-CoA|6-Hydroxycyclohex-1-enecarbonyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(6-hydroxycyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(6-hydroxycyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|6-Hydroxycyclohex-1-ene-1-carboxyl-CoA|6-Hydroxycyclohex-1-enecarbonyl-CoA http://purl.obolibrary.org/obo/CHEBI_15505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15507 biolink:ChemicalEntity beta-alanyl-CoA An acyl-CoA that is the S-(β-alanyl) derivative of coenzyme A. hmdb:HMDB0006805|kegg.compound:C02335|pubmed:13064|pubmed:15670161|pubmed:6788773|reaxys:78295 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-aminopropionyl-CoA|3-aminopropionyl-coenzyme A|S-beta-Ala-CoA|S-beta-Alanyl-coenzym-A|S-beta-alanyl-CoA|S-beta-alanyl-coenzyme-A|beta-Alanyl-CoA|beta-alanyl-CoA|beta-alanyl-coenzyme A|beta-aminopropionyl-CoA|beta-aminopropionyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-aminopropionyl-CoA|3-aminopropionyl-coenzyme A|S-beta-Ala-CoA|S-beta-Alanyl-coenzym-A|S-beta-alanyl-CoA|S-beta-alanyl-coenzyme-A|beta-Alanyl-CoA|beta-alanyl-CoA|beta-alanyl-coenzyme A|beta-aminopropionyl-CoA|beta-aminopropionyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15508 biolink:ChemicalEntity gamma-linolenoyl-CoA An octadecatrienoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of γ-linolenic acid. hmdb:HMDB0006368|kegg.compound:C03035|pubmed:1310052|pubmed:2297524|pubmed:3722151 Graph (6Z,9Z,12Z)-6,9,12-octadecatrienoyl-CoA|(Z,Z,Z)-6,9,12-octadecatrienoyl-CoA|(Z,Z,Z)-6,9,12-octadecatrienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(6Z,12Z,15Z)-octadeca-6,12,15-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|6-cis,9-cis,12-cis-octadecatrienoyl-CoA|6-cis,9-cis,12-cis-octadecatrienoyl-coenzyme A|GLA-CoA|gamma-Linolenoyl-CoA|gamma-linolenoyl-coenzyme A|gamolenoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(6Z,12Z,15Z)-octadeca-6,12,15-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (6Z,9Z,12Z)-6,9,12-octadecatrienoyl-CoA|(Z,Z,Z)-6,9,12-octadecatrienoyl-CoA|(Z,Z,Z)-6,9,12-octadecatrienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(6Z,12Z,15Z)-octadeca-6,12,15-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|6-cis,9-cis,12-cis-octadecatrienoyl-CoA|6-cis,9-cis,12-cis-octadecatrienoyl-coenzyme A|GLA-CoA|gamma-Linolenoyl-CoA|gamma-linolenoyl-coenzyme A|gamolenoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15509 biolink:ChemicalEntity 4-(2-carboxyphenyl)-4-oxobutanoyl-CoA A member of the class of acyl-CoAs that is the S-[4-(2-carboxyphenyl)-4-oxobutanoyl] derivative of coenzyme A. cas:72471-59-1|kegg.compound:C03160|pubmed:12615349|pubmed:18208520|pubmed:18973344|pubmed:28559280|pubmed:500558|pubmed:8626063|pubmed:8955296 Graph 4-(2'-carboxyphenyl)-4-oxobutyryl-CoA|4-(2'-carboxyphenyl)-4-oxobutyryl-coenzyme A|4-(2-carboxyphenyl)-4-oxobutanoyl-CoA|Coenzyme A, S-(2-(3-carboxy-1-oxopropyl)benzoate)|OSB-CoA|o-Succinylbenzoyl-CoA|ortho-Succinylbenzoyl-coa 4-(2'-carboxyphenyl)-4-oxobutyryl-CoA|4-(2'-carboxyphenyl)-4-oxobutyryl-coenzyme A|4-(2-carboxyphenyl)-4-oxobutanoyl-CoA|Coenzyme A, S-(2-(3-carboxy-1-oxopropyl)benzoate)|OSB-CoA|o-Succinylbenzoyl-CoA|ortho-Succinylbenzoyl-coa http://purl.obolibrary.org/obo/CHEBI_15509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15510 biolink:ChemicalEntity 5-hydroxy-2-furoyl-CoA The S-(5-hydroxy-2-furoyl) derivative of coenzyme A. kegg.compound:C03724 Graph 3'-phosphoadenosine 5'-{3-[(3R)3-hydroxy-4-{[3-({2-[(5-hydroxyfuran-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|S-(5-Hydroxy-2-furoyl)-CoA|S-(5-hydroxy-2-furoyl)-CoA 3'-phosphoadenosine 5'-{3-[(3R)3-hydroxy-4-{[3-({2-[(5-hydroxyfuran-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)3-hydroxy-4-{[3-({2-[(5-hydroxyfuran-2-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|S-(5-Hydroxy-2-furoyl)-CoA|S-(5-hydroxy-2-furoyl)-CoA http://purl.obolibrary.org/obo/CHEBI_15510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15511 biolink:ChemicalEntity trans-feruloyl-CoA A feruloyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-feruloic acid. kegg.compound:C00406|knapsack:C00007264|pubmed:16666570 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|feruloyl-CoA|trans-4-hydroxy-3-methoxycinnamoyl-CoA|trans-4-hydroxy-3-methoxycinnamoyl-coenzyme A|trans-Feruloyl-CoA|trans-feruloyl-CoA|trans-feruloyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|feruloyl-CoA|trans-4-hydroxy-3-methoxycinnamoyl-CoA|trans-4-hydroxy-3-methoxycinnamoyl-coenzyme A|trans-Feruloyl-CoA|trans-feruloyl-CoA|trans-feruloyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15512 biolink:ChemicalEntity L-3-aminobutanoyl-CoA A 3-aminobutyryl-CoA having that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of L-3-aminobutanoic acid. kegg.compound:C05231 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(L-3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L-3-Aminobutyryl-CoA|L-3-aminobutanoyl-coenzyme A|L-3-aminobutyryl-coenzyme A|S-(L-3-aminobutanoyl)-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(L-3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(L-3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|L-3-Aminobutyryl-CoA|L-3-aminobutanoyl-coenzyme A|L-3-aminobutyryl-coenzyme A|S-(L-3-aminobutanoyl)-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15513 biolink:ChemicalEntity acryloyl-CoA The S-acryloyl derivative of coenzyme A. beilstein:78117|cas:5776-58-9|kegg.compound:C00894|umbbd.compound:c0150 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Acryloyl-CoA|Acryloyl-coa|Acryloyl-coenzyme A|Acrylyl-CoA|Acrylyl-coa|Coenzyme A, S-2-propenoate|Propenoyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(prop-2-enoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Acryloyl-CoA|Acryloyl-coa|Acryloyl-coenzyme A|Acrylyl-CoA|Acrylyl-coa|Coenzyme A, S-2-propenoate|Propenoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15514 biolink:ChemicalEntity arachidonoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of arachidononic acid. cas:17046-56-9|hmdb:HMDB0006523|kegg.compound:C02249|pubmed:1323964|pubmed:16181777|pubmed:16344985|pubmed:2105213|pubmed:2505330|pubmed:2528345|pubmed:3989882|pubmed:4030780|pubmed:6303134|pubmed:6466693|pubmed:8605368|reaxys:9316147 Graph (5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoyl-CoA|(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoyl-coenzyme A|(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyl-coenzyme A|(5Z,8Z,11Z,14Z)-Icosatetraenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Arachidonoyl-CoA|Arachidonyl-CoA|C20:4-CoA|all-cis-5,8,11,14-eicosatetraenoyl-CoA|all-cis-5,8,11,14-eicosatetraenoyl-coenzyme A|arachidonoyl-coenzyme A|arachidonyl-coenzyme A|cis-Delta(5,8,11,14)-eicosatetraenoyl-CoA|cis-Delta(5,8,11,14)-eicosatetraenoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoyl-CoA|(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoyl-coenzyme A|(5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoyl-coenzyme A|(5Z,8Z,11Z,14Z)-Icosatetraenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Arachidonoyl-CoA|Arachidonyl-CoA|C20:4-CoA|all-cis-5,8,11,14-eicosatetraenoyl-CoA|all-cis-5,8,11,14-eicosatetraenoyl-coenzyme A|arachidonoyl-coenzyme A|arachidonyl-coenzyme A|cis-Delta(5,8,11,14)-eicosatetraenoyl-CoA|cis-Delta(5,8,11,14)-eicosatetraenoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15515 biolink:ChemicalEntity benzoyl-CoA The simplest member of the class of benzoyl-CoAs that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of benzoic acid. cas:6756-74-7|chemspider:7822142|foodb.food:FDB022929|hmdb:HMDB0002252|kegg.compound:C00512|pdb-ccd:BYC|pubmed:10766750|pubmed:10903310|pubmed:11827519|pubmed:12511484|pubmed:15458418|pubmed:1555579|pubmed:15812036|pubmed:15916608|pubmed:20578740|pubmed:21247899|pubmed:21632537|pubmed:23852864|pubmed:25630364|pubmed:26120796|pubmed:2753161|pubmed:28647601|pubmed:28918628|pubmed:29199980|pubmed:30106574|pubmed:3102706|pubmed:31430028|pubmed:32510798|pubmed:33031578|pubmed:33057782|pubmed:33452484|pubmed:33803916|pubmed:5534109|pubmed:8352646|pubmed:8661934|pubmed:9297469|pubmed:9746358|reaxys:78297|umbbd.compound:c0119 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(benzoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Benzoyl-CoA|S-Benzoate coenzyme A|S-benzoyl-coenzyme A|benzoyl coenzyme A|benzoyl-S-coenzyme A|benzoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(benzoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(benzoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Benzoyl-CoA|S-Benzoate coenzyme A|S-benzoyl-coenzyme A|benzoyl coenzyme A|benzoyl-S-coenzyme A|benzoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15516 biolink:ChemicalEntity biotinyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of biotin. agr:IND85072840|kegg.compound:C01894|lipidmaps:LMFA07050291|pubmed:3800379 Graph Biotinyl-CoA|S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda(5),5lambda(5)-diphosphaheptadecan-17-yl} 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanethioate|biotinyl-coenzyme A S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda(5),5lambda(5)-diphosphaheptadecan-17-yl} 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanethioate Biotinyl-CoA|S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda(5),5lambda(5)-diphosphaheptadecan-17-yl} 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanethioate|biotinyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15517 biolink:ChemicalEntity butyryl-CoA A short-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of butyric acid. cas:2140-48-9|hmdb:HMDB0001088|kegg.compound:C00136|pdb-ccd:BCO|pubmed:10517585|pubmed:1269146|pubmed:14570270|pubmed:15222752|pubmed:3117785|pubmed:6386797|pubmed:8099072|reaxys:78263|umbbd.compound:c0023 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(butanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|4:0-CoA|Butanoyl-CoA|Butyryl-CoA|Butyryl-coa|Butyryl-coenzyme A|C4:0-CoA|Coenzyme A, S-butanoate|S-Butyryl-coenzym-A|S-butanoyl-CoA|S-butanoyl-coenzyme A|S-butyryl-CoA|S-butyryl-coenzyme A|butanoyl-CoA|butanoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(butanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(butanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|4:0-CoA|Butanoyl-CoA|Butyryl-CoA|Butyryl-coa|Butyryl-coenzyme A|C4:0-CoA|Coenzyme A, S-butanoate|S-Butyryl-coenzym-A|S-butanoyl-CoA|S-butanoyl-coenzyme A|S-butyryl-CoA|S-butyryl-coenzyme A|butanoyl-CoA|butanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15518 biolink:ChemicalEntity caffeoyl-CoA An acyl CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of caffeic acid. cas:53034-79-0|kegg.compound:C00323|knapsack:C00007281|reaxys:7683288 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3,4-dihydroxyphenylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Caffeoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3,4-dihydroxyphenylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3,4-dihydroxyphenylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Caffeoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15519 biolink:ChemicalEntity choloyl-CoA A steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of cholic acid. kegg.compound:C01794|pubmed:10706581|pubmed:10884298|pubmed:3741411|pubmed:6639941|pubmed:869918 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-one-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl-coenzyme A|Choloyl-CoA|S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-CoA|choloyl-coenzyme A|cholyl-CoA|cholyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-one-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl-CoA|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl-coenzyme A|Choloyl-CoA|S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)-CoA|choloyl-coenzyme A|cholyl-CoA|cholyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15520 biolink:ChemicalEntity cyclohexa-1,5-diene-1-carbonyl-CoA cas:148471-94-7|kegg.compound:C06322|umbbd.compound:c0212 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(cyclohexa-1,5-diene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Cyclohex-1,5-diene-1-carboxyl-CoA|Cyclohexa-1,5-diene-1-carbonyl-CoA|Cyclohexa-1,5-dienecarbonyl-CoA|S-1,5-Cyclohexadiene-1-carboxylate coenzymeA|cyclohex-1,5-diene-1-carbonyl-CoA|cyclohex-1,5-dienecarbonyl-CoA|cyclohex-1,5-dienecarboxyl-CoA|cyclohexa-1,5-diene-1-carbonyl-coenzymeA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(cyclohexa-1,5-diene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(cyclohexa-1,5-diene-1-carbonyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Cyclohex-1,5-diene-1-carboxyl-CoA|Cyclohexa-1,5-diene-1-carbonyl-CoA|Cyclohexa-1,5-dienecarbonyl-CoA|S-1,5-Cyclohexadiene-1-carboxylate coenzymeA|cyclohex-1,5-diene-1-carbonyl-CoA|cyclohex-1,5-dienecarbonyl-CoA|cyclohex-1,5-dienecarboxyl-CoA|cyclohexa-1,5-diene-1-carbonyl-coenzymeA http://purl.obolibrary.org/obo/CHEBI_15520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15521 biolink:ChemicalEntity lauroyl-CoA A medium-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of lauric (dodecanoic) acid. cas:6244-92-4|chemspider:145018|drugbank:DB03264|foodb.food:FDB023198|hmdb:HMDB0003571|kegg.compound:C01832|lipidmaps:LMFA07050340|pdb-ccd:DCC|pubmed:10652339|pubmed:1263766|pubmed:15713483|pubmed:15849423|pubmed:16021622|pubmed:16665518|pubmed:21349973|pubmed:22906002|pubmed:24356978|pubmed:27815501|pubmed:30948713|pubmed:31935250|pubmed:33885999|pubmed:3778940|pubmed:627552|pubmed:7551821|reaxys:8033507|umbbd.compound:c0567 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(dodecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|C12:0-CoA|Dodecanoyl-CoA|Lauroyl coenzyme A|Lauroyl-CoA|Lauroyl-coenzyme A|coenzyme A, S-dodecanoate|dodecanoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(dodecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(dodecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|C12:0-CoA|Dodecanoyl-CoA|Lauroyl coenzyme A|Lauroyl-CoA|Lauroyl-coenzyme A|coenzyme A, S-dodecanoate|dodecanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15522 biolink:ChemicalEntity formyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of formic acid. hmdb:HMDB0003419|kegg.compound:C00798|pdb-ccd:FYN|pubmed:10379198|pubmed:10709654|pubmed:11330072|pubmed:9166898|reaxys:21305801 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Formyl-CoA|formyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Formyl-CoA|formyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15523 biolink:ChemicalEntity cis-geranoyl-CoA The S-geranoyl derivative of coenzyme A. kegg.compound:C01920 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[((2Z)-3,7-dimethylocta-2,5-dienoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Geranoyl-CoA|Z-geranoyl-CoA|cis-Geranyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[((2Z)-3,7-dimethylocta-2,5-dienoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[((2Z)-3,7-dimethylocta-2,5-dienoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Geranoyl-CoA|Z-geranoyl-CoA|cis-Geranyl-CoA http://purl.obolibrary.org/obo/CHEBI_15523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15524 biolink:ChemicalEntity glutaryl-CoA An ω-carboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with one of the carboxy groups of glutaric acid. cas:3131-84-8|hmdb:HMDB0001339|kegg.compound:C00527|pdb-ccd:GRA|pubmed:11024031|pubmed:3971969|pubmed:6547838|pubmed:853337|pubmed:8722121|umbbd.compound:c0222 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-carboxybutanoyl-CoA|4-carboxybutanoyl-coenzyme A|Glutaryl-CoA|coenzyme A, S-(hydrogen pentanedioate)|glutaryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-carboxybutanoyl-CoA|4-carboxybutanoyl-coenzyme A|Glutaryl-CoA|coenzyme A, S-(hydrogen pentanedioate)|glutaryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15525 biolink:ChemicalEntity palmitoyl-CoA A long-chain fatty acyl-CoA resulting from the formal condensation of the carboxy group of hexadecanoic acid with the thiol group of coenzyme A. beilstein:78534|cas:1763-10-6|kegg.compound:C00154|knapsack:C00007462|pubmed:12241043|pubmed:12880109|pubmed:15579580|pubmed:15793231|pubmed:16094855|pubmed:16100120|pubmed:17059463|pubmed:18167344|pubmed:18469143|pubmed:22585588|pubmed:23261056|pubmed:24535825|pubmed:24639481|pubmed:26621918|pubmed:31875564|pubmed:34171418 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(hexadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Coenzyme A, S-hexadecanoate|Hexadecanoyl-CoA|Palmitoyl coenzyme A|Palmitoyl-CoA|S-Palmitoylcoenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(hexadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(hexadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Coenzyme A, S-hexadecanoate|Hexadecanoyl-CoA|Palmitoyl coenzyme A|Palmitoyl-CoA|S-Palmitoylcoenzyme A http://purl.obolibrary.org/obo/CHEBI_15525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15527 biolink:ChemicalEntity icosanoyl-CoA A very long-chain fatty acyl-CoA that is the S-icosanoyl derivative of coenzyme A. hmdb:HMDB0004258|kegg.compound:C02041|lipidmaps:LMFA07050006|pubmed:3579296|reaxys:20635662 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Arachidoyl-CoA|Eicosanoyl-CoA|arachidoyl-CoA|eicosanoyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(icosanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Arachidoyl-CoA|Eicosanoyl-CoA|arachidoyl-CoA|eicosanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15528 biolink:ChemicalEntity itaconyl-CoA The S-itaconyl derivative of coenzyme A. kegg.compound:C00531 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxybut-3-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Itaconyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxybut-3-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxybut-3-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Itaconyl-CoA http://purl.obolibrary.org/obo/CHEBI_15528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15529 biolink:ChemicalEntity lactoyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of lactic acid. cas:1926-57-4|kegg.compound:C00827|pubmed:4055736|umbbd.compound:c0151 Graph 2-hydroxypropanoyl CoA|2-hydroxypropanoyl coenzyme A|2-hydroxypropionyl CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Lactoyl-CoA|S-(2-hydroxypropanoyl)coenzyme A|alpha-hydroxypropanoyl CoA|alpha-hydroxypropanoyl coenzyme A|alpha-hydroxypropionyl CoA|alpha-hydroxypropionyl coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-hydroxypropanoyl CoA|2-hydroxypropanoyl coenzyme A|2-hydroxypropionyl CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Lactoyl-CoA|S-(2-hydroxypropanoyl)coenzyme A|alpha-hydroxypropanoyl CoA|alpha-hydroxypropanoyl coenzyme A|alpha-hydroxypropionyl CoA|alpha-hydroxypropionyl coenzyme A http://purl.obolibrary.org/obo/CHEBI_15529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15530 biolink:ChemicalEntity linoleoyl-CoA An octadecadienoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of linoleic acid. kegg.compound:C02050 Graph (9Z,12Z)-Octadecadienoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|Linoleoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (9Z,12Z)-Octadecadienoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z,12Z)-octadeca-9,12-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|Linoleoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15531 biolink:ChemicalEntity malonyl-CoA The S-malonyl derivative of coenzyme A. cas:524-14-1|drugbank:DB04524|kegg.compound:C00083|knapsack:C00007260|lipidmaps:LMFA07050031|metacyc.compound:MALONYL-COA|pdb-ccd:MLC|pubmed:11117381|pubmed:11934665|pubmed:16651524|pubmed:17126822|pubmed:17522981|pubmed:18294446|pubmed:21199367|pubmed:21508288|pubmed:21763447|reaxys:78309|wikipedia.en:Malonyl-CoA Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxyacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Coenzyme A, S-(hydrogen propanedioate)|Malonyl coenzyme A|Malonyl-CoA|S-(Hydrogen malonyl)coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxyacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxyacetyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Coenzyme A, S-(hydrogen propanedioate)|Malonyl coenzyme A|Malonyl-CoA|S-(Hydrogen malonyl)coenzyme A http://purl.obolibrary.org/obo/CHEBI_15531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15532 biolink:ChemicalEntity myristoyl-CoA A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of myristic acid. cas:3130-72-1|drugbank:DB02180|hmdb:HMDB0001521|kegg.compound:C02593|lipidmaps:LMFA07050008|pdb-ccd:MYA|pubmed:15212474|pubmed:17716801|pubmed:19782157|pubmed:20920594|pubmed:21266575|pubmed:8444867|reaxys:8033632 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(tetradecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Myristoyl-CoA|S-tetradecanoyl-coenzyme A|Tetradecanoyl-CoA|n-C14:0-CoA|n-C14:0-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(tetradecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(tetradecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Myristoyl-CoA|S-tetradecanoyl-coenzyme A|Tetradecanoyl-CoA|n-C14:0-CoA|n-C14:0-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15533 biolink:ChemicalEntity octanoyl-CoA A medium-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of octanoic acid. beilstein:6562085|cas:1264-52-4|chemspider:393007|drugbank:DB02910|foodb.food:FDB022409|hmdb:HMDB0001070|kegg.compound:C01944|pdb-ccd:CO8|pubmed:11411544|pubmed:15351645|pubmed:19501572|pubmed:25095906|pubmed:26527136|pubmed:2895026|pubmed:30573650|pubmed:30599088|pubmed:31304053|pubmed:31511507|pubmed:33064909|pubmed:33436600|pubmed:4304157|pubmed:4722901|pubmed:6048700|pubmed:7092822|pubmed:729581|pubmed:8038175|pubmed:8356049|pubmed:8470910|pubmed:8823176|pubmed:9480773|pubmed:9514714|reaxys:8033230|umbbd.compound:c0048|wikipedia.en:Octanoyl-CoA Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|8:0-CoA|C8:0-CoA|Coenzyme A, S-octanoate|Octanoyl-CoA|Octanoyl-coa|Octanoyl-coenzyme A|capryloyl-CoA|capryloyl-coenzyme A|n-octanoyl-CoA|octanoylcoenzyme A|octylyl-CoA|octylyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|8:0-CoA|C8:0-CoA|Coenzyme A, S-octanoate|Octanoyl-CoA|Octanoyl-coa|Octanoyl-coenzyme A|capryloyl-CoA|capryloyl-coenzyme A|n-octanoyl-CoA|octanoylcoenzyme A|octylyl-CoA|octylyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15534 biolink:ChemicalEntity oleoyl-CoA An octadecenoyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of oleic acid. cas:1716-06-9|chemspider:4593689|foodb.food:FDB022554|hmdb:HMDB0001322|kegg.compound:C00510|lipidmaps:LMFA07050356|pdb-ccd:3VV|pubmed:10406955|pubmed:1061066|pubmed:11500518|pubmed:15604682|pubmed:16666608|pubmed:25012658|pubmed:25607896|pubmed:30420764|pubmed:30509981|pubmed:32433610|pubmed:32433613|pubmed:32433614|pubmed:6123958|pubmed:710426|pubmed:7142172|pubmed:8220169|pubmed:8373441|pubmed:9751207|pubmed:9756869|reaxys:604341 Graph (9Z)-octadec-9-enoyl-CoA|(9Z)-octadec-9-enoyl-coenzyme A|(9Z)-octadecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z)-octadec-9-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|S-[(9Z)-octadec-9-enoyl]-CoA|S-[(9Z)-octadec-9-enoyl]-coenzyme A|S-oleoyl-CoA|S-oleoylcoenzyme A|cis-9-octadecenoyl-CoA|cis-9-octadecenoyl-coenzyme A|cis-Delta(9)-octadecenoyl-CoA|cis-Delta(9)-octadecenoyl-coenzyme A|oleoyl-CoA|oleoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z)-octadec-9-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (9Z)-octadec-9-enoyl-CoA|(9Z)-octadec-9-enoyl-coenzyme A|(9Z)-octadecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z)-octadec-9-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|S-[(9Z)-octadec-9-enoyl]-CoA|S-[(9Z)-octadec-9-enoyl]-coenzyme A|S-oleoyl-CoA|S-oleoylcoenzyme A|cis-9-octadecenoyl-CoA|cis-9-octadecenoyl-coenzyme A|cis-Delta(9)-octadecenoyl-CoA|cis-Delta(9)-octadecenoyl-coenzyme A|oleoyl-CoA|oleoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15535 biolink:ChemicalEntity oxalyl-CoA An ω-carboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with one of the carboxy groups of oxalic acid. foodb.food:FDB031077|hmdb:HMDB0304445|kegg.compound:C00313|lipidmaps:LMFA07050357|pdb-ccd:OXK|pubmed:12834851|pubmed:18162462|pubmed:21683154|pubmed:35510715|pubmed:36123371|pubmed:37748563|pubmed:5472155|reaxys:15648689 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(oxalylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|OXALYL-COENZYME A|Oxalyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(oxalylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(oxalylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|OXALYL-COENZYME A|Oxalyl-CoA http://purl.obolibrary.org/obo/CHEBI_15535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15536 biolink:ChemicalEntity pentanoyl-CoA A short-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of pentanoic acid. cas:4752-33-4|hmdb:HMDB0013037|kegg.compound:C00888|pubmed:11879205|pubmed:16133321|pubmed:19860832|pubmed:3597403|reaxys:78329 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pentanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|5:0-CoA|C5:0-CoA|Pentanoyl-CoA|S-Valeryl-coenzym-A|S-valeryl-CoA|S-valeryl-coenzyme-A|Valeryl-coenzyme A|coenzyme A S-pentanoate|pentanoyl-coenzyme A|valeryl-CoA|valeryl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pentanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(pentanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|5:0-CoA|C5:0-CoA|Pentanoyl-CoA|S-Valeryl-coenzym-A|S-valeryl-CoA|S-valeryl-coenzyme-A|Valeryl-coenzyme A|coenzyme A S-pentanoate|pentanoyl-coenzyme A|valeryl-CoA|valeryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15537 biolink:ChemicalEntity phenylacetyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of phenylacetic acid. agr:IND500707503|cas:7532-39-0|chemspider:145148|foodb.food:FDB023945|hmdb:HMDB0006503|kegg.compound:C00582|knapsack:C00007536|pdb-ccd:FAQ|pubmed:11010921|pubmed:11260461|pubmed:15028709|pubmed:16788190|pubmed:16997993|pubmed:18544072|pubmed:2009287|pubmed:20823522|pubmed:21247899|pubmed:21511027|pubmed:21519854|pubmed:21725002|pubmed:24055609|pubmed:2553650|pubmed:26538563|pubmed:29867833|pubmed:31585996|pubmed:457678|pubmed:6142928|pubmed:666745|pubmed:6838224|pubmed:8002592|pubmed:8352646|pubmed:9297469|reaxys:8399067|wikipedia.en:Phenylacetyl-CoA Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(phenylacetyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Coenzyme A, S-(benzeneacetate)|Phenylacetyl coenzyme A|Phenylacetyl-CoA|Phenylacetyl-coa|Phenylacetyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(phenylacetyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(phenylacetyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Coenzyme A, S-(benzeneacetate)|Phenylacetyl coenzyme A|Phenylacetyl-CoA|Phenylacetyl-coa|Phenylacetyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15538 biolink:ChemicalEntity phytanoyl-CoA The S-phytanoyl derivative of coenzyme A. kegg.compound:C02060 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Phytanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3,7,11,15-tetramethylhexadecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Phytanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15538 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15539 biolink:ChemicalEntity propionyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of propionic acid. cas:317-66-8|chemspider:83731|drugbank:DB02912|foodb.food:FDB022529|hmdb:HMDB0001275|kegg.compound:C00100|pdb-ccd:1VU|pubmed:12700259|pubmed:12824185|pubmed:15514053|pubmed:15518551|pubmed:1595124|pubmed:1819469|pubmed:2009071|pubmed:23435886|pubmed:24206647|pubmed:24497638|pubmed:24623648|pubmed:25398867|pubmed:26170412|pubmed:27227837|pubmed:27377381|pubmed:27557613|pubmed:27820805|pubmed:28189105|pubmed:28202954|pubmed:28760847|pubmed:29033250|pubmed:29056341|pubmed:29381332|pubmed:3003041|reaxys:78167|umbbd.compound:c0363|wikipedia.en:Propionyl-CoA Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(propanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Propanoyl-CoA|Propionyl coenzyme A|Propionyl-CoA|Propionyl-coenzyme A|S-Propionyl-coenzym-A|S-Propionylcoenzyme A|S-propanoyl-CoA|S-propanoyl-coenzyme A|propanoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(propanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(propanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)|Propanoyl-CoA|Propionyl coenzyme A|Propionyl-CoA|Propionyl-coenzyme A|S-Propionyl-coenzym-A|S-Propionylcoenzyme A|S-propanoyl-CoA|S-propanoyl-coenzyme A|propanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15540 biolink:ChemicalEntity sinapoyl-CoA A trans-2-enoyl-CoA that is the S-sinapoyl derivative of coenzyme A. cas:54429-80-0|kegg.compound:C00411|knapsack:C00007283 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Sinapoyl-CoA|[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acroyl]-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Sinapoyl-CoA|[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acroyl]-CoA http://purl.obolibrary.org/obo/CHEBI_15540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15541 biolink:ChemicalEntity stearoyl-CoA A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of stearic acid. cas:362-66-3|chemspider:84957|foodb.food:FDB022431|hmdb:HMDB0001114|kegg.compound:C00412|lipidmaps:LMFA07050369|pdb-ccd:ST9|pubmed:24356978|pubmed:26098317|pubmed:26098370|pubmed:31838050|pubmed:32251275|pubmed:32601219|pubmed:33052678|pubmed:33207603|pubmed:33374300|pubmed:6472736|pubmed:7480063|pubmed:9434139|reaxys:8033851|wikipedia.en:Stearoyl-CoA Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|C18:0-CoA|C18:0-coenzyme A|S-stearoyl-CoA|S-stearoylcoenzyme A|Stearoyl-CoA|Stearyl coenzyme A|Stearyl-CoA|octadecanoyl-CoA|octadecanoyl-coenzyme A|stearoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octadecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)|C18:0-CoA|C18:0-coenzyme A|S-stearoyl-CoA|S-stearoylcoenzyme A|Stearoyl-CoA|Stearyl coenzyme A|Stearyl-CoA|octadecanoyl-CoA|octadecanoyl-coenzyme A|stearoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15542 biolink:ChemicalEntity thiophene-2-carbonyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of thiophene-2-carboxylic acid. kegg.compound:C07347 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(thiophene-2-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Thiophene-2-carbonyl-CoA|thiophene-2-carbonyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(thiophene-2-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(thiophene-2-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|Thiophene-2-carbonyl-CoA|thiophene-2-carbonyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_15542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15543 biolink:ChemicalEntity vinylacetyl-CoA The S-vinylacetyl derivative of coenzyme A. kegg.compound:C02331 Graph 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(but-3-enoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|3-Butenoyl-CoA|But-3-enoyl-CoA|Vinylacetyl-CoA|but-3-enoyl-CoA 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(but-3-enoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(but-3-enoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|3-Butenoyl-CoA|But-3-enoyl-CoA|Vinylacetyl-CoA|but-3-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_15543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15544 biolink:ChemicalEntity prostaglandin E1 cas:745-65-3|drugbank:DB00770|drugcentral:138|hmdb:HMDB0001442|kegg.compound:C04741|kegg.drug:D00180|lipidmaps:LMFA03010134|pubmed:15295081|pubmed:18176061|pubmed:7732902|reaxys:2061617|wikipedia.en:Prostaglandin_E1 Graph (11alpha,13E,15S)-11,15-dihydroxy-9-oxoprost-13-en-1-oic acid|(13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprost-13-enoate|(13E,15S)-11alpha,15-dihydroxy-9-oxoprost-13-en-1-oic acid|11alpha,15alpha-dihydroxy-9-oxo-13-trans-prostenoic acid|Alprostadil|Befar|Caverject|Edex|Muse|PGE-1|PGE1|Prostaglandin E1|Prostin VR|alprostadil|alprostadilum (13E,15S)-11alpha,15-dihydroxy-9-oxoprost-13-en-1-oic acid (11alpha,13E,15S)-11,15-dihydroxy-9-oxoprost-13-en-1-oic acid|(13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprost-13-enoate|(13E,15S)-11alpha,15-dihydroxy-9-oxoprost-13-en-1-oic acid|11alpha,15alpha-dihydroxy-9-oxo-13-trans-prostenoic acid|Alprostadil|Befar|Caverject|Edex|Muse|PGE-1|PGE1|Prostaglandin E1|Prostin VR|alprostadil|alprostadilum http://purl.obolibrary.org/obo/CHEBI_15544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15545 biolink:ChemicalEntity prostaglandin A1 cas:14152-28-4|kegg.compound:C04685|lipidmaps:LMFA03010005|pdb-ccd:8PG Graph (13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate|(13E,15S)-15-hydroxy-9-oxoprosta-10,13-dien-1-oic acid|PGA1|Prostaglandin A1 (13E,15S)-15-hydroxy-9-oxoprosta-10,13-dien-1-oic acid (13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate|(13E,15S)-15-hydroxy-9-oxoprosta-10,13-dien-1-oic acid|PGA1|Prostaglandin A1 http://purl.obolibrary.org/obo/CHEBI_15545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15546 biolink:ChemicalEntity prostaglandin C1 cas:35687-86-6|kegg.compound:C04686|lipidmaps:LMFA03010160 Graph (13E)-(15S)-15-Hydroxy-9-oxoprosta-11,13-dienoate|(13E,15S)-15-hydroxy-9-oxoprosta-11,13-dienoic acid|PGC1|Prostaglandin C1 (13E,15S)-15-hydroxy-9-oxoprosta-11,13-dienoic acid (13E)-(15S)-15-Hydroxy-9-oxoprosta-11,13-dienoate|(13E,15S)-15-hydroxy-9-oxoprosta-11,13-dienoic acid|PGC1|Prostaglandin C1 http://purl.obolibrary.org/obo/CHEBI_15546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15547 biolink:ChemicalEntity 15-dehydro-prostaglandin E2 cas:26441-05-4|foodb.food:FDB023119|hmdb:HMDB0003175|kegg.compound:C04707|lipidmaps:LMFA03010030|pubmed:23542179|pubmed:23687300|pubmed:26590294|pubmed:26820738|pubmed:30921435|pubmed:33147298|pubmed:33681993|pubmed:37538064 Graph (5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprosta-13-enoate|(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate|(5Z,13E)-11alpha-hydroxy-9,15-dioxoprosta-5,13-dienoic acid|15-Keto-PGE2|15-Keto-prostaglandin E2|15-Ketoprostaglandin E2|15-Oxo-PGE2|15-deoxy-15-oxo-prostaglandin E2 (5Z,13E)-11alpha-hydroxy-9,15-dioxoprosta-5,13-dienoic acid (5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprosta-13-enoate|(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate|(5Z,13E)-11alpha-hydroxy-9,15-dioxoprosta-5,13-dienoic acid|15-Keto-PGE2|15-Keto-prostaglandin E2|15-Ketoprostaglandin E2|15-Oxo-PGE2|15-deoxy-15-oxo-prostaglandin E2 http://purl.obolibrary.org/obo/CHEBI_15547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15548 biolink:ChemicalEntity 15-dehydro-prostaglandin E1 kegg.compound:C04654|lipidmaps:LMFA03010146 Graph (13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate|(13E)-11alpha-hydroxy-9,15-dioxoprost-13-en-1-oic acid (13E)-11alpha-hydroxy-9,15-dioxoprost-13-en-1-oic acid (13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate|(13E)-11alpha-hydroxy-9,15-dioxoprost-13-en-1-oic acid http://purl.obolibrary.org/obo/CHEBI_15548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15550 biolink:ChemicalEntity 13,14-dihydro-15-oxo-prostaglandin E2 The 13,14-dihydro derivative of 15-oxo-prostaglandin E2. cas:363-23-5|kegg.compound:C04671|lipidmaps:LMFA03010031 Graph (5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate|(5Z)-11alpha-hydroxy-9,15-dioxoprost-5-enoic acid|13,14-Dihydro-15-keto-PGE2|13,14-Dihydro-15-ketoprostaglandin E2|13,14-dihydro-15-keto-PGE2|15-Keto-13,14-dihydro-PGE2|15-Keto-13,14-dihydroprostaglandin E2|KH(2)PGE(2)|PGEM|dhk-PGE2 (5Z)-11alpha-hydroxy-9,15-dioxoprost-5-enoic acid (5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprostanoate|(5Z)-11alpha-hydroxy-9,15-dioxoprost-5-enoic acid|13,14-Dihydro-15-keto-PGE2|13,14-Dihydro-15-ketoprostaglandin E2|13,14-dihydro-15-keto-PGE2|15-Keto-13,14-dihydro-PGE2|15-Keto-13,14-dihydroprostaglandin E2|KH(2)PGE(2)|PGEM|dhk-PGE2 http://purl.obolibrary.org/obo/CHEBI_15550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15551 biolink:ChemicalEntity prostaglandin E2 Prostaglandin F2α in which the hydroxy group at position 9 has been oxidised to the corresponding ketone. Prostaglandin E2 is the most common and most biologically potent of mammalian prostaglandins. beilstein:2224724|cas:363-24-6|drugbank:DB00917|drugcentral:913|foodb.food:FDB022498|hmdb:HMDB0001220|kegg.compound:C00584|kegg.drug:D00079|lincs.smallmolecule:LSM-42919|lipidmaps:LMFA03010003|patent:DE2011969|patent:GB851827|patent:NL6505799|patent:US3598858|pdb-ccd:P2E|pubmed:11279302|pubmed:12746806|pubmed:12859290|pubmed:14499495|pubmed:14535055|pubmed:14703707|pubmed:15542928|pubmed:15661432|pubmed:16405508|pubmed:16787416|pubmed:16978535|pubmed:20671299|pubmed:2403792|pubmed:24501112|pubmed:32898608|pubmed:33271839|pubmed:33559528|pubmed:33685091|pubmed:33715333|pubmed:33782420|pubmed:33811074|pubmed:33958485|pubmed:34065827|pubmed:34071686|pubmed:34102274|pubmed:6317292|pubmed:7224729|pubmed:74611|pubmed:7836930|pubmed:9276764|reaxys:2224724|wikipedia.en:Prostaglandin_E2 Graph (15S)-prostaglandin E2|(5Z,11alpha,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oic acid|(5Z,13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprost-13-enoate|(5Z,13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprosta-5,13-dienoate|(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oic acid|(E,Z)-(1R,2R,3R)-7-(3-Hydroxy-2-((3S)-(3-hydroxy-1-octenyl))-5-oxocyclopentyl)-5-heptenoic acid|(Z)-7-((1R,2R,3R)-3-hydroxy-2-((S,E)-3-hydroxyoct-1-enyl)-5-oxocyclopentyl)hept-5-enoic acid|Cervidil|Cerviprime|Cerviprost|Dinoproston|Enzaprost E|Glandin-E2|Minprositin E2|Minprostin E2|PGE2|Prepidil|Propess|Prostaglandin E2|Prostarmon E|Prostenone|Prostin|Prostin E2|U 12062|U-12,062|U-12062|dinoprostona|dinoprostone|dinoprostonum (5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oic acid (15S)-prostaglandin E2|(5Z,11alpha,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oic acid|(5Z,13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprost-13-enoate|(5Z,13E)-(15S)-11alpha,15-Dihydroxy-9-oxoprosta-5,13-dienoate|(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oic acid|(E,Z)-(1R,2R,3R)-7-(3-Hydroxy-2-((3S)-(3-hydroxy-1-octenyl))-5-oxocyclopentyl)-5-heptenoic acid|(Z)-7-((1R,2R,3R)-3-hydroxy-2-((S,E)-3-hydroxyoct-1-enyl)-5-oxocyclopentyl)hept-5-enoic acid|Cervidil|Cerviprime|Cerviprost|Dinoproston|Enzaprost E|Glandin-E2|Minprositin E2|Minprostin E2|PGE2|Prepidil|Propess|Prostaglandin E2|Prostarmon E|Prostenone|Prostin|Prostin E2|U 12062|U-12,062|U-12062|dinoprostona|dinoprostone|dinoprostonum http://purl.obolibrary.org/obo/CHEBI_15551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15552 biolink:ChemicalEntity prostaglandin I2 beilstein:1690090|cas:35121-78-9|drugbank:DB01240|drugcentral:1034|kegg.compound:C01312|kegg.drug:D00106|lipidmaps:LMFA03010087 Graph (5Z,13E)-(15S)-6,9alpha-Epoxy-11alpha,15-dihydroxyprosta-5,13-dienoate|(5Z,13E,15S)-6,9alpha-epoxy-11alpha,15-dihydroxyprosta-5,13-dienoic acid|(5Z,9alpha,11alpha,13E,15S)-6,9-epoxy-11,15-dihydroxyprosta-5,13-dien-1-oic acid|Epoprostenol|Flolan|PGI2|PGX|Prostacyclin|Prostaglandin I2|Vasocyclin|prostaglandin X (5Z,13E,15S)-6,9alpha-epoxy-11alpha,15-dihydroxyprosta-5,13-dienoic acid (5Z,13E)-(15S)-6,9alpha-Epoxy-11alpha,15-dihydroxyprosta-5,13-dienoate|(5Z,13E,15S)-6,9alpha-epoxy-11alpha,15-dihydroxyprosta-5,13-dienoic acid|(5Z,9alpha,11alpha,13E,15S)-6,9-epoxy-11,15-dihydroxyprosta-5,13-dien-1-oic acid|Epoprostenol|Flolan|PGI2|PGX|Prostacyclin|Prostaglandin I2|Vasocyclin|prostaglandin X http://purl.obolibrary.org/obo/CHEBI_15552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15553 biolink:ChemicalEntity prostaglandin F2alpha A prostaglandins Fα that is prosta-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9, 11 and 15. It is a naturally occurring prostaglandin used to induce labor. cas:551-11-1|drugcentral:912|hmdb:HMDB0001139|kegg.compound:C00639|kegg.drug:D00081|lipidmaps:LMFA03010002|metacyc.compound:5Z13E-15S-9-ALPHA11-ALPHA15-TRIHY|pubmed:11438482|pubmed:23807981|reaxys:2225571|vsdb:1803|wikipedia.en:Dinoprost Graph (+)-Prostaglandin F2a|(5Z,13E)-(15S)-9alpha,11alpha,15-Trihydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,13-dien-1-oic acid|7-[3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoic acid|9,11,15-Trihydroxy-(5Z,9a,11a,13E,15S)-prosta-5,13-dien-1-oic acid|9a,11a-PGF2|Amoglandin|Cyclosin|Dinoprost|Enzaprost|Enzaprost F|PGF2a|PGF2alpha|Panacelan|Prostaglandin F2a|Prostaglandin F2alpha|Prostin F 2 alpha|Protamodin|U 14583|dinoprost|dinoprosta|dinoprostum|l-PGF2-alpha|l-Prostaglandin F2-alpha (5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,13-dien-1-oic acid (+)-Prostaglandin F2a|(5Z,13E)-(15S)-9alpha,11alpha,15-Trihydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha,15-trihydroxyprosta-5,13-dien-1-oic acid|7-[3,5-Dihydroxy-2-(3-hydroxy-1-octenyl)cyclopentyl]-5-heptenoic acid|9,11,15-Trihydroxy-(5Z,9a,11a,13E,15S)-prosta-5,13-dien-1-oic acid|9a,11a-PGF2|Amoglandin|Cyclosin|Dinoprost|Enzaprost|Enzaprost F|PGF2a|PGF2alpha|Panacelan|Prostaglandin F2a|Prostaglandin F2alpha|Prostin F 2 alpha|Protamodin|U 14583|dinoprost|dinoprosta|dinoprostum|l-PGF2-alpha|l-Prostaglandin F2-alpha http://purl.obolibrary.org/obo/CHEBI_15553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15554 biolink:ChemicalEntity prostaglandin H2 beilstein:1598632|cas:42935-17-1|kegg.compound:C00427|lipidmaps:LMFA03010010 Graph (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,13E)-(15S)-9alpha,11alpha-Epidioxy-15-hydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-Epidioxy-15-hydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-epidioxy-15-hydroxyprosta-5,13-dienoic acid|(5Z,9alpha,11alpha,13E,15S)-9,11-epidioxy-15-hydroxyprosta-5,13-dien-1-oic acid|9,11-Epoxymethano-pgh2|PGH2|Prostaglandin H2 (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,13E,15S)-9alpha,11alpha-epidioxy-15-hydroxyprosta-5,13-dienoic acid (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,13E)-(15S)-9alpha,11alpha-Epidioxy-15-hydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-Epidioxy-15-hydroxyprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-epidioxy-15-hydroxyprosta-5,13-dienoic acid|(5Z,9alpha,11alpha,13E,15S)-9,11-epidioxy-15-hydroxyprosta-5,13-dien-1-oic acid|9,11-Epoxymethano-pgh2|PGH2|Prostaglandin H2 http://purl.obolibrary.org/obo/CHEBI_15554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15555 biolink:ChemicalEntity prostaglandin D2 A member of the class of prostaglandins D that is prosta-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9 and 15 and an oxo group at position 11 (the 5Z,9α,13E,15S- stereoisomer). cas:41598-07-6|drugbank:DB02056|hmdb:HMDB0001403|kegg.compound:C00696|lipidmaps:LMFA03010004|pdb-ccd:PG2|pubmed:15843042|pubmed:24298012|pubmed:24447364|pubmed:24456221|reaxys:2170623|wikipedia.en:Prostaglandin_D2 Graph (5Z,13E)-(15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dien-1-oic acid|11-Dehydroprostaglandin F2-alpha|PGD2|Prostaglandin D2 (5Z,13E,15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dien-1-oic acid (5Z,13E)-(15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dien-1-oic acid|11-Dehydroprostaglandin F2-alpha|PGD2|Prostaglandin D2 http://purl.obolibrary.org/obo/CHEBI_15555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15556 biolink:ChemicalEntity 15-dehydro-prostaglandin I2 cas:100311-07-7|kegg.compound:C04835 Graph (5Z,13E)-6,9alpha-Epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate|(5Z,13E)-6,9alpha-epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoic acid|15-Keto-pgi2|15-Ketoprostaglandin I2|15-deoxy-15-oxo-prostaglandin I2|15-keto PGI2 (5Z,13E)-6,9alpha-Epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate|(5Z,13E)-6,9alpha-epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoic acid (5Z,13E)-6,9alpha-Epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate|(5Z,13E)-6,9alpha-epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoic acid|15-Keto-pgi2|15-Ketoprostaglandin I2|15-deoxy-15-oxo-prostaglandin I2|15-keto PGI2 http://purl.obolibrary.org/obo/CHEBI_15556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15557 biolink:ChemicalEntity 15-dehydro-prostaglandin D2 The 15-dehydro derivative of prostaglandin D2. kegg.compound:C04758 Graph (5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate|(5Z,13E)-9alpha-hydroxy-11,15-dioxoprosta-5,13-dienoic acid|15-Dehydro-prostaglandin D2|15-deoxy-15-oxo-prostaglandin D2 (5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate|(5Z,13E)-9alpha-hydroxy-11,15-dioxoprosta-5,13-dienoic acid (5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate|(5Z,13E)-9alpha-hydroxy-11,15-dioxoprosta-5,13-dienoic acid|15-Dehydro-prostaglandin D2|15-deoxy-15-oxo-prostaglandin D2 http://purl.obolibrary.org/obo/CHEBI_15557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15558 biolink:ChemicalEntity 15(S)-HETE An optically active form of 15-HETE having 15(S)-configuration.. beilstein:2470466|cas:54845-95-3|hmdb:HMDB0003876|kegg.compound:C04742|kegg.drug:D08931|lipidmaps:LMFA03060001|pubmed:11212240|pubmed:15613483|pubmed:15964853|pubmed:18494609|pubmed:22068350|reaxys:6125815 Graph (15S)-15-Hydroxy-5,8,11-cis-13-trans-eicosatetraenoate|(15S)-15-Hydroxy-5,8,11-cis-13-trans-icosatetraenoate|(15S)-15-hydroxy-5,8,11-cis-13-trans-eicosatetraenoate|(15S)-15-hydroxy-5,8,11-cis-13-trans-icosatetraenoate|(15S)-hydroxy-(5Z,8Z,11Z,13E)-eicosatetraenoic acid|(15S)-hydroxyeicosa-(5Z,8Z,11Z,13E)-tetraenoic acid|(5Z,8Z,11Z,13E)-(15S)-15-Hydroxyicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxy-5,8,11,13-eicosatetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxyeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxyicosa-5,8,11,13-tetraenoic acid|15(S)-HETE|15(S)-hydroxyeicosatetraenoic acid|15S-HETE|icomucret (5Z,8Z,11Z,13E,15S)-15-hydroxyicosa-5,8,11,13-tetraenoic acid (15S)-15-Hydroxy-5,8,11-cis-13-trans-eicosatetraenoate|(15S)-15-Hydroxy-5,8,11-cis-13-trans-icosatetraenoate|(15S)-15-hydroxy-5,8,11-cis-13-trans-eicosatetraenoate|(15S)-15-hydroxy-5,8,11-cis-13-trans-icosatetraenoate|(15S)-hydroxy-(5Z,8Z,11Z,13E)-eicosatetraenoic acid|(15S)-hydroxyeicosa-(5Z,8Z,11Z,13E)-tetraenoic acid|(5Z,8Z,11Z,13E)-(15S)-15-Hydroxyicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxy-5,8,11,13-eicosatetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxyeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroxyicosa-5,8,11,13-tetraenoic acid|15(S)-HETE|15(S)-hydroxyeicosatetraenoic acid|15S-HETE|icomucret http://purl.obolibrary.org/obo/CHEBI_15558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15559 biolink:ChemicalEntity 15-oxo-ETE An oxoicosatetraenoic acid having (5Z,8Z,11Z,13E) double bond stereochemistry, and an oxo group in position 15. cas:81416-72-0|hmdb:HMDB0010210|kegg.compound:C04577|lipidmaps:LMFA03060051|pubmed:17459323|pubmed:17910482|pubmed:19535459|pubmed:23945567|reaxys:6217055 Graph (5Z,8Z,11Z,13E)-15-Oxoicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-ketoeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-oxo-5,8,11,13-eicosatetraenoic acid|(5Z,8Z,11Z,13E)-15-oxoeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-oxoicosa-5,8,11,13-tetraenoic acid|15-Kete|15-Oxo-5,8,11-cis-13-trans-eicosatetraenoate|15-Oxo-ETE|15-OxoETE (5Z,8Z,11Z,13E)-15-Oxoicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-oxoicosa-5,8,11,13-tetraenoic acid (5Z,8Z,11Z,13E)-15-Oxoicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-ketoeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-oxo-5,8,11,13-eicosatetraenoic acid|(5Z,8Z,11Z,13E)-15-oxoeicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E)-15-oxoicosa-5,8,11,13-tetraenoic acid|15-Kete|15-Oxo-5,8,11-cis-13-trans-eicosatetraenoate|15-Oxo-ETE|15-OxoETE http://purl.obolibrary.org/obo/CHEBI_15559 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15560 biolink:ChemicalEntity (15Z)-12-oxophyto-10,15-dienoic acid beilstein:4354678|cas:67204-66-4|kegg.compound:C01226|knapsack:C00000365 Graph (15Z)-12-Oxophyto-10,15-dienoate|(15Z)-12-Oxophyto-10,15-dienoic acid|12-OPDA|12-Oxo-10,15(Z)-phytodienoic acid|12-oxophytodienoic acid|4-oxo-5-(2-pentenyl)-2-Cyclopentene-1-octanoic acid|8-(2-(cis-2'-Pentenyl)-3-oxo-cis-4-cyclopentenyl)octanoic acid|8-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}octanoic acid|9(S),13(S)-12-Oxo-PDA|OPDA 8-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}octanoic acid (15Z)-12-Oxophyto-10,15-dienoate|(15Z)-12-Oxophyto-10,15-dienoic acid|12-OPDA|12-Oxo-10,15(Z)-phytodienoic acid|12-oxophytodienoic acid|4-oxo-5-(2-pentenyl)-2-Cyclopentene-1-octanoic acid|8-(2-(cis-2'-Pentenyl)-3-oxo-cis-4-cyclopentenyl)octanoic acid|8-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}octanoic acid|9(S),13(S)-12-Oxo-PDA|OPDA http://purl.obolibrary.org/obo/CHEBI_15560 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15561 biolink:ChemicalEntity cis-1,2-dihydronaphthalene-1,2-diol beilstein:10079827|cas:31966-70-8|kegg.compound:C04314|umbbd.compound:c0334 Graph (1R,2S)-rel- 1,2-dihydro-1,2-naphthalenediol|cis-1,2-Dihydronaphthalene-1,2-diol|cis-1,2-dihydro-1,2-naphthalenediol|cis-1,2-dihydroxy-1,2-dihydronaphthalene|rel-(1R,2S)-1,2-dihydronaphthalene-1,2-diol rel-(1R,2S)-1,2-dihydronaphthalene-1,2-diol (1R,2S)-rel- 1,2-dihydro-1,2-naphthalenediol|cis-1,2-Dihydronaphthalene-1,2-diol|cis-1,2-dihydro-1,2-naphthalenediol|cis-1,2-dihydroxy-1,2-dihydronaphthalene|rel-(1R,2S)-1,2-dihydronaphthalene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_15561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15562 biolink:ChemicalEntity D-threo-isocitrate(3-) The D-threo-form of isocitrate(3−). kegg.compound:C00451 Graph (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylate|D-threo-isocitrate|threo-Ds-isocitrate (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylate (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylate|D-threo-isocitrate|threo-Ds-isocitrate http://purl.obolibrary.org/obo/CHEBI_15562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15563 biolink:ChemicalEntity D-erythro-isocitrate(3-) A isocitrate(3−) that is the conjugate base of D-erythro-isocitric acid. kegg.compound:C04617 Graph (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylate|D-erythro-isocitrate|threo-DS-isocitrate (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylate (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylate|D-erythro-isocitrate|threo-DS-isocitrate http://purl.obolibrary.org/obo/CHEBI_15563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15564 biolink:ChemicalEntity (3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid cas:161578-47-8|kegg.compound:C06318|umbbd.compound:c0185 Graph (1R,6S)-Dihydroxycyclohexa-2,4-diene-1,4-dicarboxylate|(1R,6S)-dihydroxycyclohexa-2,4-diene-1,4-dicarboxylate|(3S,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid|Terephthalate-1,2-cis-dihydrodiol|cis-4,5-Dihydroxycyclohexa-1(6),2-diene-1,4-dicarboxylate|cis-4,5-dihydroxycyclohexa-1(6),2-diene-1,4-dicarboxylate (3S,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid (1R,6S)-Dihydroxycyclohexa-2,4-diene-1,4-dicarboxylate|(1R,6S)-dihydroxycyclohexa-2,4-diene-1,4-dicarboxylate|(3S,4R)-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate|(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid|Terephthalate-1,2-cis-dihydrodiol|cis-4,5-Dihydroxycyclohexa-1(6),2-diene-1,4-dicarboxylate|cis-4,5-dihydroxycyclohexa-1(6),2-diene-1,4-dicarboxylate http://purl.obolibrary.org/obo/CHEBI_15564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15565 biolink:ChemicalEntity (1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol cas:41977-20-2|kegg.compound:C04592|umbbd.compound:c0283 Graph (1S,2R)-3-Methylcyclohexa-3,5-diene-1,2-diol|(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol|Toluene-cis-1,2-dihydrodiol|Toluene-cis-dihydrodiol (1S,2R)-3-Methylcyclohexa-3,5-diene-1,2-diol|(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol (1S,2R)-3-Methylcyclohexa-3,5-diene-1,2-diol|(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol|Toluene-cis-1,2-dihydrodiol|Toluene-cis-dihydrodiol http://purl.obolibrary.org/obo/CHEBI_15565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15566 biolink:ChemicalEntity (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid kegg.compound:C04687 Graph (1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid (1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate|(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_15566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15567 biolink:ChemicalEntity (1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylic acid kegg.compound:C04670 Graph (1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylic acid (1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylic acid (1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylate|(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_15567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15568 biolink:ChemicalEntity (R)-2-halocarboxylic acid Any carboxylic acid carrying an unspecified halogen substituent at the 2R-position. metacyc.compound:R-2-Haloacids Graph (R)-2-haloacid|(R)-2-haloacids|(R)-2-halocarboxylic acids (R)-2-haloacid|(R)-2-haloacids|(R)-2-halocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_15568 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15570 biolink:ChemicalEntity D-alanine The D-enantiomer of alanine. cas:338-69-2|drugbank:DB01786|ecmdb:ECMDB01310|gmelin:82157|hmdb:HMDB0001310|kegg.compound:C00133|knapsack:C00019654|metacyc.compound:D-ALANINE|pdb-ccd:DAL|pubmed:10977898|pubmed:1450921|pubmed:22005737|pubmed:22075031|pubmed:22123251|pubmed:22313760|pubmed:3275662|reaxys:1720249|ymdb:YMDB00993 Graph (2R)-2-aminopropanoic acid|(R)-2-aminopropanoic acid|(R)-alanine|D-2-Aminopropionic acid|D-Ala|D-Alanin|D-Alanine|D-alanine|D-alpha-alanine|D-alpha-aminopropionic acid|DAL D-Alanine|D-alanine (2R)-2-aminopropanoic acid|(R)-2-aminopropanoic acid|(R)-alanine|D-2-Aminopropionic acid|D-Ala|D-Alanin|D-Alanine|D-alanine|D-alpha-alanine|D-alpha-aminopropionic acid|DAL http://purl.obolibrary.org/obo/CHEBI_15570 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15571 biolink:ChemicalEntity hydrazine beilstein:878137|cas:302-01-2|gmelin:190|kegg.compound:C05361|umbbd.compound:c0651 Graph H2NNH2|Hydrazin|Hydrazine|N2H4|diamine|diazane|hydrazine|nitrogen hydride Hydrazine|diazane|hydrazine H2NNH2|Hydrazin|Hydrazine|N2H4|diamine|diazane|hydrazine|nitrogen hydride http://purl.obolibrary.org/obo/CHEBI_15571 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15573 biolink:ChemicalEntity (2-aminoethyl)phosphonic acid A phosphonic acid in which the hydrogen attached to the phosphorus of phosphonic acid is substituted by a 2-aminoethyl group. cas:2041-14-7|hmdb:HMDB0011747|kegg.compound:C03557|metacyc.compound:CPD-1106|pdb-ccd:P7I|pubmed:21108683|pubmed:4385371|pubmed:4963810|pubmed:6056747|reaxys:1098879 Graph (2-Aminoethane)phosphonic acid|(2-Aminoethyl)phosphonate|(2-aminoethyl)phosphonic acid|2-Aminoethylphosphonate|2-aminoethylphosphonate|Aminoethylphosphonic acid|Ciliatine|Phosphonoethylamine|beta-Aminoethylphosphonic acid (2-aminoethyl)phosphonic acid (2-Aminoethane)phosphonic acid|(2-Aminoethyl)phosphonate|(2-aminoethyl)phosphonic acid|2-Aminoethylphosphonate|2-aminoethylphosphonate|Aminoethylphosphonic acid|Ciliatine|Phosphonoethylamine|beta-Aminoethylphosphonic acid http://purl.obolibrary.org/obo/CHEBI_15573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15574 biolink:ChemicalEntity nuatigenin cas:6811-35-4|kegg.compound:C04715|knapsack:C00003581|lipidmaps:LMST01090001 Graph (20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol|(20S,22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol|(22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol|Nuatigenin|nuatigenin (22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol (20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol|(20S,22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol|(22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol|Nuatigenin|nuatigenin http://purl.obolibrary.org/obo/CHEBI_15574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15575 biolink:ChemicalEntity nuatigenin 3-beta-D-glucopyranoside kegg.compound:C04859 Graph (20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol 3-O-beta-D-glucoside|(20S,22S,25S)-22,25-epoxy-26-hydroxyfurost-5-en-3beta-yl beta-D-glucopyranoside|(22S,25S)-26-hydroxy-22,25-epoxyfurost-5-en-3beta-yl beta-D-glucopyranoside|nuatigenin 3-beta-D-glucopyranoside (22S,25S)-26-hydroxy-22,25-epoxyfurost-5-en-3beta-yl beta-D-glucopyranoside (20S,22S,25S)-22,25-Epoxyfurost-5-ene-3beta,26-diol 3-O-beta-D-glucoside|(20S,22S,25S)-22,25-epoxy-26-hydroxyfurost-5-en-3beta-yl beta-D-glucopyranoside|(22S,25S)-26-hydroxy-22,25-epoxyfurost-5-en-3beta-yl beta-D-glucopyranoside|nuatigenin 3-beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_15575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15577 biolink:ChemicalEntity (3beta,24R,24'R)-fucosterol epoxide beilstein:4712006|kegg.compound:C03910 Graph (24R,24'R)-Fucosterol epoxide|(24R,24(1)R)-24,24(1)-epoxystigmast-5-en-3beta-ol|(24R,24(1)R)-fucosterol epoxide|(24R,28R)-24,28-epoxystigmast-5-en-3beta-ol|(24R,28R)-Fucosterol epoxide (24R,24(1)R)-24,24(1)-epoxystigmast-5-en-3beta-ol|(24R,28R)-24,28-epoxystigmast-5-en-3beta-ol (24R,24'R)-Fucosterol epoxide|(24R,24(1)R)-24,24(1)-epoxystigmast-5-en-3beta-ol|(24R,24(1)R)-fucosterol epoxide|(24R,28R)-24,28-epoxystigmast-5-en-3beta-ol|(24R,28R)-Fucosterol epoxide http://purl.obolibrary.org/obo/CHEBI_15577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15578 biolink:ChemicalEntity (25S)-5beta-spirostan-3beta-ol beilstein:91757|cas:126-19-2|kegg.compound:C03963|knapsack:C00003590 Graph (25S)-5-beta-spirostan-3-beta-ol|(25S)-5beta-Spirostan-3beta-ol|(25S)-5beta-spirostan-3beta-ol|(3beta,5beta,25S)-spirostan-3-ol|Parigenin|Sarsasapogenin (25S)-5beta-Spirostan-3beta-ol|(25S)-5beta-spirostan-3beta-ol (25S)-5-beta-spirostan-3-beta-ol|(25S)-5beta-Spirostan-3beta-ol|(25S)-5beta-spirostan-3beta-ol|(3beta,5beta,25S)-spirostan-3-ol|Parigenin|Sarsasapogenin http://purl.obolibrary.org/obo/CHEBI_15578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15579 biolink:ChemicalEntity (25S)-5beta-spirostan-3beta-yl beta-D-glucoside beilstein:99976|cas:14835-43-9|kegg.compound:C08886|knapsack:C00003563|lipidmaps:LMST01080008|pubmed:36500218 Graph (25S)-5-beta-spirostan-3-beta-yl beta-D-glucoside|(25S)-5beta-Spirostan-3beta-ol 3-O-beta-D-glucoside|(25S)-5beta-spirostan-3beta-ol 3-O-beta-D-glucoside|(25S)-5beta-spirostan-3beta-yl beta-D-glucopyranoside|asparagoside A (25S)-5beta-spirostan-3beta-yl beta-D-glucopyranoside (25S)-5-beta-spirostan-3-beta-yl beta-D-glucoside|(25S)-5beta-Spirostan-3beta-ol 3-O-beta-D-glucoside|(25S)-5beta-spirostan-3beta-ol 3-O-beta-D-glucoside|(25S)-5beta-spirostan-3beta-yl beta-D-glucopyranoside|asparagoside A http://purl.obolibrary.org/obo/CHEBI_15579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15580 biolink:ChemicalEntity (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid A C16 polyunsaturated fatty acid that is the (10R,11S)-epoxy derivative of trideca-2,6-dienoic acid. kegg.compound:C04834|lipidmaps:LMFA01070019 Graph (2E,6E)-(10R,11S)-10,11-Epoxy-3,7,11-trimethyltrideca-2,6-dienoate|(2E,6E)-(10R,11S)-10,11-Epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid|(2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate|(2E,6E)-10,11-Epoxy-3,7,11-trimethyltridecadienoic acid|(2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoic acid (2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoic acid (2E,6E)-(10R,11S)-10,11-Epoxy-3,7,11-trimethyltrideca-2,6-dienoate|(2E,6E)-(10R,11S)-10,11-Epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid|(2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate|(2E,6E)-10,11-Epoxy-3,7,11-trimethyltridecadienoic acid|(2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoic acid http://purl.obolibrary.org/obo/CHEBI_15580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15581 biolink:ChemicalEntity juvenile hormone II A member of the juvenile hormone family of compounds that is the methyl ester of (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid. cas:34218-61-6|kegg.compound:C04867|lipidmaps:LMFA01070020|pubmed:2134167|pubmed:22375690|pubmed:3350118|reaxys:1685515 Graph (10R,11S)-(+)-Juvenile hormone II|(10R,11S)-Juvenile hormone II|12-Homojuvenate|Cecropia juvenile hormone II|JH II|Juvenile hormone 2|Methyl (2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate|Methyl (2E,6E)-cis-10,11-epoxy-3,7,11-trimethyl-2,6-tridecadienoate|Methyl 3,7,11-trimethyl-cis-10,11-oxido-trans,trans-2,6-tridecadienoate|cis-10,11-Epoxy-11-ethyl-3,7-dimethyl-2-trans-6-trans-tridecadienoic acid methyl ester|juvenile hormone II|methyl (2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate|methyl (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate methyl (2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate|methyl (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate (10R,11S)-(+)-Juvenile hormone II|(10R,11S)-Juvenile hormone II|12-Homojuvenate|Cecropia juvenile hormone II|JH II|Juvenile hormone 2|Methyl (2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate|Methyl (2E,6E)-cis-10,11-epoxy-3,7,11-trimethyl-2,6-tridecadienoate|Methyl 3,7,11-trimethyl-cis-10,11-oxido-trans,trans-2,6-tridecadienoate|cis-10,11-Epoxy-11-ethyl-3,7-dimethyl-2-trans-6-trans-tridecadienoic acid methyl ester|juvenile hormone II|methyl (2E,6E)-9-[(2R,3S)-3-ethyl-3-methyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate|methyl (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate http://purl.obolibrary.org/obo/CHEBI_15581 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155814 biolink:ChemicalEntity Cer(d40:2) Graph http://purl.obolibrary.org/obo/CHEBI_155814 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:155817 biolink:ChemicalEntity HexCer(d34:1) Graph HexCer d34:1 HexCer d34:1 http://purl.obolibrary.org/obo/CHEBI_155817 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15582 biolink:ChemicalEntity (2R,3S)-2,3-dimethylmalic acid The (2R,3S)-diastereomer of 2,3-dimethylmalic acid. kegg.compound:C03652|pubmed:527937|pubmed:7141415|reaxys:1725262 Graph (2R,3S)-2,3-Dimethylmalate|(2R,3S)-2,3-dimethylmalate|(2R,3S)-2-hydroxy-2,3-dimethylbutanedioic acid (2R,3S)-2-hydroxy-2,3-dimethylbutanedioic acid (2R,3S)-2,3-Dimethylmalate|(2R,3S)-2,3-dimethylmalate|(2R,3S)-2-hydroxy-2,3-dimethylbutanedioic acid http://purl.obolibrary.org/obo/CHEBI_15582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15583 biolink:ChemicalEntity (R)-2-ethylmalic acid The (R)-enantiomer of 2-ethylmalic acid. kegg.compound:C02488 Graph (2R)-2-ethyl-2-hydroxybutanedioic acid|(R)-2-Ethylmalate|(R)-2-ethylmalate (2R)-2-ethyl-2-hydroxybutanedioic acid (2R)-2-ethyl-2-hydroxybutanedioic acid|(R)-2-Ethylmalate|(R)-2-ethylmalate http://purl.obolibrary.org/obo/CHEBI_15583 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155830 biolink:ChemicalEntity N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine(1-) Graph N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine http://purl.obolibrary.org/obo/CHEBI_155830 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:155834 biolink:ChemicalEntity phosphatidylethanolamine 34:1 Graph PE 34:1|PE(34:1)|phosphatidylethanolamine(34:1) PE 34:1|PE(34:1)|phosphatidylethanolamine(34:1) http://purl.obolibrary.org/obo/CHEBI_155834 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:155835 biolink:ChemicalEntity phosphatidylethanolamine 34:2 Graph PE 34:2|PE(34:2)|phosphatidylethanolamine(34:2) PE 34:2|PE(34:2)|phosphatidylethanolamine(34:2) http://purl.obolibrary.org/obo/CHEBI_155835 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:155837 biolink:ChemicalEntity tripeptide zwitterion A peptide zwitterion obtained from the tranfer of a proton from the carboxy group to the amino group of any tripeptide. It contains an equal number of positively-charged and negatively-charged functional groups. Major structure at pH 7.3. Graph L-amino acid tripeptide zwitterion|L-amino acid tripeptide zwitterions|amino acid tripeptide zwitterion|amino acid tripeptide zwitterions|an L-amino acid tripeptide L-amino acid tripeptide zwitterion|L-amino acid tripeptide zwitterions|amino acid tripeptide zwitterion|amino acid tripeptide zwitterions|an L-amino acid tripeptide http://purl.obolibrary.org/obo/CHEBI_155837 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15584 biolink:ChemicalEntity citramalic acid A 2-hydroxydicarboxylic acid that is malic acid (hydroxysuccinic acid) in which the hydrogen at position 2 is substituted by a methyl group. cas:2306-22-1|hmdb:HMDB0000426|kegg.compound:C00815|knapsack:C00001181|patent:US5650440|pubmed:13160012|pubmed:14470458|pubmed:17439666|pubmed:21871058|pubmed:6145530|pubmed:7408203|reaxys:1723817|ymdb:YMDB01584 Graph (+-)-2-hydroxy-2-methylsuccinic acid|2-Methylmalic acid|2-hydroxy-2-methylbutanedioic acid|2-hydroxy-2-methylsuccinic acid|2-methylmalic acid|Citramalic acid|alpha-Hydroxypyrotartaric acid|alpha-hydroxypyrotartaric acid|citramalic acids 2-hydroxy-2-methylbutanedioic acid (+-)-2-hydroxy-2-methylsuccinic acid|2-Methylmalic acid|2-hydroxy-2-methylbutanedioic acid|2-hydroxy-2-methylsuccinic acid|2-methylmalic acid|Citramalic acid|alpha-Hydroxypyrotartaric acid|alpha-hydroxypyrotartaric acid|citramalic acids http://purl.obolibrary.org/obo/CHEBI_15584 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15586 biolink:ChemicalEntity D-citramalic acid The D-enantiomer of citramalic acid. kegg.compound:C02612 Graph (2R)-2-Hydroxy-2-methylbutanedioate|(2R)-2-hydroxy-2-methylbutanedioic acid|(2R)-2-hydroxy-2-methylsuccinic acid|(3R)-Citramalic acid|(3R)-alpha-Hydroxypyrotartaric acid|(R)-2-Methylmalic acid|D-(-)-2-methylmalic acid|D-Citramalic acid|D-alpha-Hydroxypyrotartaric acid (2R)-2-hydroxy-2-methylbutanedioic acid (2R)-2-Hydroxy-2-methylbutanedioate|(2R)-2-hydroxy-2-methylbutanedioic acid|(2R)-2-hydroxy-2-methylsuccinic acid|(3R)-Citramalic acid|(3R)-alpha-Hydroxypyrotartaric acid|(R)-2-Methylmalic acid|D-(-)-2-methylmalic acid|D-Citramalic acid|D-alpha-Hydroxypyrotartaric acid http://purl.obolibrary.org/obo/CHEBI_15586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15587 biolink:ChemicalEntity (R)-3,3-dimethylmalic acid The (R)-enantiomer of 3,3-dimethylmalic acid. kegg.compound:C01088 Graph (3R)-3-hydroxy-2,2-dimethylbutanedioic acid|(R)-3,3-Dimethylmalate|(R)-3,3-dimethylmalate (3R)-3-hydroxy-2,2-dimethylbutanedioic acid (3R)-3-hydroxy-2,2-dimethylbutanedioic acid|(R)-3,3-Dimethylmalate|(R)-3,3-dimethylmalate http://purl.obolibrary.org/obo/CHEBI_15587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155878 biolink:ChemicalEntity D-idopyranose The pyranose form of D-idose. glytoucan:G97146EI Graph D-Idop|D-idopyranose D-Idop|D-idopyranose D-Idop|D-idopyranose http://purl.obolibrary.org/obo/CHEBI_155878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15588 biolink:ChemicalEntity (R)-malate(2-) An optically active form of malate having (R)-configuration. kegg.compound:C00497|metacyc.compound:CPD-660 Graph (2R)-2-hydroxybutanedioate|(R)-malate|D-malate (2R)-2-hydroxybutanedioate (2R)-2-hydroxybutanedioate|(R)-malate|D-malate http://purl.obolibrary.org/obo/CHEBI_15588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155885 biolink:ChemicalEntity alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base(1-) metacyc.compound:VLC-MIPC Graph (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-{[6-O-(alpha-D-mannosyl)-1D-myo-inositol-1-O-yl]hydroxyphosphoryl}sphinganine|an alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-{[6-O-(alpha-D-mannosyl)-1D-myo-inositol-1-O-yl]hydroxyphosphoryl}sphinganine (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-{[6-O-(alpha-D-mannosyl)-1D-myo-inositol-1-O-yl]hydroxyphosphoryl}sphinganine|an alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base http://purl.obolibrary.org/obo/CHEBI_155885 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15589 biolink:ChemicalEntity (S)-malate(2-) An optically active form of malate having (S)-configuration. kegg.compound:C00149|metacyc.compound:MAL|reaxys:4133558 Graph (2S)-2-hydroxybutanedioate|(S)-malate|L-malate (2S)-2-hydroxybutanedioate (2S)-2-hydroxybutanedioate|(S)-malate|L-malate http://purl.obolibrary.org/obo/CHEBI_15589 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15590 biolink:ChemicalEntity 2,3-dimethylmalic acid A 2-hydroxydicarboxylic acid that is malic acid substituted by methyl groups at positions 2 and 3. lipidmaps:LMFA01050470|pubmed:527937|pubmed:7399408 Graph 2-hydroxy-2,3-dimethylbutanedioic acid|2-hydroxy-2,3-dimethylsuccinic acid 2-hydroxy-2,3-dimethylbutanedioic acid 2-hydroxy-2,3-dimethylbutanedioic acid|2-hydroxy-2,3-dimethylsuccinic acid http://purl.obolibrary.org/obo/CHEBI_15590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155900 biolink:ChemicalEntity 4-quinolone A quinolone that is 1,4-dihydroquinoline substituted by an oxo group at position 4. cas:529-37-3|pubmed:7840594|pubmed:7884804|wikipedia.en:4-Quinolone Graph 1,4-dihydroquinolin-4-one|1H-quinolin-4-one|4(1H)-quinolinone|quinolin-4(1H)-one quinolin-4(1H)-one 1,4-dihydroquinolin-4-one|1H-quinolin-4-one|4(1H)-quinolinone|quinolin-4(1H)-one http://purl.obolibrary.org/obo/CHEBI_155900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155902 biolink:ChemicalEntity 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one A member of the class of butenolides that is furan-2(5H)-one substituted by 4-hydroxyphenyl, hydroxy and 4-hydroxybenzylidene groups at positions 3, 4 and 5, respectively. Graph 4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2(5H)-one|4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one 4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2(5H)-one|4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one http://purl.obolibrary.org/obo/CHEBI_155902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155904 biolink:ChemicalEntity (+)-albicanol A drimane-type sesquiterpenoid orginally isolated from the liverwort Diplophyllum albicans. It exhibits fish antifeedant, antifungal and antineoplastic activities. cas:54632-04-1|knapsack:C00020283|pmc:PMC7278516|pubmed:10959585|pubmed:11440150|pubmed:12130851|pubmed:12350155|pubmed:16913486|pubmed:18310958|pubmed:19594165|pubmed:19801866|pubmed:22660771|pubmed:24647035|pubmed:32548177 Graph (1S,4aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1-methanol|(4aalpha)-2-methylene-5,5,8abeta-trimethyldecalin-1beta-methanol|(4aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1beta-methanol|(8aS)-albicanol|[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]methanol|albicanol [(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]methanol (1S,4aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1-methanol|(4aalpha)-2-methylene-5,5,8abeta-trimethyldecalin-1beta-methanol|(4aalpha)-decahydro-5,5,8abeta-trimethyl-2-methylenenaphthalene-1beta-methanol|(8aS)-albicanol|[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]methanol|albicanol http://purl.obolibrary.org/obo/CHEBI_155904 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15591 biolink:ChemicalEntity 3-ethylmalic acid The 2-hydroxy-3-ethyl derivative of succinic acid. kegg.compound:C01989 Graph 2-ethyl-3-hydroxybutanedioic acid|3-Ethylmalate 2-ethyl-3-hydroxybutanedioic acid 2-ethyl-3-hydroxybutanedioic acid|3-Ethylmalate http://purl.obolibrary.org/obo/CHEBI_15591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15592 biolink:ChemicalEntity 3-isopropylmalate(2-) A dicarboxylic acid dianion resulting from deprotonation of both carboxy groups of 3-isopropylmalic acid. Graph 2-hydroxy-3-(propan-2-yl)butanedioate|2-hydroxy-3-isopropylsuccinate 2-hydroxy-3-(propan-2-yl)butanedioate 2-hydroxy-3-(propan-2-yl)butanedioate|2-hydroxy-3-isopropylsuccinate http://purl.obolibrary.org/obo/CHEBI_15592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155926 biolink:ChemicalEntity 1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base(1-) Graph (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-[(1D-myo-inositol-1-O-yl)hydroxyphosphoryl]sphinganine|a 1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-[(1D-myo-inositol-1-O-yl)hydroxyphosphoryl]sphinganine (4R)-4-hydroxy-N-[(2R)-2-hydroxy-very-long-chain-acyl]-1-O-[(1D-myo-inositol-1-O-yl)hydroxyphosphoryl]sphinganine|a 1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base http://purl.obolibrary.org/obo/CHEBI_155926 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15593 biolink:ChemicalEntity 3-oxalomalate(3-) A tricarboxylic acid trianion that is the conjugate base of 3-oxalomalic acid. kegg.compound:C01990 Graph 1-hydroxy-3-oxopropane-1,2,3-tricarboxylate|3-oxalomalate 1-hydroxy-3-oxopropane-1,2,3-tricarboxylate 1-hydroxy-3-oxopropane-1,2,3-tricarboxylate|3-oxalomalate http://purl.obolibrary.org/obo/CHEBI_15593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:155932 biolink:ChemicalEntity alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-(R)-4-hydroxysphingoid base(1-) A mannosyl-α-1→6-inositol-1-phospho-N-(2-hydroxyacyl)-phytoceramide(1−) in which the acyl group has a chain length greater than 22 carbon atoms. pubmed:9323360 Graph N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base-1-phospho-(6-O-alpha-D-mannosyl)-1D-myo-inositol (1-)|an alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-(R)-4-hydroxysphingoid base|mannosylinositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base(1-)|mannosylinositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base(1-) N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base-1-phospho-(6-O-alpha-D-mannosyl)-1D-myo-inositol (1-)|an alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-(R)-4-hydroxysphingoid base|mannosylinositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base(1-)|mannosylinositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-phytosphingoid base(1-) http://purl.obolibrary.org/obo/CHEBI_155932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15594 biolink:ChemicalEntity 3-propylmalate(2-) A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of 3-propylmalic acid. kegg.compound:C02123 Graph 2-hydroxy-3-propylbutanedioate|2-hydroxy-3-propylsuccinate|3-propylmalate 2-hydroxy-3-propylbutanedioate 2-hydroxy-3-propylbutanedioate|2-hydroxy-3-propylsuccinate|3-propylmalate http://purl.obolibrary.org/obo/CHEBI_15594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15595 biolink:ChemicalEntity malate(2-) A C4-dicarboxylate resulting from deprotonation of both carboxy groups of malic acid. cas:149-61-1|gmelin:327305|kegg.compound:C00711|pubmed:17190852|reaxys:3664410 Graph 2-hydroxybutanedioate|hydroxybutanedioic acid, ion(2-)|mal|malate|malate anion|malate dianion 2-hydroxybutanedioate 2-hydroxybutanedioate|hydroxybutanedioic acid, ion(2-)|mal|malate|malate anion|malate dianion http://purl.obolibrary.org/obo/CHEBI_15595 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15596 biolink:ChemicalEntity sinapic acid (S)-malate ester The 4-O-(S)-malate derivative of sinapic acid. kegg.compound:C02887 Graph 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)prop-2-enoic acid|Sinapoyl-(S)-malate 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)prop-2-enoic acid 3-(4-{[(2S)-3-carboxy-2-hydroxypropanoyl]oxy}-3,5-dimethoxyphenyl)prop-2-enoic acid|Sinapoyl-(S)-malate http://purl.obolibrary.org/obo/CHEBI_15596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15597 biolink:ChemicalEntity (2R)-2-O-phosphonato-3-sulfonatolactate(4-) A quadruply-charged carboxyalkyl phosphate oxoanion resulting from global deprotonation of (2R)-O-phospho-3-sulfolactic acid. Graph (2R)-2-(phosphonatooxy)-3-sulfonatopropanoate|(2R)-2-O-phosphonato-3-sulfonatolactate|(2R)-O-phospho-3-sulfolactate (2R)-2-(phosphonatooxy)-3-sulfonatopropanoate (2R)-2-(phosphonatooxy)-3-sulfonatopropanoate|(2R)-2-O-phosphonato-3-sulfonatolactate|(2R)-O-phospho-3-sulfolactate http://purl.obolibrary.org/obo/CHEBI_15597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15598 biolink:ChemicalEntity 2-methylcitrate(3-) A tricarboxylic acid trianion that is the conjugate base of 2-methylcitric acid. kegg.compound:C02225 Graph 2-Hydroxybutane-1,2,3-tricarboxylate|2-Methylcitrate|2-hydroxybutane-1,2,3-tricarboxylate|2-methylcitrate 2-hydroxybutane-1,2,3-tricarboxylate 2-Hydroxybutane-1,2,3-tricarboxylate|2-Methylcitrate|2-hydroxybutane-1,2,3-tricarboxylate|2-methylcitrate http://purl.obolibrary.org/obo/CHEBI_15598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15599 biolink:ChemicalEntity cis-3-phenylcyclohexa-3,5-diene-1,2-diol beilstein:6801441|kegg.compound:C06589 Graph cis-2,3-Dihydro-2,3-dihydroxybiphenyl|cis-3-Phenylcyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol rel-(1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol cis-2,3-Dihydro-2,3-dihydroxybiphenyl|cis-3-Phenylcyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_15599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15600 biolink:ChemicalEntity (+)-catechin The (+)-enantiomer of catechin and a polyphenolic antioxidant plant metabolite. cas:154-23-4|drugcentral:629|hmdb:HMDB0002780|kegg.compound:C06562|knapsack:C00000947|lipidmaps:LMPK12020001|metacyc.compound:CPD-1961|pdb-ccd:KXN|pubmed:10617953|pubmed:11196148|pubmed:1502708|pubmed:8224433|pubmed:9438556|reaxys:92761|wikipedia.en:Catechin Graph (+)-(2R,3S)-5,7,3',4'-Tetrahydroxyflavan-3-ol|(+)-3',4',5,7-Tetrahydroxy-2,3-trans-flavan-3-ol|(+)-Catechin|(+)-Catechol|(+)-Cyanidan-3-ol|(2R,3S)-(+)-Catechin|(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-1H-chromene-3,5,7-triol|(2R,3S)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol|(2R,3S)-Catechin|(2R,3S)-catechin|(2R-trans)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-Benzopyran-3,5,7-triol|Cianidanol|Cyanidanol|D-Catechin|catechuic acid (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-1H-chromene-3,5,7-triol (+)-(2R,3S)-5,7,3',4'-Tetrahydroxyflavan-3-ol|(+)-3',4',5,7-Tetrahydroxy-2,3-trans-flavan-3-ol|(+)-Catechin|(+)-Catechol|(+)-Cyanidan-3-ol|(2R,3S)-(+)-Catechin|(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-1H-chromene-3,5,7-triol|(2R,3S)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol|(2R,3S)-Catechin|(2R,3S)-catechin|(2R-trans)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-Benzopyran-3,5,7-triol|Cianidanol|Cyanidanol|D-Catechin|catechuic acid http://purl.obolibrary.org/obo/CHEBI_15600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15601 biolink:ChemicalEntity (2R,4S)-2,4-diaminopentanoate A 2,4-diaminopentanoate that is the conjugate base of (2R,4S)-2,4-diaminopentanoic acid. Graph (2R,4S)-2,4-diaminopentanoate|(2R,4S)-2,4-diaminovalerate|D-threo-2,4-diaminopentanoate (2R,4S)-2,4-diaminopentanoate (2R,4S)-2,4-diaminopentanoate|(2R,4S)-2,4-diaminovalerate|D-threo-2,4-diaminopentanoate http://purl.obolibrary.org/obo/CHEBI_15601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15602 biolink:ChemicalEntity (2S)-2-[(R)-1-carboxyethylamino]pentanoate A dicarboxylic acid monoanion that is the conjugate base of (2S)-2-[(R)-1-carboxyethylamino]pentanoic acid. kegg.compound:C06326 Graph (2S)-2-{[(1R)-1-carboxyethyl]amino}pentanoate|(2S)-2-{[(1R)-1-carboxyethyl]amino}valerate|(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate|(2S)-2-{[1-(R)-carboxyethyl]amino}pentanoate|N-[(1R)-1-carboxyethyl]-L-norvalinate (2S)-2-{[(1R)-1-carboxyethyl]amino}pentanoate|N-[(1R)-1-carboxyethyl]-L-norvalinate (2S)-2-{[(1R)-1-carboxyethyl]amino}pentanoate|(2S)-2-{[(1R)-1-carboxyethyl]amino}valerate|(2S)-2-{[1-(R)-Carboxyethyl]amino}pentanoate|(2S)-2-{[1-(R)-carboxyethyl]amino}pentanoate|N-[(1R)-1-carboxyethyl]-L-norvalinate http://purl.obolibrary.org/obo/CHEBI_15602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156029 biolink:ChemicalEntity phosphatidylglycerol 38:6 Graph PG 38:6|PG(38:6) PG 38:6|PG(38:6) http://purl.obolibrary.org/obo/CHEBI_156029 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15603 biolink:ChemicalEntity L-leucine The L-enantiomer of leucine. cas:61-90-5|drugbank:DB00149|drugcentral:1557|ecmdb:ECMDB00687|gmelin:50204|hmdb:HMDB0000687|kegg.compound:C00123|kegg.drug:D00030|knapsack:C00001377|metacyc.compound:LEU|pdb-ccd:LEU_LFOH|pubmed:17609475|pubmed:22735334|pubmed:24206068|pubmed:24333966|pubmed:8798704|reaxys:1721722|wikipedia.en:Leucine|ymdb:YMDB00387 Graph (2S)-2-amino-4-methylpentanoic acid|(2S)-alpha-2-Amino-4-methylvaleric acid|(2S)-alpha-Leucine|(S)-(+)-leucine|(S)-leucine|2-Amino-4-methylvaleric acid|L|L-Leucin|L-Leucine|L-Leuzin|L-leucine|LEUCINE|Leu L-Leucine|L-leucine|LEUCINE (2S)-2-amino-4-methylpentanoic acid|(2S)-alpha-2-Amino-4-methylvaleric acid|(2S)-alpha-Leucine|(S)-(+)-leucine|(S)-leucine|2-Amino-4-methylvaleric acid|L|L-Leucin|L-Leucine|L-Leuzin|L-leucine|LEUCINE|Leu http://purl.obolibrary.org/obo/CHEBI_15603 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156030 biolink:ChemicalEntity phosphatidylglycerol 40:5 Graph PG 40:5|PG(40:5) PG 40:5|PG(40:5) http://purl.obolibrary.org/obo/CHEBI_156030 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156031 biolink:ChemicalEntity phosphatidylglycerol 40:6 Graph PG 40:6|PG(40:6) PG 40:6|PG(40:6) http://purl.obolibrary.org/obo/CHEBI_156031 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156032 biolink:ChemicalEntity phosphatidylglycerol 36:3 Graph PG 36:3|PG(36:3) PG 36:3|PG(36:3) http://purl.obolibrary.org/obo/CHEBI_156032 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156034 biolink:ChemicalEntity phosphatidylglycerol 38:3 Graph PG 38:3|PG(38:3) PG 38:3|PG(38:3) http://purl.obolibrary.org/obo/CHEBI_156034 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156035 biolink:ChemicalEntity phosphatidylglycerol 38:5 Graph PG 38:5|PG(38:5) PG 38:5|PG(38:5) http://purl.obolibrary.org/obo/CHEBI_156035 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156036 biolink:ChemicalEntity phosphatidylglycerol 40:7 Graph PG 40:7|PG(40:7) PG 40:7|PG(40:7) http://purl.obolibrary.org/obo/CHEBI_156036 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156039 biolink:ChemicalEntity phosphatidylglycerol 44:12 Graph PG 44:12|PG(44:12) PG 44:12|PG(44:12) http://purl.obolibrary.org/obo/CHEBI_156039 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15604 biolink:ChemicalEntity (3R)-beta-leucine The (3R)-β-isomer of leucine. cas:5699-54-7|kegg.compound:C02486|metacyc.compound:CPD-2041|pubmed:3356699|reaxys:1721066 Graph (3R)-3-Amino-4-methylpentanoic acid|(3R)-3-Amino-4-methylvaleric acid|(3R)-3-amino-4-methylpentanoic acid|(3R)-beta-2-amino-4-methylvaleric acid|(3R)-beta-Leucine|(3R)-beta-leucine|L-beta-Leucine (3R)-3-amino-4-methylpentanoic acid (3R)-3-Amino-4-methylpentanoic acid|(3R)-3-Amino-4-methylvaleric acid|(3R)-3-amino-4-methylpentanoic acid|(3R)-beta-2-amino-4-methylvaleric acid|(3R)-beta-Leucine|(3R)-beta-leucine|L-beta-Leucine http://purl.obolibrary.org/obo/CHEBI_15604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156040 biolink:ChemicalEntity phosphatidylinositol 40:5 Graph PI 40:5|PI(40:5) PI 40:5|PI(40:5) http://purl.obolibrary.org/obo/CHEBI_156040 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156044 biolink:ChemicalEntity phosphatidylinositol 40:7 Graph PI 40:7|PI(40:7) PI 40:7|PI(40:7) http://purl.obolibrary.org/obo/CHEBI_156044 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15605 biolink:ChemicalEntity (2S)-flavan-4-ol A hydroxyflavan that is (2S)-flavan substituted by a hydroxy group at position 4. kegg.compound:C02345 Graph (2S)-2-phenyl-3,4-dihydro-2H-chromen-4-ol|(2S)-2-phenylchroman-4-ol|(2S)-Flavan-4-ol|(2S)-flavan-4-ol (2S)-2-phenyl-3,4-dihydro-2H-chromen-4-ol (2S)-2-phenyl-3,4-dihydro-2H-chromen-4-ol|(2S)-2-phenylchroman-4-ol|(2S)-Flavan-4-ol|(2S)-flavan-4-ol http://purl.obolibrary.org/obo/CHEBI_15605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15606 biolink:ChemicalEntity (2S)-flavanone The (S)-enantiomer of flavanone. beilstein:5379356|beilstein:85288|kegg.compound:C02099|reaxys:85288 Graph (2S)-2-phenyl-2,3-dihydro-4H-chromen-4-one|(2S)-Flavanone|(2S)-flavanone (2S)-2-phenyl-2,3-dihydro-4H-chromen-4-one (2S)-2-phenyl-2,3-dihydro-4H-chromen-4-one|(2S)-Flavanone|(2S)-flavanone http://purl.obolibrary.org/obo/CHEBI_15606 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156068 biolink:ChemicalEntity alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose(1-) The conjugate base of α-N-acetylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-D-glucose arising from deprotonation of the neuraminosyl carboxy group; major species at pH 7.3. pubmed:14613940|pubmed:22228546 Graph N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose|alpha-NeuAc-(2->3)-beta-D-Gal-(1->4)-D-Glc(1-) N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose|alpha-NeuAc-(2->3)-beta-D-Gal-(1->4)-D-Glc(1-) http://purl.obolibrary.org/obo/CHEBI_156068 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15607 biolink:ChemicalEntity (2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid A 3-hydroxybutane-1,2,3-tricarboxylic acid which has (2S,3R) configuration. cas:71183-66-9|kegg.compound:C04593|lipidmaps:LMFA01050444|pdb-ccd:MIC Graph (2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate|(2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-4-C-methyl-L-threo-pentaric acid|Methylisocitric acid (2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate|(2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid (2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate|(2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-4-C-methyl-L-threo-pentaric acid|Methylisocitric acid http://purl.obolibrary.org/obo/CHEBI_15607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15608 biolink:ChemicalEntity (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid The (2S,3S)-diastereomer of 2-hydroxytridecane-1,2,3-tricarboxylic acid. kegg.compound:C04655 Graph (2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid (2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid (2S,3S)-2-Hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate|(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_15608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156095 biolink:ChemicalEntity lumefantrine A member of the class of fluorenes that is 9-(p-chlorobenzylidene)-9H-fluorene which is substitutec by chlorine at positions 2 and 7, and by a 2-(dibutylamino)-1-hydroxyethyl group at position 4. An antimalarial drug used in combination with artemether for the treatment of multi-drug resistant strains of falciparum malaria. beilstein:8811003|cas:82186-77-4|drugbank:DB06708|drugcentral:1617|kegg.drug:D03821|pubmed:12565929|pubmed:12699750|pubmed:12798326|wikipedia.en:Lumefantrine Graph (+-)-2,7-Dichloro-9-((Z)-p-chlorobenzylidene)-alpha-((dibutylamino)methyl)fluorene-4-methanol|2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol|2-Dibutylamino-1-[2,7-dichloro-9-(4-chloro-benzylidene)-9H-fluoren-4-yl]-ethanol|2-Dibutylamino-1-{2,7-dichloro-9-[1-(4-chloro-phenyl)-meth-(Z)-ylidene]-9H-fluoren-4-yl}-ethanol|Benflumetol|Lumefantrine|dl-Benflumelol 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol (+-)-2,7-Dichloro-9-((Z)-p-chlorobenzylidene)-alpha-((dibutylamino)methyl)fluorene-4-methanol|2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol|2-Dibutylamino-1-[2,7-dichloro-9-(4-chloro-benzylidene)-9H-fluoren-4-yl]-ethanol|2-Dibutylamino-1-{2,7-dichloro-9-[1-(4-chloro-phenyl)-meth-(Z)-ylidene]-9H-fluoren-4-yl}-ethanol|Benflumetol|Lumefantrine|dl-Benflumelol http://purl.obolibrary.org/obo/CHEBI_156095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15611 biolink:ChemicalEntity sarcosine A N-alkylglycine that is the N-methyl derivative of glycine. It is an intermediate in the metabolic pathway of glycine. cas:107-97-1|gmelin:2018|hmdb:HMDB0000271|kegg.compound:C00213|metacyc.compound:SARCOSINE|pdb-ccd:SAR|pubmed:11272730|pubmed:11850512|pubmed:15023571|pubmed:15331688|pubmed:16154544|pubmed:17095900|pubmed:17190852|pubmed:17901997|pubmed:19433577|pubmed:19577367|pubmed:19619564|pubmed:19944746|reaxys:1699442|umbbd.compound:c0135|wikipedia.en:Sarcosine Graph (methylamino)acetic acid|(methylamino)ethanoic acid|L-sarcosine|MeGly|N-Methylglycine|N-methylaminoacetic acid|SARCOSINE|Sar|Sarcosine|methylaminoacetic acid|sarcosine|sarcosinic acid SARCOSINE|Sarcosine|sarcosine (methylamino)acetic acid|(methylamino)ethanoic acid|L-sarcosine|MeGly|N-Methylglycine|N-methylaminoacetic acid|SARCOSINE|Sar|Sarcosine|methylaminoacetic acid|sarcosine|sarcosinic acid http://purl.obolibrary.org/obo/CHEBI_15611 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15613 biolink:ChemicalEntity (3S)-3,6-diaminohexanoic acid A chiral diamino acid consisting of hexanoic acid having amino substituents at the 3- and 6-positions and (S)-configuration. kegg.compound:C01142 Graph (3S)-3,6-Diaminohexanoate|(3S)-3,6-diaminohexanoic acid|L-beta-Lysine|L-beta-lysine (3S)-3,6-diaminohexanoic acid (3S)-3,6-Diaminohexanoate|(3S)-3,6-diaminohexanoic acid|L-beta-Lysine|L-beta-lysine http://purl.obolibrary.org/obo/CHEBI_15613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156132 biolink:ChemicalEntity L-thialysinium metacyc.compound:S-2-AMINOETHYL-L-CYSTEINE|pubmed:14766574 Graph S-(2-aminoethyl)-L-cysteine|S-(beta-aminoethyl)-L-cysteine S-(2-aminoethyl)-L-cysteine|S-(beta-aminoethyl)-L-cysteine http://purl.obolibrary.org/obo/CHEBI_156132 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15614 biolink:ChemicalEntity (S)-3-methyl-2-oxovaleric acid The (S)-enantiomer of 3-methyl-2-oxovaleric acid. beilstein:1722136|kegg.compound:C00671|lipidmaps:LMFA01020275|pubmed:1638756 Graph (3S)-2-oxo-3-methyl-n-valeric acid|(3S)-3-Methyl-2-oxopentanoic acid|(3S)-3-methyl-2-oxopentanoic acid|(S)-2-oxo-3-methylpentanoic acid|(S)-3-Methyl-2-oxopentanoate|(S)-3-Methyl-2-oxopentanoic acid|(S)-3-methyl-2-oxovaleric acid|(S)-OMV (3S)-3-Methyl-2-oxopentanoic acid|(3S)-3-methyl-2-oxopentanoic acid (3S)-2-oxo-3-methyl-n-valeric acid|(3S)-3-Methyl-2-oxopentanoic acid|(3S)-3-methyl-2-oxopentanoic acid|(S)-2-oxo-3-methylpentanoic acid|(S)-3-Methyl-2-oxopentanoate|(S)-3-Methyl-2-oxopentanoic acid|(S)-3-methyl-2-oxovaleric acid|(S)-OMV http://purl.obolibrary.org/obo/CHEBI_15614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15615 biolink:ChemicalEntity (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid kegg.compound:C04529 Graph (3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylate|(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylate|(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylate|(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_15615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15616 biolink:ChemicalEntity (3S,5S)-3,5-diaminohexanoic acid A chiral diamino acid consisting of hexanoic acid having amino substituents at the 3- and 5-positions and (S,S)-configuration. kegg.compound:C01186 Graph (3S,5S)-3,5-diaminocaproic acid|(3S,5S)-3,5-diaminohexanoic acid|L-erythro-3,5-diaminohexanoic acid (3S,5S)-3,5-diaminohexanoic acid (3S,5S)-3,5-diaminocaproic acid|(3S,5S)-3,5-diaminohexanoic acid|L-erythro-3,5-diaminohexanoic acid http://purl.obolibrary.org/obo/CHEBI_15616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15617 biolink:ChemicalEntity (2R,3Z)-phycocyanobilin The (3Z)-isomer of (2R)-phycocyanobilin. kegg.compound:C05786|metacyc.compound:3Z-PHYCOCYANOBILIN Graph (2R,3Z)-8,12-bis(2-carboxyethyl)-18-ethyl-3-ethylidene-2,7,13,17-tetramethyl-2,3-dihydrobilin-1,19(21H,24H)-dione|(3Z)-Phycocyanobilin (2R,3Z)-8,12-bis(2-carboxyethyl)-18-ethyl-3-ethylidene-2,7,13,17-tetramethyl-2,3-dihydrobilin-1,19(21H,24H)-dione (2R,3Z)-8,12-bis(2-carboxyethyl)-18-ethyl-3-ethylidene-2,7,13,17-tetramethyl-2,3-dihydrobilin-1,19(21H,24H)-dione|(3Z)-Phycocyanobilin http://purl.obolibrary.org/obo/CHEBI_15617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15618 biolink:ChemicalEntity (3Z)-phycoerythrobilin The (3Z)-isomer of phycoerythrobilin. kegg.compound:C05912 Graph (3Z)-8,12-bis(2-carboxyethyl)-18-ethenyl-3-ethylidene-2,7,13,17-tetramethyl-2,3,15,16-tetrahydrobiline-1,19(21H,24H)-dione|(3Z)-Phycoerythrobilin (3Z)-8,12-bis(2-carboxyethyl)-18-ethenyl-3-ethylidene-2,7,13,17-tetramethyl-2,3,15,16-tetrahydrobiline-1,19(21H,24H)-dione (3Z)-8,12-bis(2-carboxyethyl)-18-ethenyl-3-ethylidene-2,7,13,17-tetramethyl-2,3,15,16-tetrahydrobiline-1,19(21H,24H)-dione|(3Z)-Phycoerythrobilin http://purl.obolibrary.org/obo/CHEBI_15618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156186 biolink:ChemicalEntity 1,25-Dihydroxy-24-oxo-16-ene-vitamin D3 lipidmaps:LMST03020608 Graph (6R)-6-[(3aS,4E,7aS)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]-2-hydroxy-2-methylheptan-3-one (6R)-6-[(3aS,4E,7aS)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]-2-hydroxy-2-methylheptan-3-one (6R)-6-[(3aS,4E,7aS)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-3a,5,6,7-tetrahydro-3H-inden-1-yl]-2-hydroxy-2-methylheptan-3-one http://purl.obolibrary.org/obo/CHEBI_156186 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15619 biolink:ChemicalEntity (3Z)-phytochromobilin The (3Z)-isomer of phytochromobilin. kegg.compound:C05913 Graph (3Z)-Phytochromobilin|3-(2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-{(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid 3-(2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-{(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid (3Z)-Phytochromobilin|3-(2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-{(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid http://purl.obolibrary.org/obo/CHEBI_15619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15621 biolink:ChemicalEntity (4-hydroxyphenyl)acetaldehyde cas:7339-87-9|kegg.compound:C03765 Graph (4-hydroxyphenyl)acetaldehyde|2-(4-Hydroxyphenyl)acetaldehyde|4-Hydroxyphenylacetaldehyde|p-Hydroxyphenylacetaldehyde|pOH-Ph-CH2CHO (4-hydroxyphenyl)acetaldehyde (4-hydroxyphenyl)acetaldehyde|2-(4-Hydroxyphenyl)acetaldehyde|4-Hydroxyphenylacetaldehyde|p-Hydroxyphenylacetaldehyde|pOH-Ph-CH2CHO http://purl.obolibrary.org/obo/CHEBI_15621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15622 biolink:ChemicalEntity 2,3-diketogulonic acid A carbohydrate acid formally derived from gulonic acid by oxidation of the -OH groups at positions 2 and 3 to keto groups. beilstein:1711133|cas:3409-57-2|kegg.compound:C04575|pubmed:9506998|reaxys:1711133 Graph (4R,5S)-2,3-dioxo-4,5,6-trihydroxyhexanoic acid|(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoic acid|2,3-Diketo-L-gulonate|2,3-L-diketogulonic acid|2,3-diketo-L-gulonic acid|2,3-dioxo-2,3-dideoxy-L-gulonic acid|L-threo-(2,3)-Hexodiulosonsaeure|L-threo-2,3-hexodiurosonic acid|L-threo-hexo-2,3-diulosonic acid|diketo-L-gulonic acid|threo-2,3-Hexodiulosonic acid (4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoic acid|L-threo-hexo-2,3-diulosonic acid (4R,5S)-2,3-dioxo-4,5,6-trihydroxyhexanoic acid|(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate|(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoic acid|2,3-Diketo-L-gulonate|2,3-L-diketogulonic acid|2,3-diketo-L-gulonic acid|2,3-dioxo-2,3-dideoxy-L-gulonic acid|L-threo-(2,3)-Hexodiulosonsaeure|L-threo-2,3-hexodiurosonic acid|L-threo-hexo-2,3-diulosonic acid|diketo-L-gulonic acid|threo-2,3-Hexodiulosonic acid http://purl.obolibrary.org/obo/CHEBI_15622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15623 biolink:ChemicalEntity 3-deoxy-D-glycero-hexo-2,5-diulosonic acid kegg.compound:C04349 Graph (4S)-4,6-Dihydroxy-2,5-dioxohexanoate|(4S)-4,6-dihydroxy-2,5-dioxohexanoic acid|2,5-Diketo-3-deoxy-D-gluconate|3-Deoxy-D-glycero-2,5-hexodiulosonate|3-deoxy-D-glycero-hexo-2,5-diulosonic acid (4S)-4,6-Dihydroxy-2,5-dioxohexanoate|(4S)-4,6-dihydroxy-2,5-dioxohexanoic acid|3-deoxy-D-glycero-hexo-2,5-diulosonic acid (4S)-4,6-Dihydroxy-2,5-dioxohexanoate|(4S)-4,6-dihydroxy-2,5-dioxohexanoic acid|2,5-Diketo-3-deoxy-D-gluconate|3-Deoxy-D-glycero-2,5-hexodiulosonate|3-deoxy-D-glycero-hexo-2,5-diulosonic acid http://purl.obolibrary.org/obo/CHEBI_15623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15624 biolink:ChemicalEntity (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid A dioxo monocarboxylic acid that is the 4,5-dihydroxy-2,6-dioxo derivative of hexanoic acid having (4S,5S)-configuration. kegg.compound:C04471 Graph (4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid|4-deoxy-L-erythro-hex-5-ulosuronic acid (4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid (4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate|(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid|4-deoxy-L-erythro-hex-5-ulosuronic acid http://purl.obolibrary.org/obo/CHEBI_15624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15625 biolink:ChemicalEntity S-adenosylmethioninamine The S-adenosyl derivative of methioninamine. It acts as the aminopropyl donor in the biosynthesis of the polyamines, spermidine and spermine. beilstein:4161053|cas:22365-13-5|foodb.food:FDB022353|hmdb:HMDB0000988|kegg.compound:C01137|pubmed:15130560|pubmed:17822713|pubmed:20523031|pubmed:20950271|pubmed:3006760|pubmed:3409208|pubmed:3728970|pubmed:4084287|pubmed:6439194|pubmed:6621404|pubmed:6807294|pubmed:7391043|pubmed:7396502|pubmed:7448956|pubmed:869190|wikipedia.en:S-Adenosylmethioninamine Graph (3-aminopropyl)(5'-deoxyadenosin-5'-yl)(methyl)sulfonium|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium cation|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium salt|S-Adenosylmethioninamine|S-adenosyl 3-(methylsulfanyl)propylamine|S-adenosyl 3-(methylthio)propylamine|S-adenosyl-(5')-3-methylthiopropylamine|S-adenosyl-3-methylthiopropylamine|S-adenosylmethionamine|S-adenosylmethioninamine|S-methyl-S-adenosyl homocysteamine|S-methyl-S-adenosylhomocysteamine|S-methyladenosylhomocysteamine|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl](3-aminopropyl)(methyl)sulfonium|dAdoMet|dc-SAM|dcAdoMet|dcSAM|decarboxylated AdoMet|decarboxylated S-adenosylmethionine|decarboxylated SAM (3-aminopropyl)(5'-deoxyadenosin-5'-yl)(methyl)sulfonium (3-aminopropyl)(5'-deoxyadenosin-5'-yl)(methyl)sulfonium|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium cation|(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium salt|S-Adenosylmethioninamine|S-adenosyl 3-(methylsulfanyl)propylamine|S-adenosyl 3-(methylthio)propylamine|S-adenosyl-(5')-3-methylthiopropylamine|S-adenosyl-3-methylthiopropylamine|S-adenosylmethionamine|S-adenosylmethioninamine|S-methyl-S-adenosyl homocysteamine|S-methyl-S-adenosylhomocysteamine|S-methyladenosylhomocysteamine|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl](3-aminopropyl)(methyl)sulfonium|dAdoMet|dc-SAM|dcAdoMet|dcSAM|decarboxylated AdoMet|decarboxylated S-adenosylmethionine|decarboxylated SAM http://purl.obolibrary.org/obo/CHEBI_15625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156255 biolink:ChemicalEntity S-adenosyl-D-methionine Graph http://purl.obolibrary.org/obo/CHEBI_156255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156258 biolink:ChemicalEntity enrasentan A member of the class of indanes that is 2,3-dihydro-1H-indene which is substituted by a 1,3-benzodioxol-5-yl group, carboxy group, 2-(2-hydroxyethoxy)-4-methoxyphenyl group and a propoxy group at positions 1S, 2R, 3S and 5, respectively. It is an orally active mixed endothelin A/B receptor antagonist with a 100-fold greater affinity for the endothelin A receptor. The drug was being developed by GSK for the treatment of congestive heart failure and pulmonary hypertension (clinical trials discontinued). cas:167256-08-8|drugbank:DB06460|pubmed:10208832|pubmed:10610275|pubmed:11078416|pubmed:11588531|pubmed:11904522|pubmed:12376360|pubmed:12595914|pubmed:16339819|pubmed:8587428|pubmed:8632328|pubmed:9399985|pubmed:9595469|pubmed:9595510|pubmed:9631875|pubmed:9988883 Graph (1S,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-[2-(2-hydroxyethoxy)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid|(1S,2R,3S)-3-(2-(2-hydroxyethoxy)-4-methoxyphenyl)-1-(3,4-(methylenedioxy)phenyl)-5-propoxy-2-indancarboxylic acid|SB 217242|SB-217242|SB217242|enrasentan|enrasentanum (1S,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-[2-(2-hydroxyethoxy)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid (1S,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-[2-(2-hydroxyethoxy)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid|(1S,2R,3S)-3-(2-(2-hydroxyethoxy)-4-methoxyphenyl)-1-(3,4-(methylenedioxy)phenyl)-5-propoxy-2-indancarboxylic acid|SB 217242|SB-217242|SB217242|enrasentan|enrasentanum http://purl.obolibrary.org/obo/CHEBI_156258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156259 biolink:ChemicalEntity PD-166866 A member of the class of pyridopyrimidines that is pyrido[2,3-d]pyrimidine substituted by an amino group at position 2, 3,5-dimethoxyphenyl group at position 6, and by a (tert-butylcarbamoyl)nitrilo group at position 7. It is a selective ATP competitive inhibitor of the human fibroblast growth factor-1 receptor (FGFR1) tyrosine kinase with an IC50 of 52.4 nM. cas:192705-79-6|pubmed:11063616|pubmed:11384237|pubmed:11404258|pubmed:12805413|pubmed:15773903|pubmed:15780636|pubmed:17964795|pubmed:17987803|pubmed:20003343|pubmed:21967732|pubmed:22876277|pubmed:23421678|pubmed:24719266|pubmed:26993162|pubmed:32572027|pubmed:9655904 Graph 1-[2-amino-6-(3,5-dimethoxyphenyl)-pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butyl urea|1-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea|N-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-N'-(1,1-dimethylethyl)-urea|PD 166866|PD-166866|PD166866 1-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea 1-[2-amino-6-(3,5-dimethoxyphenyl)-pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butyl urea|1-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea|N-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-N'-(1,1-dimethylethyl)-urea|PD 166866|PD-166866|PD166866 http://purl.obolibrary.org/obo/CHEBI_156259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15626 biolink:ChemicalEntity 12(S)-HPETE The (S)-enantiomer of 12-HPETE. cas:67675-13-2|kegg.compound:C05965|lipidmaps:LMFA03060013|lipidmaps:LMFA03060042 Graph (5Z,8Z,10E,12S,14Z)-12-hydroperoxyicosa-5,8,10,14-tetraenoic acid|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyeicosa-5,8,10,14-tetraenoate|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoate|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid|12(S)-HPETE|12-HpETE|12-Hpete|12-Hydroperoxyeicosatetraenoate|12-Hydroperoxyeicosatetraenoic acid|12-Hydroperoxyicosatetraenoate|12-Hydroperoxyicosatetraenoic acid|12-Oohete|Arachidonic acid omega-9 hydroperoxide|omega-9 Hpaa|omega-9-Hydroperoxyarachidonic acid (5Z,8Z,10E,12S,14Z)-12-hydroperoxyicosa-5,8,10,14-tetraenoic acid (5Z,8Z,10E,12S,14Z)-12-hydroperoxyicosa-5,8,10,14-tetraenoic acid|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyeicosa-5,8,10,14-tetraenoate|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoate|(5Z,8Z,10E,14Z)-(12S)-12-Hydroperoxyicosa-5,8,10,14-tetraenoic acid|12(S)-HPETE|12-HpETE|12-Hpete|12-Hydroperoxyeicosatetraenoate|12-Hydroperoxyeicosatetraenoic acid|12-Hydroperoxyicosatetraenoate|12-Hydroperoxyicosatetraenoic acid|12-Oohete|Arachidonic acid omega-9 hydroperoxide|omega-9 Hpaa|omega-9-Hydroperoxyarachidonic acid http://purl.obolibrary.org/obo/CHEBI_15626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156262 biolink:ChemicalEntity O-(S-octanoylpantetheine-4-phosphoryl)serine residue An O-(S-acylpantetheine-4'-phosphoryl)-L-serine residue in which the S-acyl group is specified as octanoyl. pubmed:22451903 Graph octanoyl-pantetheine-4-phosphoryl-serine residue octanoyl-pantetheine-4-phosphoryl-serine residue http://purl.obolibrary.org/obo/CHEBI_156262 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15627 biolink:ChemicalEntity thromboxane A2 A thromboxane which is produced by activated platelets and has prothrombotic properties: it stimulates activation of new platelets as well as increases platelet aggregation. cas:57576-52-0|kegg.compound:C02198|lipidmaps:LMFA03030001 Graph (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid|(5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid|9S,11S-epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-oic acid|TXA-2|TXA2|Thromboxane A2 (5Z,13E,15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid (5Z,13E)-(15S)-9alpha,11alpha-Epoxy-15-hydroxythromboxa-5,13-dienoate|(5Z,13E,15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid|(5Z,9alpha,11alpha,13E,15S)-9,11-Epoxy-15-hydroxythromboxa-5,13-dien-1-oic acid|9S,11S-epoxy,15S-hydroxy-thromboxa-5Z,13E-dien-1-oic acid|TXA-2|TXA2|Thromboxane A2 http://purl.obolibrary.org/obo/CHEBI_15627 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15628 biolink:ChemicalEntity 15(S)-HPETE The (S)-enantiomer of 15-HPETE. kegg.compound:C05966|knapsack:C00000400|lipidmaps:LMFA03060014 Graph (5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoate|(5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoic acid|15(S)-HPETE|15-Hydroperoxyeicosatetraenoate|15-Hydroperoxyeicosatetraenoic acid|15-Hydroperoxyicosatetraenoate|15-Hydroperoxyicosatetraenoic acid|15S-HpETE (5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoic acid (5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoate|(5Z,8Z,11Z,13E)-(15S)-15-Hydroperoxyicosa-5,8,11,13-tetraenoic acid|(5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoic acid|15(S)-HPETE|15-Hydroperoxyeicosatetraenoate|15-Hydroperoxyeicosatetraenoic acid|15-Hydroperoxyicosatetraenoate|15-Hydroperoxyicosatetraenoic acid|15S-HpETE http://purl.obolibrary.org/obo/CHEBI_15628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156287 biolink:ChemicalEntity CX-5461 An organic heterotetracyclic compound that is 5-oxo-5H-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxylic acid substituted by a 4-methyl-1,4-diazepan-1-yl group at position 2 and in which the carboxy group at position 6 is substituted by a [(5-methylpyrazin-2-yl)methyl]nitrilo group. An inhibitor of ribosomal RNA (rRNA) synthesis which specifically inhibits RNA polymerase I-driven transcription of rRNA in several cancer cell lines. It is currently in phase I/II clinical trials for advanced hematologic malignancies and triple-negative breast cancer with BRCA1/2 mutation. cas:1138549-36-6|lincs.smallmolecule:LSM-6342|pubmed:21159662|pubmed:30016731|pubmed:30542116|pubmed:30879743|pubmed:31092402|pubmed:31183313|pubmed:31210846|pubmed:31341008|pubmed:31557908|pubmed:31817270|pubmed:32041867|pubmed:32414869|pubmed:32457376|pubmed:32719798 Graph 2-(4-methyl-1,4-diazepan-1-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxo-5H-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide|2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-N-[(5-methyl-2-pyrazinyl)methyl]-5-oxo-5H-benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide|CX 5461|CX5461 2-(4-methyl-1,4-diazepan-1-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxo-5H-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide 2-(4-methyl-1,4-diazepan-1-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxo-5H-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide|2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-N-[(5-methyl-2-pyrazinyl)methyl]-5-oxo-5H-benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide|CX 5461|CX5461 http://purl.obolibrary.org/obo/CHEBI_156287 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15629 biolink:ChemicalEntity 8(R)-HPETE The (R)-enantiomer of 8-HPETE. kegg.compound:C04822|knapsack:C00000422|lipidmaps:LMFA03060037 Graph (5Z,8R,9E,11Z,14Z)-8-hydroperoxyicosa-5,9,11,14-tetraenoic acid|(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyeicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroxyperoxyeicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroxyperoxyicosa-5,9,11,14-tetraenoate|8(R)-HPETE|8R-HpETE (5Z,8R,9E,11Z,14Z)-8-hydroperoxyicosa-5,9,11,14-tetraenoic acid (5Z,8R,9E,11Z,14Z)-8-hydroperoxyicosa-5,9,11,14-tetraenoic acid|(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyeicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroperoxyicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroxyperoxyeicosa-5,9,11,14-tetraenoate|(5Z,9E,11Z,14Z)-(8R)-8-Hydroxyperoxyicosa-5,9,11,14-tetraenoate|8(R)-HPETE|8R-HpETE http://purl.obolibrary.org/obo/CHEBI_15629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156297 biolink:ChemicalEntity EC 3.4.21.75 (furin) inhibitor An EC 3.4.21.* (serine endopeptidase) inhibitor that interferes with the action of furin (EC 3.4.21.75). wikipedia.en:Furin Graph EC 3.4.21.75 (furin) inhibitors|EC 3.4.21.75 inhibitor|EC 3.4.21.75 inhibitors|PACE inhibitor|PACE inhibitors|PC1 inhibitor|PC1 inhibitors|SPC3 inhibitor|SPC3 inhibitors|dibasic processing enzyme inhibitor|dibasic processing enzyme inhibitors|furin convertase inhibitor|furin convertase inhibitors|furin inhibitor|furin inhibitors|paired basic amino acid cleaving enzyme inhibitor|paired basic amino acid cleaving enzyme inhibitors|paired basic amino acid converting enzyme inhibitor|paired basic amino acid converting enzyme inhibitors|prohormone convertase inhibitor|prohormone convertase inhibitors|proprotein convertase inhibitor|proprotein convertase inhibitors|serine proteinase PACE inhibitor|serine proteinase PACE inhibitors EC 3.4.21.75 (furin) inhibitors|EC 3.4.21.75 inhibitor|EC 3.4.21.75 inhibitors|PACE inhibitor|PACE inhibitors|PC1 inhibitor|PC1 inhibitors|SPC3 inhibitor|SPC3 inhibitors|dibasic processing enzyme inhibitor|dibasic processing enzyme inhibitors|furin convertase inhibitor|furin convertase inhibitors|furin inhibitor|furin inhibitors|paired basic amino acid cleaving enzyme inhibitor|paired basic amino acid cleaving enzyme inhibitors|paired basic amino acid converting enzyme inhibitor|paired basic amino acid converting enzyme inhibitors|prohormone convertase inhibitor|prohormone convertase inhibitors|proprotein convertase inhibitor|proprotein convertase inhibitors|serine proteinase PACE inhibitor|serine proteinase PACE inhibitors http://purl.obolibrary.org/obo/CHEBI_156297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15630 biolink:ChemicalEntity (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid A hydroxy monocarboxylic acid consisting of icosa-5,9,14-trienoic acid having three hydroxy groups placed at the 8-, 11- and 12-positions. kegg.compound:C04843 Graph (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11xi,12S)-8,11,12-Trihydroxyicosa-5,9,14-trienoate|(5Z,9E,14Z)-(8xi,11xi,12S)-8,11,12-Trihydroxyicosa-5,9,14-trienoic acid (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11xi,12S)-8,11,12-Trihydroxyicosa-5,9,14-trienoate|(5Z,9E,14Z)-(8xi,11xi,12S)-8,11,12-Trihydroxyicosa-5,9,14-trienoic acid http://purl.obolibrary.org/obo/CHEBI_15630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15631 biolink:ChemicalEntity (5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoic acid A C20 trienoic hydroxy fatty acid consisting of 8-hydroxyicosa-5,9,14-trienoic acid having an epoxy group at the 11,12-position. kegg.compound:C04849 Graph (5Z,9E)-8-hydroxy-10-{(2R,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyeicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoic acid (5Z,9E)-8-hydroxy-10-{(2R,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoic acid (5Z,9E)-8-hydroxy-10-{(2R,3S)-3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}deca-5,9-dienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyeicosa-5,9,14-trienoic acid|(5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoic acid http://purl.obolibrary.org/obo/CHEBI_15631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15632 biolink:ChemicalEntity 5(S)-HPETE An icosatetraenoic acid in which the double bonds are located at the 6-7, 8-9, 11-12, and 14-15 positions and have E, Z, Z, and Z geometry, respectively, and in which the pro-S hydrogen is substituted by a hydroperoxy group. cas:71774-08-8|hmdb:HMDB0011135|kegg.compound:C05356|lipidmaps:LMFA03060012|reaxys:5282501 Graph (5S,6E,8Z,11Z,14Z)-5-Hydroperoxyicosa-6,8,11,14-tetraenoate|(5S,6E,8Z,11Z,14Z)-5-hydroperoxyeicosa-6,8,11,14-tetraenoic acid|(5S,6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoic acid|(6E,8Z,11Z,14Z)-(5S)-5-Hydroperoxyeicosa-6,8,11,14-tetraenoate|(6E,8Z,11Z,14Z)-(5S)-5-Hydroperoxyeicosa-6,8,11,14-tetraenoic acid|(S)-5-HPETE|5(S)-HPETE|5(S)-Hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic acid|5(S)-hydroperoxy-6(E),8(Z),11(Z),14(Z)-eicosatetraenoic acid|5(S)-hydroxyperoxy-6E,8Z,11Z,14Z-icosatetraenoic acid|5-Hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoate|5S-HpETE (5S,6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoic acid (5S,6E,8Z,11Z,14Z)-5-Hydroperoxyicosa-6,8,11,14-tetraenoate|(5S,6E,8Z,11Z,14Z)-5-hydroperoxyeicosa-6,8,11,14-tetraenoic acid|(5S,6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoic acid|(6E,8Z,11Z,14Z)-(5S)-5-Hydroperoxyeicosa-6,8,11,14-tetraenoate|(6E,8Z,11Z,14Z)-(5S)-5-Hydroperoxyeicosa-6,8,11,14-tetraenoic acid|(S)-5-HPETE|5(S)-HPETE|5(S)-Hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic acid|5(S)-hydroperoxy-6(E),8(Z),11(Z),14(Z)-eicosatetraenoic acid|5(S)-hydroxyperoxy-6E,8Z,11Z,14Z-icosatetraenoic acid|5-Hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoate|5S-HpETE http://purl.obolibrary.org/obo/CHEBI_15632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15633 biolink:ChemicalEntity dihydrofolic acid A folic acid derivative acted upon by dihydrofolate reductase to produce tetrahydrofolic acid. It interacts with bacteria during cell division and is targeted by various drugs to prevent nucleic acid synthesis. cas:4033-27-6|drugbank:DB02015|kegg.compound:C00415|knapsack:C00007248 Graph 7,8-Dihydrofolate|7,8-Dihydrofolic acid|7,8-Dihydropteroylglutamate|Dihydrofolate|Dihydrofolic acid|N-(4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-(7,8-dihydropteroyl)-L-glutamic acid N-(4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid 7,8-Dihydrofolate|7,8-Dihydrofolic acid|7,8-Dihydropteroylglutamate|Dihydrofolate|Dihydrofolic acid|N-(4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-(7,8-dihydropteroyl)-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_15633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15634 biolink:ChemicalEntity 10-formyldihydrofolic acid The 10-formyl derivative of dihydrofolic acid. beilstein:70909|cas:28459-40-7|kegg.compound:C03204 Graph 10-Formyldihydrofolate|10-formyl-7,8-dihydrofolate|N-(10-formyl-7,8-dihydropteroyl)-L-glutamate|N-(4-{N-[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]formamido}benzoyl)-L-glutamic acid N-(4-{N-[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]formamido}benzoyl)-L-glutamic acid 10-Formyldihydrofolate|10-formyl-7,8-dihydrofolate|N-(10-formyl-7,8-dihydropteroyl)-L-glutamate|N-(4-{N-[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]formamido}benzoyl)-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_15634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15635 biolink:ChemicalEntity (6S)-5,6,7,8-tetrahydrofolic acid A derivative of folic acid in which the pteridine ring is fully reduced; it is the parent compound of a variety of coenzymes that serve as carriers of one-carbon groups in metabolic reactions. beilstein:101190|cas:135-16-0|drugbank:DB02031|kegg.compound:C00101|pdb-ccd:THG Graph (6S)-5,6,7,8-TETRAHYDROFOLATE|(6S)-5,6,7,8-tetrahydrofolate|(6S)-5,6,7,8-tetrahydropteroylglutamate|(6S)-H4folate|(6S)-THFA|(6S)-Tetrahydrofolate|(6S)-Tetrahydrofolic acid|(6S)-tetrahydrofolate|5,6,7,8-Tetrahydrofolate|N-(5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|THF|Tetrahydrofolate|Tetrahydrofolic acid N-[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid (6S)-5,6,7,8-TETRAHYDROFOLATE|(6S)-5,6,7,8-tetrahydrofolate|(6S)-5,6,7,8-tetrahydropteroylglutamate|(6S)-H4folate|(6S)-THFA|(6S)-Tetrahydrofolate|(6S)-Tetrahydrofolic acid|(6S)-tetrahydrofolate|5,6,7,8-Tetrahydrofolate|N-(5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|THF|Tetrahydrofolate|Tetrahydrofolic acid http://purl.obolibrary.org/obo/CHEBI_15635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15636 biolink:ChemicalEntity (6R)-5,10-methylenetetrahydrofolate(2-) beilstein:5468618 Graph (6R)-5,10-CH2-H4folate|(6R)-5,10-methylene-5,6,7,8-tetrahydrofolate|N-(5,10-methylene-5,6,7,8-tetrahydropteroyl)-L-glutamate|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate (6R)-5,10-CH2-H4folate|(6R)-5,10-methylene-5,6,7,8-tetrahydrofolate|N-(5,10-methylene-5,6,7,8-tetrahydropteroyl)-L-glutamate|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamate http://purl.obolibrary.org/obo/CHEBI_15636 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15637 biolink:ChemicalEntity 10-formyltetrahydrofolic acid A form of tetrahydrofolate that acts as a donor of formyl groups in anabolism. In these reactions 10-formyltetrahydrofolic acid is used as a substrate in formyltransferase reactions, which is important in purine biosynthesis. beilstein:101559|cas:2800-34-2|foodb.food:FDB022345|hmdb:HMDB0000972|kegg.compound:C00234|knapsack:C00007251|pubmed:1095054|pubmed:13336106|pubmed:13672973|pubmed:9833324 Graph 10-FTHF|10-Formyltetrahydrofolate|10-HCO-H4folic acid|10-formyl-(6RS)-tetrahydrofolic acid|10-formyl-5,6,7,8-tetrahydrofolic acid|10-formyl-THF|10-formyltetrahydropteroylglutamic acid|N(10)-formyl-5,6,7,8-tetrahydrofolic acid|N(10)-formyl-THF|N(10)-formyltetrahydrofolic acid|N-(10-formyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl](formyl)amino}benzoyl)-L-glutamic acid N-(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl](formyl)amino}benzoyl)-L-glutamic acid 10-FTHF|10-Formyltetrahydrofolate|10-HCO-H4folic acid|10-formyl-(6RS)-tetrahydrofolic acid|10-formyl-5,6,7,8-tetrahydrofolic acid|10-formyl-THF|10-formyltetrahydropteroylglutamic acid|N(10)-formyl-5,6,7,8-tetrahydrofolic acid|N(10)-formyl-THF|N(10)-formyltetrahydrofolic acid|N-(10-formyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl](formyl)amino}benzoyl)-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_15637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156377 biolink:ChemicalEntity GP369 An FGFR2-IIIb isoform-specific monoclonal antibody used in cancer patients with aberrantly activated/amplified FGFR2 signaling Graph http://purl.obolibrary.org/obo/CHEBI_156377 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156379 biolink:ChemicalEntity paraherquonin Published in DOI:10.1016/S0040-4039(00)88109-5 Graph http://purl.obolibrary.org/obo/CHEBI_156379 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15638 biolink:ChemicalEntity (6R)-5,10-methenyltetrahydrofolic acid The 5,10-methenyl derivative of tetrahydrofolic acid arising from enzymatic cyclisation of 5-formyltetrahydrofolic acid. beilstein:6184059|cas:7444-29-3|kegg.compound:C00445|knapsack:C00019687 Graph (6R)-5,10-CH(+)-H4folate|5,10-Methenyltetrahydrofolate|5,10-methenyltetrahydropteroylglutamate|Anhydroleucovorin|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]benzoyl}-L-glutamic acid N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]benzoyl}-L-glutamic acid (6R)-5,10-CH(+)-H4folate|5,10-Methenyltetrahydrofolate|5,10-methenyltetrahydropteroylglutamate|Anhydroleucovorin|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]benzoyl}-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_15638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15639 biolink:ChemicalEntity 5-formimidoyltetrahydrofolic acid The 5-formimidoyl derivative of tetrahydrofolic acid. kegg.compound:C00664 Graph (6R)-5-formiminotetrahydrofolate|5-Formimidoyltetrahydrofolate|5-Formiminotetrahydrofolate|5-formiminotetrahydrofolate|N-(5-formimidoyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[(6S)-2-amino-5-formimidoyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|[(6S)-5-formimidoyl-5,6,7,8-tetrahydropteroyl]glutamate N-[4-({[(6S)-2-amino-5-formimidoyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid (6R)-5-formiminotetrahydrofolate|5-Formimidoyltetrahydrofolate|5-Formiminotetrahydrofolate|5-formiminotetrahydrofolate|N-(5-formimidoyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[(6S)-2-amino-5-formimidoyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|[(6S)-5-formimidoyl-5,6,7,8-tetrahydropteroyl]glutamate http://purl.obolibrary.org/obo/CHEBI_15639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15640 biolink:ChemicalEntity 5-formyltetrahydrofolic acid A formyltetrahydrofolic acid in which the formyl group is located at position 5. cas:58-05-9|drugbank:DB03256|drugcentral:1232|kegg.compound:C03479|kegg.drug:D07986|lincs.smallmolecule:LSM-5146|reaxys:101688|wikipedia.en:Folinic_acid Graph (5-formyl-5,6,7,8-tetrahydropteroyl)glutamate|10-Formyl-7,8-dihydrofolic acid|5-Formyl-5,6,7,8-tetrahydrofolic acid|5-Formyl-5,6,7,8-tetrahydropteroyl-L-glutamic acid|5-Formyltetrahydrofolate|Acide folinique|Folinic acid|L(-)-5-Formyl-5,6,7,8-tetrahydrofolic acid|Leucovorin|Leucovorinum|N-(5-formyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[2-amino-5-formyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|N5-Formyl-5,6,7,8-tetrahydrofolic acid|N5-Formyltetrahydrofolic acid|folinate N-[4-({[2-amino-5-formyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid (5-formyl-5,6,7,8-tetrahydropteroyl)glutamate|10-Formyl-7,8-dihydrofolic acid|5-Formyl-5,6,7,8-tetrahydrofolic acid|5-Formyl-5,6,7,8-tetrahydropteroyl-L-glutamic acid|5-Formyltetrahydrofolate|Acide folinique|Folinic acid|L(-)-5-Formyl-5,6,7,8-tetrahydrofolic acid|Leucovorin|Leucovorinum|N-(5-formyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-[4-({[2-amino-5-formyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid|N5-Formyl-5,6,7,8-tetrahydrofolic acid|N5-Formyltetrahydrofolic acid|folinate http://purl.obolibrary.org/obo/CHEBI_15640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15641 biolink:ChemicalEntity 5-methyltetrahydrofolic acid A tetrahydrofolic acid that is 5,6,7,8-tetrahydrofolic acid substituted by a methyl group at position 5. agr:IND606335060|cas:134-35-0|chemspider:8001181|drugbank:DB04789|foodb.food:FDB022600|hmdb:HMDB0001396|kegg.compound:C00440|knapsack:C00007252|pubmed:10993519|pubmed:11816560|pubmed:15094208|pubmed:15173401|pubmed:15717023|pubmed:16310391|pubmed:16429378|pubmed:1683972|pubmed:17176169|pubmed:18160726|pubmed:1969014|pubmed:2445472|pubmed:32170863|pubmed:34311437|pubmed:34886014|pubmed:6609768|pubmed:8031869|pubmed:8613033|pubmed:9101216|pubmed:9870205 Graph 5-methyl-5,6,7,8-tetrahydrofolate|5-methyl-5,6,7,8-tetrahydrofolic acid|5-methyl-5,6,7,8-tetrahydropteroyl-L-glutamic acid|5-methyl-THF|5-methyltetrahydrofolate|5-methyltetrahydropteroylglutamic acid|N(5)-methyl-tetrahydrofolate|N(5)-methyl-tetrahydrofolic acid|N(5)-methyltetrahydrofolic acid|N-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-(5-methyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-methyltetrahydrofolate|N-methyltetrahydrofolic acid N-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid 5-methyl-5,6,7,8-tetrahydrofolate|5-methyl-5,6,7,8-tetrahydrofolic acid|5-methyl-5,6,7,8-tetrahydropteroyl-L-glutamic acid|5-methyl-THF|5-methyltetrahydrofolate|5-methyltetrahydropteroylglutamic acid|N(5)-methyl-tetrahydrofolate|N(5)-methyl-tetrahydrofolic acid|N(5)-methyltetrahydrofolic acid|N-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-(5-methyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid|N-methyltetrahydrofolate|N-methyltetrahydrofolic acid http://purl.obolibrary.org/obo/CHEBI_15641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15642 biolink:ChemicalEntity 4a-hydroxy-L-erythro-5,6,7,8-tetrahydrobiopterin A 4a-hydroxytetrahydrobiopterin which has R configuration at position 6 and in which the dihydroxypropyl substituent has L-erythro configuration. kegg.compound:C15522|metacyc.compound:CPD-5881 Graph (4aS,6R)-4a-hydroxy-L-erythro-5,6,7,8-tetrahydrobiopterin|(6R)-2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one|(6R)-6-(L-erythro-1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4a-hydroxypterin (6R)-2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one (4aS,6R)-4a-hydroxy-L-erythro-5,6,7,8-tetrahydrobiopterin|(6R)-2-amino-6-[(1S,2R)-1,2-dihydroxypropyl]-4a-hydroxy-5,6,7,8-tetrahydropteridin-4(4aH)-one|(6R)-6-(L-erythro-1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4a-hydroxypterin http://purl.obolibrary.org/obo/CHEBI_15642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156439 biolink:ChemicalEntity (R)-2-methylbutanoyl-CoA(4-) A 2-methylbutanoyl-CoA(4−) obtained by deprotonation of phosphate and diphosphate functions of (R)-2-methylbutanoyl-CoA; major species at pH 7.3. pubmed:6874697 Graph (2R)-2-methylbutanoyl-CoA (2R)-2-methylbutanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_156439 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15645 biolink:ChemicalEntity (6S)-6-hydroxyhyoscyamine kegg.compound:C03325 Graph (1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|(3S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|(6S)-6-Hydroxyhyoscyamine|(6S)-6-hydroxyhyoscyamine|(6S)-Hydroxyhyoscyamine|(6S)-hydroxyhyoscyamine (1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate (1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|(3S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|(6S)-6-Hydroxyhyoscyamine|(6S)-6-hydroxyhyoscyamine|(6S)-Hydroxyhyoscyamine|(6S)-hydroxyhyoscyamine http://purl.obolibrary.org/obo/CHEBI_15645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15646 biolink:ChemicalEntity 20-hydroxy-leukotriene B4 The 20-hydroxy derivative of leukotriene B4. hmdb:HMDB0001509|kegg.compound:C04853|lipidmaps:LMFA03020018|pubmed:3000366|pubmed:8382231|pubmed:8609415 Graph (5S,6Z,8E,10E,12R,14Z)-5,12,20-trihydroxyicosa-6,8,10,14-tetraenoic acid|(6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyeicosa-6,8,10,14-tetraenoate|(6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyicosa-6,8,10,14-tetraenoate|20-Hydroxy-leukotriene B4|20-OH-LTB4|20-OH-Leukotriene B4|20-hydroxy-LTB4 (5S,6Z,8E,10E,12R,14Z)-5,12,20-trihydroxyicosa-6,8,10,14-tetraenoic acid (5S,6Z,8E,10E,12R,14Z)-5,12,20-trihydroxyicosa-6,8,10,14-tetraenoic acid|(6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyeicosa-6,8,10,14-tetraenoate|(6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyicosa-6,8,10,14-tetraenoate|20-Hydroxy-leukotriene B4|20-OH-LTB4|20-OH-Leukotriene B4|20-hydroxy-LTB4 http://purl.obolibrary.org/obo/CHEBI_15646 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156460 biolink:ChemicalEntity novofumigatonin pubmed:18179222|pubmed:29968715 Graph novofumigatonin novofumigatonin http://purl.obolibrary.org/obo/CHEBI_156460 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156461 biolink:ChemicalEntity 5'-(N(7)-methyl 5'-triphosphoguanosine)-ribonucleoside(2-) residue A 7-methyl guanosine (m7G) linked via an inverted 5'-5' triphosphate bridge to an initiating ribonucleoside Graph a 5'-(N(7)-methyl 5'-triphosphoguanosine)-ribonucleoside residue|m7GpppN residue a 5'-(N(7)-methyl 5'-triphosphoguanosine)-ribonucleoside residue|m7GpppN residue http://purl.obolibrary.org/obo/CHEBI_156461 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156467 biolink:ChemicalEntity thiosemicarbazone A hydrazone resulting from the formal condensation of an aldehyde or ketone with the non-thioacylated nitrogen of thiosemicarbazide or its substituted derivatives. wikipedia.en:Thiosemicarbazone Graph thiosemicarbazone derivative|thiosemicarbazone derivatives|thiosemicarbazones thiosemicarbazone derivative|thiosemicarbazone derivatives|thiosemicarbazones http://purl.obolibrary.org/obo/CHEBI_156467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15647 biolink:ChemicalEntity leukotriene B4 A leukotriene composed of (6Z,8E,10E,14Z)-icosatetraenoic acid having (5S)- and (12R)-hydroxy substituents. It is a lipid mediator of inflammation that is generated from arachidonic acid via the 5-lipoxygenase pathway. cas:71160-24-2|chemspider:4444132|drugbank:DB12961|hmdb:HMDB0001085|kegg.compound:C02165|knapsack:C00053425|lipidmaps:LMFA03020001|pdb-ccd:LTB|pubmed:10087000|pubmed:10391868|pubmed:10695938|pubmed:11166796|pubmed:11254552|pubmed:12709426|pubmed:12742837|pubmed:12947016|pubmed:1327049|pubmed:1333134|pubmed:1335872|pubmed:1338371|pubmed:15016629|pubmed:15515787|pubmed:16567388|pubmed:1661709|pubmed:17481557|pubmed:17548641|pubmed:17623009|pubmed:1847289|pubmed:20400503|pubmed:20529300|pubmed:20671299|pubmed:23625922|pubmed:32439596|pubmed:32960415|pubmed:33292560|pubmed:33612149|pubmed:6271967|pubmed:7924852|pubmed:8243477|pubmed:8382716|pubmed:8397308|pubmed:9209678|pubmed:9516893|pubmed:9606840|reaxys:4235309|wikipedia.en:Leukotriene_B4 Graph (5S,12R,6Z,8E,10E,14Z)-5,12-dihydroxy-6,8,10,14-eicosatetraenoic acid|(5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyeicosa-6,8,10,14-tetraenoic acid|(5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid|(S-(R*,S*-(E,Z,E,Z)))-5,12-Dihydroxy-6,8,10,14-eicosatetraenoic acid|5(S),12(R)-dihydroxy-6(Z),8(E),10(E),14(Z)-eicosatetraenoic acid|5(S),12(R)-dihydroxy-6(Z),8(E),10(E),14(Z)-icosatetraenoic acid|5,12-Dihete|5,12-Hete|5S,12R-diHETE|5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid|LTB4|Leukotriene B4 (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid (5S,12R,6Z,8E,10E,14Z)-5,12-dihydroxy-6,8,10,14-eicosatetraenoic acid|(5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyeicosa-6,8,10,14-tetraenoic acid|(5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid|(S-(R*,S*-(E,Z,E,Z)))-5,12-Dihydroxy-6,8,10,14-eicosatetraenoic acid|5(S),12(R)-dihydroxy-6(Z),8(E),10(E),14(Z)-eicosatetraenoic acid|5(S),12(R)-dihydroxy-6(Z),8(E),10(E),14(Z)-icosatetraenoic acid|5,12-Dihete|5,12-Hete|5S,12R-diHETE|5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid|LTB4|Leukotriene B4 http://purl.obolibrary.org/obo/CHEBI_15647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156473 biolink:ChemicalEntity cyclobutanes Cyclobutane and its derivatives formed by substitution. Graph http://purl.obolibrary.org/obo/CHEBI_156473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15648 biolink:ChemicalEntity (6aR,11aR)-3,9-dihydroxypterocarpan cas:61135-91-9|kegg.compound:C04271 Graph (6AR,11AR)-3,9-dihydroxypterocarpan|(6aR,11aR)-3,9-Dihydroxypterocarpan|(6aR,11aR)-3,9-dihydroxypterocarpan|(6aR,11aR)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,9-diol|(6aR-cis)-6a,11a-Dihydro-6H-benzofuro(3,2-c)(1)benzopyran-3,9-diol (6aR,11aR)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,9-diol (6AR,11AR)-3,9-dihydroxypterocarpan|(6aR,11aR)-3,9-Dihydroxypterocarpan|(6aR,11aR)-3,9-dihydroxypterocarpan|(6aR,11aR)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,9-diol|(6aR-cis)-6a,11a-Dihydro-6H-benzofuro(3,2-c)(1)benzopyran-3,9-diol http://purl.obolibrary.org/obo/CHEBI_15648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15649 biolink:ChemicalEntity 3,6,9-trihydroxypterocarpan A member of the class of pterocarpans carrying three hydroxy substituents at positions 3, 6a and 9. cas:69393-95-9|hmdb:HMDB0034105|kegg.compound:C01263|knapsack:C00002532|lipidmaps:LMPK12070128|metacyc.compound:6AS11AS-36A9-TRIHYDROXYPTEROCARPAN|pubmed:16250441|pubmed:16661917|pubmed:16663042|pubmed:19116342|pubmed:19943626|pubmed:21667928|reaxys:1259301 Graph (-)-Glycinol|(6aS,11aS)-3,6a,9-Trihydroxypterocarpan|(6aS,11aS)-3,6a,9-trihydroxypterocarpan|(6aS,11aS)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,6a,9-triol|(6aS-cis)-6H-Benzofuro(3,2-c)(1)benzopyran-3,6a,9(11aH)-triol|(6alphaS,11alphaS)-3,6alpha,9-trihydroxypterocarpan|3,6,9-Trihydroxypterocarpan|6H-Benzofuro[3,2-c][1]benzopyran-3,6a,9(11aH)-triol|Glycinol (6aS,11aS)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,6a,9-triol (-)-Glycinol|(6aS,11aS)-3,6a,9-Trihydroxypterocarpan|(6aS,11aS)-3,6a,9-trihydroxypterocarpan|(6aS,11aS)-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromene-3,6a,9-triol|(6aS-cis)-6H-Benzofuro(3,2-c)(1)benzopyran-3,6a,9(11aH)-triol|(6alphaS,11alphaS)-3,6alpha,9-trihydroxypterocarpan|3,6,9-Trihydroxypterocarpan|6H-Benzofuro[3,2-c][1]benzopyran-3,6a,9(11aH)-triol|Glycinol http://purl.obolibrary.org/obo/CHEBI_15649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156498 biolink:ChemicalEntity rohitukine A member of the class of chromones that is 4H-chromen-4-one in which the hydrogens at positions 2,5,7 and 8 are replaced by methyl, hydroxy, hydroxy, and (3S,4R)-3-hydroxy-1-methylpiperidin-4-yl groups, respectively. It is an alkaloid initially isolated from Amoora rohituka and is a precursor of the anti-cancer compound flavopiridol. agr:IND20371019|cas:71294-60-5|knapsack:C00048080|patent:CN101139344|pubmed:17963866|pubmed:19686817|pubmed:19757855|pubmed:21898150|pubmed:22113419|pubmed:24215673|pubmed:24646949|pubmed:24677095|pubmed:24840406|pubmed:25243649|pubmed:25472605|pubmed:25799183|pubmed:26405812|pubmed:27362422|pubmed:27363938|pubmed:27422078|pubmed:29370702|pubmed:30665042|pubmed:31513869|pubmed:32165175 Graph 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-methyl-4H-1-benzopyran-4-one|5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-methyl-4H-chromen-4-one 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-methyl-4H-chromen-4-one 5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-methyl-4H-1-benzopyran-4-one|5,7-dihydroxy-8-[(3S,4R)-3-hydroxy-1-methylpiperidin-4-yl]-2-methyl-4H-chromen-4-one http://purl.obolibrary.org/obo/CHEBI_156498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15650 biolink:ChemicalEntity leukotriene E4 A leukotriene that is (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid substituted by a hydroxy group at position 5 (5S) and an L-cystein-S-yl group at position 6 (6R). cas:75715-89-8|kegg.compound:C05952|lipidmaps:LMFA03020002|pubmed:19291727 Graph (5S,6R,7E,9E,11Z,14Z)-6-(L-cystein-S-yl)-5-hydroxyicosa-7,9,11,14-tetraenoic acid|(5S-(5R*,6S*(S*),7E,9E,11Z,14Z))-6-((2-Amino-2-carboxyethyl)thio)-5-hydroxy-7,9,11,14-eicosatetraenoic acid|(7E,9E,11Z,14Z)-(5S,6R)-6-(Cystein-S-yl)-5-hydroxyeicosa-7,9,11,14-tetraenoate|(7E,9E,11Z,14Z)-(5S,6R)-6-(Cystein-S-yl)-5-hydroxyicosa-7,9,11,14-tetraenoate|5S-hydroxy,6R-(S-cysteinyl),7E,9E,11Z,14Z-eicosatetraenoic acid|LTE4|Leukotriene E4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine (5S,6R,7E,9E,11Z,14Z)-6-(L-cystein-S-yl)-5-hydroxyicosa-7,9,11,14-tetraenoic acid|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine (5S,6R,7E,9E,11Z,14Z)-6-(L-cystein-S-yl)-5-hydroxyicosa-7,9,11,14-tetraenoic acid|(5S-(5R*,6S*(S*),7E,9E,11Z,14Z))-6-((2-Amino-2-carboxyethyl)thio)-5-hydroxy-7,9,11,14-eicosatetraenoic acid|(7E,9E,11Z,14Z)-(5S,6R)-6-(Cystein-S-yl)-5-hydroxyeicosa-7,9,11,14-tetraenoate|(7E,9E,11Z,14Z)-(5S,6R)-6-(Cystein-S-yl)-5-hydroxyicosa-7,9,11,14-tetraenoate|5S-hydroxy,6R-(S-cysteinyl),7E,9E,11Z,14Z-eicosatetraenoic acid|LTE4|Leukotriene E4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine http://purl.obolibrary.org/obo/CHEBI_15650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15651 biolink:ChemicalEntity leukotriene A4 A leukotriene that is the (5S,6S)-epoxy derivative of (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid. cas:72059-45-1|hmdb:HMDB0001337|kegg.compound:C00909|knapsack:C00053424|lipidmaps:LMFA03020023|pdb-ccd:DJ3|pubmed:1667967|pubmed:19531649|pubmed:20120015|pubmed:22913921|pubmed:28827365|pubmed:33896285|pubmed:8017792|reaxys:5756170|wikipedia.en:Leukotriene_A4 Graph (5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoic acid|(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyeicosa-7,9,11,14-tetraenoic acid|5(S)-5,6-oxido-7,9-trans-11,14-cis-eicosatetraenoic acid|5S,6S-epoxy-7E,9E,11Z,14Z-eicosatetraenoic acid|5S,6S-leukotriene A4|LTA4|Leukotriene A4|Oxiranebutanoic acid, 3-(1,3,5,8-tetradecatetraenyl)-, (2S-(2alpha,3beta(1E,3Z,5Z,8Z)))- (5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoic acid (5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoic acid|(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyeicosa-7,9,11,14-tetraenoic acid|5(S)-5,6-oxido-7,9-trans-11,14-cis-eicosatetraenoic acid|5S,6S-epoxy-7E,9E,11Z,14Z-eicosatetraenoic acid|5S,6S-leukotriene A4|LTA4|Leukotriene A4|Oxiranebutanoic acid, 3-(1,3,5,8-tetradecatetraenyl)-, (2S-(2alpha,3beta(1E,3Z,5Z,8Z)))- http://purl.obolibrary.org/obo/CHEBI_15651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15652 biolink:ChemicalEntity 5'-xanthylic acid A purine ribonucleoside 5'-monophosphate having xanthine as the nucleobase. cas:523-98-8|kegg.compound:C00655|knapsack:C00007396|pdb-ccd:XMP|pubmed:13563457|pubmed:18303855|pubmed:24130159|reaxys:59853 Graph (9-D-Ribosylxanthine)-5'-phosphate|(9-D-ribosylxanthine)-5'-phosphate|5'-xanthylic acid|XMP|Xanthosine 5'-phosphate|Xanthylic acid|xanthosine monophosphate 5'-xanthylic acid (9-D-Ribosylxanthine)-5'-phosphate|(9-D-ribosylxanthine)-5'-phosphate|5'-xanthylic acid|XMP|Xanthosine 5'-phosphate|Xanthylic acid|xanthosine monophosphate http://purl.obolibrary.org/obo/CHEBI_15652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15653 biolink:ChemicalEntity (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid A long-chain trienoic fatty acid consisting of octadecanoic acid having the three double bonds at positions 9, 11 and 15 as well as an epoxy ring linking positions 12 and 13. kegg.compound:C04672|lipidmaps:LMFA02000053|metacyc.compound:CPD-728 Graph (9Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate|(9Z)-11-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}undec-9-enoic acid|(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate|(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoic acid|12,13(S)-EOT|12,13(S)-EOTrE|12,13(S)-epoxy-9(Z),11,15(Z)-octadecatrienoic acid|12,13(S)-epoxylinolenic acid|12,13-EOT (9Z)-11-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}undec-9-enoic acid (9Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate|(9Z)-11-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}undec-9-enoic acid|(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate|(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoic acid|12,13(S)-EOT|12,13(S)-EOTrE|12,13(S)-epoxy-9(Z),11,15(Z)-octadecatrienoic acid|12,13(S)-epoxylinolenic acid|12,13-EOT http://purl.obolibrary.org/obo/CHEBI_15653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156536 biolink:ChemicalEntity oligoglycosyl-(1->4)-D-glucose Graph an oligoglycosyl-(1->4)-D-glucose an oligoglycosyl-(1->4)-D-glucose http://purl.obolibrary.org/obo/CHEBI_156536 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:156548 biolink:ChemicalEntity kainate(1-) A dicarboxylate resulting from deprotonation of both carboxy groups of kainic acid, and protonation of its amine group. Major species at pH 7.3. metacyc.compound:CPD-22470|pubmed:16847640|pubmed:30995339 Graph kainate kainate http://purl.obolibrary.org/obo/CHEBI_156548 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15655 biolink:ChemicalEntity 13(S)-HPODE The (S)-enantiomer of 13-HPODE cas:33964-75-9|hmdb:HMDB0003871|kegg.compound:C04717|knapsack:C00000394|lipidmaps:LMFA02000034|reaxys:3592723 Graph (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate|(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid|(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoic acid|13(S)-HPODE|13S-Hydroperoxy-9Z,11E-octadecadienoic acid (9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate|(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid|(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoic acid|13(S)-HPODE|13S-Hydroperoxy-9Z,11E-octadecadienoic acid http://purl.obolibrary.org/obo/CHEBI_15655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156557 biolink:ChemicalEntity beraprost(1-) A monocarboxylic acid anion that is conjugate base of beraprost, arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3. Graph 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoate|beraprost anion 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoate 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoate|beraprost anion http://purl.obolibrary.org/obo/CHEBI_156557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15657 biolink:ChemicalEntity (11S)-11-hydroperoxylinoleic acid The 11-hydroperoxy derivative of linoleic acid having (S)-configuration. kegg.compound:C07338|lipidmaps:LMFA01040068 Graph (9Z,11S,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid|(9Z,12Z)-(11S)-11-Hydroperoxyoctadeca-9,12-dienoate|(9Z,12Z)-(11S)-11-Hydroperoxyoctadeca-9,12-dienoic acid (9Z,11S,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid (9Z,11S,12Z)-11-hydroperoxyoctadeca-9,12-dienoic acid|(9Z,12Z)-(11S)-11-Hydroperoxyoctadeca-9,12-dienoate|(9Z,12Z)-(11S)-11-Hydroperoxyoctadeca-9,12-dienoic acid http://purl.obolibrary.org/obo/CHEBI_15657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156573 biolink:ChemicalEntity (R)-toloxatone The (R)-enantiomer of toloxatone. cas:148278-79-9 Graph (5R)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|R-toloxatone (5R)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (5R)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|R-toloxatone http://purl.obolibrary.org/obo/CHEBI_156573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156574 biolink:ChemicalEntity (S)-toloxatone The (S)-enantiomer of toloxatone. Graph (5S)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|S-toloxatone (5S)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one (5S)-5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|S-toloxatone http://purl.obolibrary.org/obo/CHEBI_156574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156575 biolink:ChemicalEntity 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one A member of the class of oxazolidinones that is 5-(hydroxymethyl)-1,3-oxazolidin-2-one substituted by a 3-methylphenyl group at position 3. Graph 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|5-(hydroxymethyl)-3-(3-methylphenyl)-2-oxazolidinone|5-hydroxymethyl-3-(m-tolyl)-2-oxazolidinone 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one 5-(hydroxymethyl)-3-(3-methylphenyl)-1,3-oxazolidin-2-one|5-(hydroxymethyl)-3-(3-methylphenyl)-2-oxazolidinone|5-hydroxymethyl-3-(m-tolyl)-2-oxazolidinone http://purl.obolibrary.org/obo/CHEBI_156575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:156576 biolink:ChemicalEntity (1R,2S)-ritodrine A 4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]phenol that has (1R,2S)-configuration. patent:US5449694 Graph (-)-erythro-1-(p-hydroxyphenyl)-2-[2-(p-hydroxyphenyl)ethylamino]-1-propanol|(-)-ritodrine|4-[(1R,2S)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol 4-[(1R,2S)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol (-)-erythro-1-(p-hydroxyphenyl)-2-[2-(p-hydroxyphenyl)ethylamino]-1-propanol|(-)-ritodrine|4-[(1R,2S)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol http://purl.obolibrary.org/obo/CHEBI_156576 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:156577 biolink:ChemicalEntity (1S,2R)-ritodrine A 4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]phenol that has (1S,2R)-configuration. pubmed:23954364 Graph (+)-erythro-1-(p-hydroxyphenyl)-2-[2-(p-hydroxyphenyl)ethylamino]-1-propanol|(+)-ritodrine|(1S,2R)-2-(4-hydroxyphenethylamino)-1-(4-hydroxyphenyl)-1-propanol|4-[(1S,2R)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol 4-[(1S,2R)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol (+)-erythro-1-(p-hydroxyphenyl)-2-[2-(p-hydroxyphenyl)ethylamino]-1-propanol|(+)-ritodrine|(1S,2R)-2-(4-hydroxyphenethylamino)-1-(4-hydroxyphenyl)-1-propanol|4-[(1S,2R)-1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl]phenol http://purl.obolibrary.org/obo/CHEBI_156577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15658 biolink:ChemicalEntity 7(S),8(S)-DiHODE A dihydroxy monocarboxylic acid that is the 7(S),8(S)-dihydroxy derivative of linoleic acid. kegg.compound:C07354|lipidmaps:LMFA01050344|pubmed:8117115|pubmed:8662736|pubmed:9694817 Graph (7S,8S)-DiHODE|(7S,8S)-dihydroxylinoleic acid|(7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoic acid|(9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoate|(9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid (7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoic acid (7S,8S)-DiHODE|(7S,8S)-dihydroxylinoleic acid|(7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoic acid|(9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoate|(9Z,12Z)-(7S,8S)-Dihydroxyoctadeca-9,12-dienoic acid http://purl.obolibrary.org/obo/CHEBI_15658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15659 biolink:ChemicalEntity (E)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide kegg.compound:C04621 Graph (2E)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide|(E)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|(E)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide (2E)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide (2E)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide|(E)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|(E)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide http://purl.obolibrary.org/obo/CHEBI_15659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15660 biolink:ChemicalEntity (Z)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide A member of the class of acrylamides that is acrylamide which is substituted at positions 2 and 3 by 2-furyl and 5-nitro-2-furyl groups, respectively (the trans isomer). Formerly used as a food preservative, it was withdrawn from the market following suspicions of carcenogenicity. cas:3688-53-7|kegg.compound:C04622|kegg.compound:C19558|kegg.drug:D02528|wikipedia.en:Furylfuramide Graph (2Z)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide|(Z)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|(Z)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide|2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|AF 2|AF-2|Furylfuramide (2Z)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide (2Z)-2-(2-furyl)-3-(5-nitro-2-furyl)prop-2-enamide|(Z)-2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|(Z)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide|2-(2-Furyl)-3-(5-nitro-2-furyl)acrylamide|AF 2|AF-2|Furylfuramide http://purl.obolibrary.org/obo/CHEBI_15660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15661 biolink:ChemicalEntity (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid The 2-(methoxycarbonylmethyl) derivative of fumaric acid. kegg.compound:C11515|pdb-ccd:T8N Graph (2E)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid|(E)-2-(Methoxycarbonylmethyl)butenedioate (2E)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid (2E)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid|(E)-2-(Methoxycarbonylmethyl)butenedioate http://purl.obolibrary.org/obo/CHEBI_15661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15663 biolink:ChemicalEntity (2E)-3-(methoxycarbonyl)pent-2-enedioic acid The 2-(methoxycarbonyl) derivative of (Z)-glutaconic acid. kegg.compound:C11514 Graph (2E)-3-(methoxycarbonyl)pent-2-enedioic acid|(E)-3-(Methoxycarbonyl)pent-2-enedioate (2E)-3-(methoxycarbonyl)pent-2-enedioic acid (2E)-3-(methoxycarbonyl)pent-2-enedioic acid|(E)-3-(Methoxycarbonyl)pent-2-enedioate http://purl.obolibrary.org/obo/CHEBI_15663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15664 biolink:ChemicalEntity (2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate A prenol phosphate comprising (2E)-4-hydroxy-3-methylbut-2-en-1-ol having an O-diphosphate substituent. kegg.compound:C11811|knapsack:C00007567|pdb-ccd:H6P|pubmed:12203549|pubmed:12646635|pubmed:19919056|pubmed:23872678|reaxys:9060574 Graph (2E)-4-hydroxy-3-methylbut-2-en-1-yl pyrophosphate|(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate|(E)-4-Hydroxy-3-methyl-but-2-enyl diphosphate|(E)-4-Hydroxy-3-methylbut-2-en-1-yl diphosphate|(E)-4-Hydroxy-3-methylbut-2-enyl diphosphate|(E)-4-hydroxy-3-methyl-2-buten-1-yl diphosphate|(E)-4-hydroxy-3-methyl-2-buten-1-yl pyrophosphate|(E)-4-hydroxy-3-methylbut-2-enyl pyrophosphate|1-Hydroxy-2-methyl-2-butenyl 4-diphosphate|1-hydroxy-2-methylbut-2(E)-en-4-yl diphosphate|1-hydroxy-2-methylbut-2(E)-en-4-yl pyrophosphate|HMBPP (2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate (2E)-4-hydroxy-3-methylbut-2-en-1-yl pyrophosphate|(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate|(E)-4-Hydroxy-3-methyl-but-2-enyl diphosphate|(E)-4-Hydroxy-3-methylbut-2-en-1-yl diphosphate|(E)-4-Hydroxy-3-methylbut-2-enyl diphosphate|(E)-4-hydroxy-3-methyl-2-buten-1-yl diphosphate|(E)-4-hydroxy-3-methyl-2-buten-1-yl pyrophosphate|(E)-4-hydroxy-3-methylbut-2-enyl pyrophosphate|1-Hydroxy-2-methyl-2-butenyl 4-diphosphate|1-hydroxy-2-methylbut-2(E)-en-4-yl diphosphate|1-hydroxy-2-methylbut-2(E)-en-4-yl pyrophosphate|HMBPP http://purl.obolibrary.org/obo/CHEBI_15664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15665 biolink:ChemicalEntity (4-hydroxyphenyl)acetaldehyde oxime cas:23745-82-6|knapsack:C00018213|pubmed:10415119|pubmed:10759528|pubmed:10938360|pubmed:12818674|pubmed:26548317|pubmed:28795267|pubmed:35088406|pubmed:572359|pubmed:7012151|pubmed:7358727|pubmed:7574710|pubmed:9484480 Graph (4-hydroxyphenyl)acetaldehyde oxime|4-Hydroxyphenylacetaldehyde oxime|4-Hydroxyphenylacetaldoxime|4-hydroxybenzeneacetaldehyde, oxime|4-hydroxyphenylacetaldehyde oxime|p-hydroxyphenylacetaldoxime|para-hydroxyphenylacetaldoxime (4-hydroxyphenyl)acetaldehyde oxime (4-hydroxyphenyl)acetaldehyde oxime|4-Hydroxyphenylacetaldehyde oxime|4-Hydroxyphenylacetaldoxime|4-hydroxybenzeneacetaldehyde, oxime|4-hydroxyphenylacetaldehyde oxime|p-hydroxyphenylacetaldoxime|para-hydroxyphenylacetaldoxime http://purl.obolibrary.org/obo/CHEBI_15665 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15666 biolink:ChemicalEntity (E)-(4-hydroxyphenyl)acetaldehyde oxime kegg.compound:C04350 Graph (1E)-(4-hydroxyphenyl)acetaldehyde oxime|(E)-4-Hydroxyphenylacetaldehyde-oxime|(E)-4-hydroxyphenylacetaldehyde oxime (1E)-(4-hydroxyphenyl)acetaldehyde oxime (1E)-(4-hydroxyphenyl)acetaldehyde oxime|(E)-4-Hydroxyphenylacetaldehyde-oxime|(E)-4-hydroxyphenylacetaldehyde oxime http://purl.obolibrary.org/obo/CHEBI_15666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15668 biolink:ChemicalEntity (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid A 4-oxo derivative of but-1-ene-1,2,4-tricarboxylic acid with (E)-stereochemistry about the C=C bond. cas:85179-60-8|kegg.compound:C04434 Graph (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid|(E)-4-Oxobut-1-ene-1,2,4-tricarboxylate|(E)-4-oxobut-1-ene-1,2,4-tricarboxylate|4-Oxalmesaconic acid|4-Oxalomesaconate (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid|(E)-4-Oxobut-1-ene-1,2,4-tricarboxylate|(E)-4-oxobut-1-ene-1,2,4-tricarboxylate|4-Oxalmesaconic acid|4-Oxalomesaconate http://purl.obolibrary.org/obo/CHEBI_15668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15669 biolink:ChemicalEntity trans-cinnamate beilstein:3904521|gmelin:328658|kegg.compound:C00423 Graph (2E)-3-phenylprop-2-enoate|(E)-cinnamate|trans-cinnamate (2E)-3-phenylprop-2-enoate (2E)-3-phenylprop-2-enoate|(E)-cinnamate|trans-cinnamate http://purl.obolibrary.org/obo/CHEBI_15669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15670 biolink:ChemicalEntity (E)-glutaconic acid The (E)-isomer of glutaconic acid. cas:628-48-8|hmdb:HMDB0000620|kegg.compound:C02214|lipidmaps:LMFA01170109|metacyc.compound:GLUTACONATE|reaxys:1722686|wikipedia.en:Glutaconic_acid Graph (2E)-pent-2-enedioic acid|(E)-Glutaconate|(E)-glutaconic acid|Glutaconic acid|trans-Glutaconate|trans-Glutaconic acid (2E)-pent-2-enedioic acid (2E)-pent-2-enedioic acid|(E)-Glutaconate|(E)-glutaconic acid|Glutaconic acid|trans-Glutaconate|trans-Glutaconic acid http://purl.obolibrary.org/obo/CHEBI_15670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15671 biolink:ChemicalEntity L-tartaric acid The L-enantiomer of tartaric acid. beilstein:1725147|beilstein:4231301|cas:526-83-0|cas:87-69-4|drugcentral:2566|gmelin:82690|kegg.compound:C00898|pdb-ccd:TLA Graph (+)-(R,R)-tartaric acid|(+)-L-tartaric acid|(+)-Tartaric acid|(+)-Weinsaeure|(+)-tartaric acid|(2R,3R)-2,3-Dihydroxybernsteinsaeure|(2R,3R)-2,3-dihydroxybutanedioic acid|(2R,3R)-2,3-dihydroxysuccinic acid|(2R,3R)-Tartaric acid|(2R,3R)-tartaric acid|(R,R)-(+)-tartaric acid|(R,R)-Tartaric acid|L(+)-TARTARIC ACID|L-Tartaric acid|L-threaric acid|Rechtsweinsaeure|Weinsteinsaeure (2R,3R)-2,3-dihydroxybutanedioic acid (+)-(R,R)-tartaric acid|(+)-L-tartaric acid|(+)-Tartaric acid|(+)-Weinsaeure|(+)-tartaric acid|(2R,3R)-2,3-Dihydroxybernsteinsaeure|(2R,3R)-2,3-dihydroxybutanedioic acid|(2R,3R)-2,3-dihydroxysuccinic acid|(2R,3R)-Tartaric acid|(2R,3R)-tartaric acid|(R,R)-(+)-tartaric acid|(R,R)-Tartaric acid|L(+)-TARTARIC ACID|L-Tartaric acid|L-threaric acid|Rechtsweinsaeure|Weinsteinsaeure http://purl.obolibrary.org/obo/CHEBI_15671 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15672 biolink:ChemicalEntity D-tartaric acid The D-enantiomer of tartaric acid. beilstein:4666810|cas:147-71-7|drugbank:DB01694|foodb.food:FDB001110|gmelin:50225|hmdb:HMDB0029878|kegg.compound:C02107|pdb-ccd:TAR|pubmed:34378325|pubmed:36274712|pubmed:36296249|pubmed:37068187|pubmed:37375278|pubmed:37524461|pubmed:38109287|pubmed:38958572|pubmed:39006392|pubmed:39181416|reaxys:1725145 Graph (-)-(S,S)-tartaric acid|(-)-D-tartaric acid|(-)-Tartaric acid|(-)-Weinsaeure|(-)-tartaric acid|(2S,3S)-(-)-tartaric acid|(2S,3S)-2,3-dihydroxybutanedioic acid|(2S,3S)-2,3-dihydroxysuccinic acid|(2S,3S)-tartaric acid|(S,S)-(-)-tartaric acid|(S,S)-tartaric acid|D(-)-TARTARIC ACID|D-(-)-tartaric acid|D-Tartaric acid|D-threaric acid|Linksweinsaeure (2S,3S)-2,3-dihydroxybutanedioic acid (-)-(S,S)-tartaric acid|(-)-D-tartaric acid|(-)-Tartaric acid|(-)-Weinsaeure|(-)-tartaric acid|(2S,3S)-(-)-tartaric acid|(2S,3S)-2,3-dihydroxybutanedioic acid|(2S,3S)-2,3-dihydroxysuccinic acid|(2S,3S)-tartaric acid|(S,S)-(-)-tartaric acid|(S,S)-tartaric acid|D(-)-TARTARIC ACID|D-(-)-tartaric acid|D-Tartaric acid|D-threaric acid|Linksweinsaeure http://purl.obolibrary.org/obo/CHEBI_15672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15673 biolink:ChemicalEntity meso-tartaric acid A 2,3-dihydroxybutanedioic acid that has meso configuration. beilstein:1725146|beilstein:4666811|cas:147-73-9|drugbank:DB14756|gmelin:3214|kegg.compound:C00552|patent:MX2011012689|pdb-ccd:SRT|pubmed:10614067|pubmed:17061893|pubmed:18641452|pubmed:38740717 Graph (2R,3S)-2,3-dihydroxybutanedioic acid|(2R,3S)-2,3-dihydroxysuccinic acid|(2R,3S)-rel-2,3-dihydroxybutanedioic acid|(2R,3S)-tartaric acid|(R*,S*)-2,3-dihydroxybutanedioic acid|Mesoweinsaeure|S,R MESO-TARTARIC ACID|erythraric acid|i-tartaric acid|internally compensated tartaric acid|m-tartaric acid|meso-Tartaric acid|meso-tartaric acid|mesotartaric acid|unresolvable tartaric acid (2R,3S)-2,3-dihydroxybutanedioic acid (2R,3S)-2,3-dihydroxybutanedioic acid|(2R,3S)-2,3-dihydroxysuccinic acid|(2R,3S)-rel-2,3-dihydroxybutanedioic acid|(2R,3S)-tartaric acid|(R*,S*)-2,3-dihydroxybutanedioic acid|Mesoweinsaeure|S,R MESO-TARTARIC ACID|erythraric acid|i-tartaric acid|internally compensated tartaric acid|m-tartaric acid|meso-Tartaric acid|meso-tartaric acid|mesotartaric acid|unresolvable tartaric acid http://purl.obolibrary.org/obo/CHEBI_15673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15674 biolink:ChemicalEntity 2,3-dihydroxybutanedioic acid A tetraric acid that is butanedioic acid substituted by hydroxy groups at positions 2 and 3. cas:526-83-0|wikipedia.en:Tartaric_Acid Graph 2,3-dihydroxybutanedioic acid|2,3-dihydroxysuccinic acid|tartaric acid (unspecified stereochemistry) 2,3-dihydroxybutanedioic acid 2,3-dihydroxybutanedioic acid|2,3-dihydroxysuccinic acid|tartaric acid (unspecified stereochemistry) http://purl.obolibrary.org/obo/CHEBI_15674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15675 biolink:ChemicalEntity (2R)-1-aminopropan-2-ol A 1-aminopropan-2-ol that has R-configuration. cas:2799-16-8|kegg.compound:C03194|pdb-ccd:FOP|reaxys:1718869 Graph (2R)-(-)-2-hydroxypropylamine|(2R)-(-)-hydroxypropylamine|(2R)-1-aminopropan-2-ol|(R)-(-)-1-amino-2-propanol|(R)-(-)-1-aminopropan-2-ol|(R)-1-Amino-2-propanol|(R)-1-Aminopropan-2-ol|(R)-1-amino-2-propanol|(R)-1-aminopropan-2-ol (2R)-1-aminopropan-2-ol (2R)-(-)-2-hydroxypropylamine|(2R)-(-)-hydroxypropylamine|(2R)-1-aminopropan-2-ol|(R)-(-)-1-amino-2-propanol|(R)-(-)-1-aminopropan-2-ol|(R)-1-Amino-2-propanol|(R)-1-Aminopropan-2-ol|(R)-1-amino-2-propanol|(R)-1-aminopropan-2-ol http://purl.obolibrary.org/obo/CHEBI_15675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15676 biolink:ChemicalEntity allantoin An imidazolidine-2,4-dione that is 5-aminohydantoin in which a carbamoyl group is attached to the exocyclic nitrogen. cas:97-59-6|drugcentral:4268|hmdb:HMDB0000462|kegg.compound:C01551|kegg.drug:D00121|knapsack:C00007468|lincs.smallmolecule:LSM-5190|metacyc.compound:ALLANTOIN|patent:US2158098|pubmed:11157020|pubmed:14619112|pubmed:17190852|reaxys:83514|wikipedia.en:Allantoin Graph (2,5-Dioxo-4-imidazolidinyl)urea|2,5-Dioxo-4-imidazolidinyl-urea|4-ureido-2,5-imidazolidinedione|5-Ureido-2,4-imidazolidindione|5-Ureidohydantoin|Allantoin|Glyoxyldiureide|N-(2,5-Dioxo-4-imidazolidinyl)urea|N-(2,5-dioxoimidazolidin-4-yl)urea|allantoin N-(2,5-dioxoimidazolidin-4-yl)urea (2,5-Dioxo-4-imidazolidinyl)urea|2,5-Dioxo-4-imidazolidinyl-urea|4-ureido-2,5-imidazolidinedione|5-Ureido-2,4-imidazolidindione|5-Ureidohydantoin|Allantoin|Glyoxyldiureide|N-(2,5-Dioxo-4-imidazolidinyl)urea|N-(2,5-dioxoimidazolidin-4-yl)urea|allantoin http://purl.obolibrary.org/obo/CHEBI_15676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15677 biolink:ChemicalEntity (R)-(-)-allantoin An optically active form of allantoin having (R)-(−)-configuration. kegg.compound:C02348|metacyc.compound:R--ALLANTOIN|reaxys:83512 Graph (R)(-)-Allantoin|(R)-Allantoin|(R)-allantoin|N-[(4R)-2,5-dioxoimidazolidin-4-yl]urea N-[(4R)-2,5-dioxoimidazolidin-4-yl]urea (R)(-)-Allantoin|(R)-Allantoin|(R)-allantoin|N-[(4R)-2,5-dioxoimidazolidin-4-yl]urea http://purl.obolibrary.org/obo/CHEBI_15677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15678 biolink:ChemicalEntity (S)-(+)-allantoin An optically active form of allantoin having (S)-(+)-configuration. kegg.compound:C02350|metacyc.compound:S-ALLANTOIN|pdb-ccd:3AL|reaxys:83513 Graph (S)(+)-Allantoin|(S)-Allantoin|(S)-allantoin|N-[(4S)-2,5-dioxoimidazolidin-4-yl]urea N-[(4S)-2,5-dioxoimidazolidin-4-yl]urea (S)(+)-Allantoin|(S)-Allantoin|(S)-allantoin|N-[(4S)-2,5-dioxoimidazolidin-4-yl]urea http://purl.obolibrary.org/obo/CHEBI_15678 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15681 biolink:ChemicalEntity alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide A sialodiosylceramide consisting of the trisaccharide α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc attached to the primary hydroxy function of ceramide. kegg.compound:C04730|kegg.glycan:G00108|lipidmaps:LMSP0601AJ00|pubmed:11093705|pubmed:11164910|pubmed:11534772|pubmed:12950986|pubmed:1371229|pubmed:1379980|pubmed:15102521|pubmed:15385432|pubmed:15546874|pubmed:1567198|pubmed:15939439|pubmed:16212238|pubmed:16341241|pubmed:16574813|pubmed:167132|pubmed:1724444|pubmed:19364317|pubmed:21149694|pubmed:2303428|pubmed:2448252|pubmed:2449247|pubmed:2714813|pubmed:2775195|pubmed:3392043|pubmed:3864442|pubmed:7534889|pubmed:7693874|pubmed:8448384|pubmed:8496625|pubmed:9375803 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)1 (Cer)1|(N-Acetylneuraminyl)-D-galactosyl-D-glucosylceramide|(Neu5Ac)GM3|GM3|GM3 (NeuAc)|Hematoside|N-Acetylneuraminyl-2,3-alpha-D-galactosyl-1,4-beta-D-glucosylceramide|Neu5Ac-alpha2->3Gal-beta1->4Glc-beta1->1'Cer|Neu5Acalpha2->3Galbeta1->4Glcbeta-Cer|NeuAc-GM3|NeuAcalpha2-3Galbeta1-4Glcbeta1-1'Cer|NeuAcalpha2->3Galbeta1->4Glc-Cer|alpha-N-Acetylneuraminyl-2,3-beta-D-galactosyl-1,4-beta-D-glucosylceramide|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GM3|monosialoganglioside GM3 (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)1 (Cer)1|(N-Acetylneuraminyl)-D-galactosyl-D-glucosylceramide|(Neu5Ac)GM3|GM3|GM3 (NeuAc)|Hematoside|N-Acetylneuraminyl-2,3-alpha-D-galactosyl-1,4-beta-D-glucosylceramide|Neu5Ac-alpha2->3Gal-beta1->4Glc-beta1->1'Cer|Neu5Acalpha2->3Galbeta1->4Glcbeta-Cer|NeuAc-GM3|NeuAcalpha2-3Galbeta1-4Glcbeta1-1'Cer|NeuAcalpha2->3Galbeta1->4Glc-Cer|alpha-N-Acetylneuraminyl-2,3-beta-D-galactosyl-1,4-beta-D-glucosylceramide|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GM3|monosialoganglioside GM3 http://purl.obolibrary.org/obo/CHEBI_15681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15682 biolink:ChemicalEntity (N(omega)-L-arginino)succinic acid cas:2387-71-5|kegg.compound:C03406|knapsack:C00019688 Graph 2-(N(omega)-L-arginino)butanedioic acid|2-(Nomega-L-Arginino)succinate|L-Argininosuccinate|L-Argininosuccinic acid|L-Arginosuccinic acid|L-argininosuccinate|L-argininosuccinic acid|L-arginosuccinic acid|N(omega)-(L-Arginino)succinate|N(omega)-(L-arginino)succinate|N-(L-Arginino)succinate|N-(L-arginino) succinate 2-(N(omega)-L-arginino)butanedioic acid 2-(N(omega)-L-arginino)butanedioic acid|2-(Nomega-L-Arginino)succinate|L-Argininosuccinate|L-Argininosuccinic acid|L-Arginosuccinic acid|L-argininosuccinate|L-argininosuccinic acid|L-arginosuccinic acid|N(omega)-(L-Arginino)succinate|N(omega)-(L-arginino)succinate|N-(L-Arginino)succinate|N-(L-arginino) succinate http://purl.obolibrary.org/obo/CHEBI_15682 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15683 biolink:ChemicalEntity (R)-10-hydroxyoctadecanoate A hydroxy monocarboxylic acid anion resulting from the removal of the proton from the carboxy group of (R)-10-hydroxyoctadecanoic acid. kegg.compound:C03195 Graph (10R)-10-hydroxyoctadecanoate|(R)-10-hydroxyoctadecanoate|(R)-10-hydroxystearate (10R)-10-hydroxyoctadecanoate (10R)-10-hydroxyoctadecanoate|(R)-10-hydroxyoctadecanoate|(R)-10-hydroxystearate http://purl.obolibrary.org/obo/CHEBI_15683 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15684 biolink:ChemicalEntity (R)-2,3-dihydroxy-3-methylbutanoic acid beilstein:1722372|kegg.compound:C04272 Graph (2R)-2,3-dihydroxy-3-methylbutanoic acid|(R)-2,3-Dihydroxy-isovaleric acid (2R)-2,3-dihydroxy-3-methylbutanoic acid (2R)-2,3-dihydroxy-3-methylbutanoic acid|(R)-2,3-Dihydroxy-isovaleric acid http://purl.obolibrary.org/obo/CHEBI_15684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15685 biolink:ChemicalEntity L-2-succinylamino-6-oxoheptanedioate(3-) kegg.compound:C04462 Graph (2S)-2-(3-carboxylatopropanamido)-6-oxoheptanedioate|(S)-2-succinylamino-6-oxoheptanedioate|N-succinyl-L-2-amino-6-oxoheptanedioate|N-succinyl-L-2-amino-6-oxopimelate (2S)-2-(3-carboxylatopropanamido)-6-oxoheptanedioate (2S)-2-(3-carboxylatopropanamido)-6-oxoheptanedioate|(S)-2-succinylamino-6-oxoheptanedioate|N-succinyl-L-2-amino-6-oxoheptanedioate|N-succinyl-L-2-amino-6-oxopimelate http://purl.obolibrary.org/obo/CHEBI_15685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15686 biolink:ChemicalEntity (R)-acetoin cas:513-86-0|cas:53584-56-8|kegg.compound:C00810 Graph (3R)-3-hydroxybutan-2-one|(R)-2-Acetoin|(R)-2-acetoin|(R)-3-Hydroxy-2-butanone|(R)-3-Hydroxybutan-2-one|(R)-3-hydroxy-2-butanone|(R)-3-hydroxybutan-2-one|(R)-Acetoin|(R)-Dimethylketol|(R)-acetoin|(R)-dimethylketol (3R)-3-hydroxybutan-2-one (3R)-3-hydroxybutan-2-one|(R)-2-Acetoin|(R)-2-acetoin|(R)-3-Hydroxy-2-butanone|(R)-3-Hydroxybutan-2-one|(R)-3-hydroxy-2-butanone|(R)-3-hydroxybutan-2-one|(R)-Acetoin|(R)-Dimethylketol|(R)-acetoin|(R)-dimethylketol http://purl.obolibrary.org/obo/CHEBI_15686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15687 biolink:ChemicalEntity (S)-acetoin kegg.compound:C01769 Graph (3S)-3-hydroxybutan-2-one|(S)-2-Acetoin|(S)-2-acetoin|(S)-Acetoin|(S)-acetoin (3S)-3-hydroxybutan-2-one (3S)-3-hydroxybutan-2-one|(S)-2-Acetoin|(S)-2-acetoin|(S)-Acetoin|(S)-acetoin http://purl.obolibrary.org/obo/CHEBI_15687 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15688 biolink:ChemicalEntity acetoin A methyl ketone that is butan-2-one substituted by a hydroxy group at position 3. cas:513-86-0|drugbank:DB02788|kegg.compound:C00466|kegg.compound:C01769 Graph (S)-2-Acetoin|1-Hydroxyethyl methyl ketone|2,3-Butanolone|2-Acetoin|2-Hydroxy-3-butanone|3-Hydroxy-2-butanone|3-Hydroxybutan-2-one|3-hydroxybutan-2-one|Acetoin|Acetyl methyl carbinol|Dimethylketol|acetoin|gamma-Hydroxy-beta-oxobutane 3-Hydroxybutan-2-one|3-hydroxybutan-2-one (S)-2-Acetoin|1-Hydroxyethyl methyl ketone|2,3-Butanolone|2-Acetoin|2-Hydroxy-3-butanone|3-Hydroxy-2-butanone|3-Hydroxybutan-2-one|3-hydroxybutan-2-one|Acetoin|Acetyl methyl carbinol|Dimethylketol|acetoin|gamma-Hydroxy-beta-oxobutane http://purl.obolibrary.org/obo/CHEBI_15688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15689 biolink:ChemicalEntity 2,3-dihydroxy-3-methylbutanoic acid A dihydroxy monocarboxylic acid that is isovaleric acid which is substituted by hydroxy groups at positions 2 and 3. beilstein:1756569|cas:1756-18-9|kegg.compound:C04039|knapsack:C00019678 Graph 2,3-Dihydroxy-isovaleric acid|2,3-dihydroxy-3-methylbutanoic acid|2,3-dihydroxy-3-methylbutyric acid|alpha,beta-Dihydroxyisovaleric acid 2,3-dihydroxy-3-methylbutanoic acid 2,3-Dihydroxy-isovaleric acid|2,3-dihydroxy-3-methylbutanoic acid|2,3-dihydroxy-3-methylbutyric acid|alpha,beta-Dihydroxyisovaleric acid http://purl.obolibrary.org/obo/CHEBI_15689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15690 biolink:ChemicalEntity 20-hydroxy-3-oxopregn-4-en-21-al kegg.compound:C04108 Graph 20-Hydroxy-3-oxopregn-4-en-21-al|20-hydroxy-3-oxopregn-4-en-21-al 20-Hydroxy-3-oxopregn-4-en-21-al|20-hydroxy-3-oxopregn-4-en-21-al 20-Hydroxy-3-oxopregn-4-en-21-al|20-hydroxy-3-oxopregn-4-en-21-al http://purl.obolibrary.org/obo/CHEBI_15690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15692 biolink:ChemicalEntity 3'-demethylstaurosporine kegg.compound:C07349 Graph (5S,6R,7R,9R)-6-hydroxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one|3'-Demethylstaurosporine (5S,6R,7R,9R)-6-hydroxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one (5S,6R,7R,9R)-6-hydroxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one|3'-Demethylstaurosporine http://purl.obolibrary.org/obo/CHEBI_15692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15693 biolink:ChemicalEntity aldose Aldehydic parent sugars (polyhydroxy aldehydes H[CH(OH)]nC(=O)H, n ≥ 2) and their intramolecular hemiacetals. kegg.compound:C01370|wikipedia.en:Aldose Graph Aldose|aldoses|an aldose Aldose|aldoses|an aldose http://purl.obolibrary.org/obo/CHEBI_15693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15694 biolink:ChemicalEntity (R)-S-lactoylglutathione The S-[(R)-lactoyl] derivative of glutathione. It is an intermediate in the pyruvate metabolism. cas:25138-66-3|hmdb:HMDB0001066|kegg.compound:C03451|knapsack:C00019550|metacyc.compound:S-LACTOYL-GLUTATHIONE|pubmed:10397839|pubmed:3123469|reaxys:1717478 Graph (R)-S-Lactoylglutathione|S-D-Lactoylglutathione|S-[(2R)-2-hydroxypropanoyl]-gamma-L-glutamyl-L-cysteinylglycine|S-lactoylglutathione S-[(2R)-2-hydroxypropanoyl]-gamma-L-glutamyl-L-cysteinylglycine (R)-S-Lactoylglutathione|S-D-Lactoylglutathione|S-[(2R)-2-hydroxypropanoyl]-gamma-L-glutamyl-L-cysteinylglycine|S-lactoylglutathione http://purl.obolibrary.org/obo/CHEBI_15694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15695 biolink:ChemicalEntity D-4-hydroxyphenylglycine The D-enantiomer of 4-hydroxyphenylglycine. A non-proteinogenic amino acid found in Herpetosiphon aurantiacus. cas:22818-40-2|kegg.compound:C03493|metacyc.compound:D-4-HYDROXYPHENYLGLYCINE|patent:US4260684|pdb-ccd:GHP|pubmed:20140718|pubmed:22307823|pubmed:22515657|pubmed:7716788|reaxys:6056393 Graph (2R)-amino(4-hydroxyphenyl)acetic acid|(R)-alpha-Amino-4-hydroxybenzeneacetic acid|4-HYDROXYPHENYLGLYCINE|D-4-Hydroxyphenylglycine|D-N-(4-Hydroxyphenyl)glycine (2R)-amino(4-hydroxyphenyl)acetic acid (2R)-amino(4-hydroxyphenyl)acetic acid|(R)-alpha-Amino-4-hydroxybenzeneacetic acid|4-HYDROXYPHENYLGLYCINE|D-4-Hydroxyphenylglycine|D-N-(4-Hydroxyphenyl)glycine http://purl.obolibrary.org/obo/CHEBI_15695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15696 biolink:ChemicalEntity beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate A polyprenyl glycosyl diphosphate having eleven prenyl units and with β-D-glucosyl-(1→4)-N-acetyl-D-glucosamine as the glycosyl fragment. kegg.glycan:G10501 Graph 2-(acetylamino)-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose 2-(acetylamino)-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose 2-(acetylamino)-2-deoxy-4-O-beta-D-glucopyranosyl-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_15696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15698 biolink:ChemicalEntity 2'-deoxycytidine A pyrimidine 2'-deoxyribonucleoside having cytosine as the nucleobase. cas:951-77-9|drugbank:DB02594|gmelin:1321747|hmdb:HMDB0000014|kegg.compound:C00881|metacyc.compound:DEOXYCYTIDINE|pdb-ccd:DCZ|pubmed:15778433|reaxys:87567|wikipedia.en:Deoxycytidine Graph 2'-DEOXYCYTIDINE|2'-Deoxycytidine|2'-deoxycytidine|4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2(1H)-one|Deoxycytidine|dC|dCYD 2'-DEOXYCYTIDINE|2'-Deoxycytidine|2'-deoxycytidine 2'-DEOXYCYTIDINE|2'-Deoxycytidine|2'-deoxycytidine|4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2(1H)-one|Deoxycytidine|dC|dCYD http://purl.obolibrary.org/obo/CHEBI_15698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15699 biolink:ChemicalEntity L-homoserine The L-enantiomer of homoserine. cas:672-15-1|drugbank:DB04193|hmdb:HMDB0000719|kegg.compound:C00263|knapsack:C00001366|metacyc.compound:HOMO-SER|pdb-ccd:HSE|pubmed:22770225|reaxys:1721681|wikipedia.en:Homoserine Graph (2S)-2-amino-4-hydroxybutanoic acid|2-Amino-4-hydroxybutanoic acid|2-Amino-4-hydroxybutyric acid|Homoserine|L-HOMOSERINE|L-Homoserine|L-homoserine L-HOMOSERINE|L-Homoserine|L-homoserine (2S)-2-amino-4-hydroxybutanoic acid|2-Amino-4-hydroxybutanoic acid|2-Amino-4-hydroxybutyric acid|Homoserine|L-HOMOSERINE|L-Homoserine|L-homoserine http://purl.obolibrary.org/obo/CHEBI_15699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15700 biolink:ChemicalEntity dTDP-alpha-D-glucose A dTDP-sugar having α-D-glucopyranose as the sugar portion. cas:2196-62-5|kegg.compound:C00842|knapsack:C00007456|pdb-ccd:DAU|reaxys:6836291|reaxys:7403915 Graph dTDP-D-glucose|dTDP-alpha-D-glucose|dTDPglucose|thymidine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] dTDP-D-glucose|dTDP-alpha-D-glucose|dTDPglucose|thymidine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15702 biolink:ChemicalEntity terephthalic acid A benzenedicarboxylic acid carrying carboxy groups at positions 1 and 4. One of three possible isomers of benzenedicarboxylic acid, the others being phthalic and isophthalic acids. cas:100-21-0|gmelin:50561|hmdb:HMDB0002428|kegg.compound:C06337|metacyc.compound:TEREPHTHALATE|pubmed:24101250|pubmed:24473302|pubmed:24527803|reaxys:1909333|wikipedia.en:Terephthalic_acid Graph 1,4-Benzenedicarboxylic acid|TPA|Terephthalic acid|benzene-1,4-dicarboxylic acid|p-benzenedicarboxylic acid|para-benzenedicarboxylic acid|terephthalic acid benzene-1,4-dicarboxylic acid 1,4-Benzenedicarboxylic acid|TPA|Terephthalic acid|benzene-1,4-dicarboxylic acid|p-benzenedicarboxylic acid|para-benzenedicarboxylic acid|terephthalic acid http://purl.obolibrary.org/obo/CHEBI_15702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15703 biolink:ChemicalEntity alpha-maltose 6'-phosphate A maltose phosphate having the phosphate group placed at the 6'-position. kegg.compound:C02995|kegg.glycan:G10519 Graph Maltose 6'-phosphate|alpha-D-glucopyranosyl-(1->4)-D-glucose 6'-(dihydrogen phosphate) alpha-D-glucopyranosyl-(1->4)-D-glucose 6'-(dihydrogen phosphate) Maltose 6'-phosphate|alpha-D-glucopyranosyl-(1->4)-D-glucose 6'-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15704 biolink:ChemicalEntity 6-alkylamino-7-beta-D-glucosylpurine A β-D-glucopyranoside with a 6-alkylamino-7-H-purin-7-yl substituent at the anomeric carbon atom. kegg.compound:C04422 Graph 6-alkylamino-7-beta-D-glucosylpurines|N6-Alkylaminopurine-7-beta-D-glucoside|an N(6)-alkylamino-7-beta-D-glucosylpurine 6-alkylamino-7-beta-D-glucosylpurines|N6-Alkylaminopurine-7-beta-D-glucoside|an N(6)-alkylamino-7-beta-D-glucosylpurine http://purl.obolibrary.org/obo/CHEBI_15704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15705 biolink:ChemicalEntity L-alpha-amino acid Any α-amino acid having L-configuration at the α-carbon. kegg.compound:C00151 Graph L-2-Amino acid|L-Amino acid|L-alpha-amino acid|L-alpha-amino acids L-alpha-amino acids L-2-Amino acid|L-Amino acid|L-alpha-amino acid|L-alpha-amino acids http://purl.obolibrary.org/obo/CHEBI_15705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15707 biolink:ChemicalEntity 2,6-dioxo-6-phenylhexanoic acid A dioxo monocarboxylic acid consisting of 6-phenylhexanoic acid having the two oxo groups at the 2- and 6-positions. kegg.compound:C03750 Graph 2,6-Dioxo-6-phenylhexanoate|2,6-dioxo-6-phenylhexanoic acid 2,6-Dioxo-6-phenylhexanoate|2,6-dioxo-6-phenylhexanoic acid 2,6-Dioxo-6-phenylhexanoate|2,6-dioxo-6-phenylhexanoic acid http://purl.obolibrary.org/obo/CHEBI_15707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15708 biolink:ChemicalEntity trans-aconitate(3-) An aconitate(3−) that is the conjugate base of trans-aconitic acid. beilstein:3907462|drugbank:DB04351|gmelin:329167|kegg.compound:C02341|pdb-ccd:TRA Graph (1E)-prop-1-ene-1,2,3-tricarboxylate|ACONITATE ION|trans-aconitate (1E)-prop-1-ene-1,2,3-tricarboxylate (1E)-prop-1-ene-1,2,3-tricarboxylate|ACONITATE ION|trans-aconitate http://purl.obolibrary.org/obo/CHEBI_15708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15710 biolink:ChemicalEntity betaine aldehyde A quaternary ammonium ion that is nitrogen substituted by three methyl groups and a 2-oxoethyl group. It is an intermediate in the metabolism of amino acids like glycine, serine and threonine. cas:7418-61-3|drugbank:DB04401|hmdb:HMDB0001252|kegg.compound:C00576|pdb-ccd:BTL|pubmed:22569963|pubmed:23563483|pubmed:23823928|pubmed:24747910|reaxys:1748566|wikipedia.en:Betaine_aldehyde Graph BETAINE ALDEHYDE|Betaine aldehyde|N,N,N-trimethyl-2-oxoethanaminium|betaine aldehyde|glycine betaine aldehyde N,N,N-trimethyl-2-oxoethanaminium BETAINE ALDEHYDE|Betaine aldehyde|N,N,N-trimethyl-2-oxoethanaminium|betaine aldehyde|glycine betaine aldehyde http://purl.obolibrary.org/obo/CHEBI_15710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15711 biolink:ChemicalEntity 1D-1-O-(indol-3-yl)acetyl-myo-inositol A cyclitol ester that is 1D-myo-inositol bearing a indol-3-acetyl substituent at position 1. kegg.compound:C03868 Graph 1D-1-O-(indol-3-yl)acetyl-myo-inositol|Indol-3-ylacetyl-1D-myo-inositol|Indol-3-ylacetyl-myo-inositol|Indole-3-acetyl-myo-inositol|Indole-3-ylacetyl-myo-inositol|indole-3-acetyl-1D-myo-inositol 1D-1-O-(indol-3-yl)acetyl-myo-inositol 1D-1-O-(indol-3-yl)acetyl-myo-inositol|Indol-3-ylacetyl-1D-myo-inositol|Indol-3-ylacetyl-myo-inositol|Indole-3-acetyl-myo-inositol|Indole-3-ylacetyl-myo-inositol|indole-3-acetyl-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_15711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15712 biolink:ChemicalEntity 2,3-dihydrobiochanin A A hydroxyisoflavanone that is the 2,3-dihydro derivative of biochanin A. cas:83920-62-1|kegg.compound:C02675|knapsack:C00009553|pubmed:1477911|pubmed:16462085|pubmed:17442349|pubmed:21345747|pubmed:23030687|pubmed:7623042|reaxys:1260381 Graph 2,3-Dihydrobiochanin A|2,3-dihydrobiochanin A|5,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|Dihydrobiochanin A 5,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one 2,3-Dihydrobiochanin A|2,3-dihydrobiochanin A|5,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|Dihydrobiochanin A http://purl.obolibrary.org/obo/CHEBI_15712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15713 biolink:ChemicalEntity UTP A pyrimidine ribonucleoside 5'-triphosphate having uracil as the nucleobase. beilstein:71520|cas:63-39-8|drugbank:DB04005|drugcentral:3639|gmelin:307896|kegg.compound:C00075|pdb-ccd:UTP Graph 5'-UTP|H4utp|UTP|Uridine 5'-triphosphate|Uridine triphosphate|uridine 5'-(tetrahydrogen triphosphate)|uridine 5'-triphosphoric acid uridine 5'-(tetrahydrogen triphosphate) 5'-UTP|H4utp|UTP|Uridine 5'-triphosphate|Uridine triphosphate|uridine 5'-(tetrahydrogen triphosphate)|uridine 5'-triphosphoric acid http://purl.obolibrary.org/obo/CHEBI_15713 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15714 biolink:ChemicalEntity trans-sinapic acid A sinapic acid in which the double bond has trans-configuration. cas:7362-37-0|drugbank:DB08587|hmdb:HMDB0032616|kegg.compound:C00482|knapsack:C00002776|pdb-ccd:SXX|reaxys:2699118|wikipedia.en:Sinapinic_acid Graph (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid|(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid|(E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid|SINAPINATE|sinapic acid|sinapinic acid (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid|(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid|(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid|(E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid|SINAPINATE|sinapic acid|sinapinic acid http://purl.obolibrary.org/obo/CHEBI_15714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15715 biolink:ChemicalEntity streptomycin 3''-phosphate A streptomycin phosphate having the phosphate group placed at the 3''-position. kegg.compound:C03731 Graph Streptomycin 3''-phosphate|[2-deoxy-2-(methylamino)-3-O-phosphono-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine}|streptomycin 3''-(dihydrogen phosphate) [2-deoxy-2-(methylamino)-3-O-phosphono-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine} Streptomycin 3''-phosphate|[2-deoxy-2-(methylamino)-3-O-phosphono-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine}|streptomycin 3''-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15716 biolink:ChemicalEntity 12-hydroxydihydrochelirubine A benzophenanthridine alkaloid comprising dihydrochelirubine carrying a hydroxy substituent at the 12-position. cas:131984-77-5|kegg.compound:C05193|knapsack:C00027673 Graph 12-Hydroxychelirubine|12-Hydroxydihydrochelirubine|12-hydroxydihydrochelirubine|5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-7-ol 5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-7-ol 12-Hydroxychelirubine|12-Hydroxydihydrochelirubine|12-hydroxydihydrochelirubine|5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-7-ol http://purl.obolibrary.org/obo/CHEBI_15716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157175 biolink:ChemicalEntity enoxacin A 1,8-naphthyridine derivative that is 1,4-dihydro-1,8-naphthyridine with an ethyl group at the 1 position, a carboxy group at the 3-position, an oxo sustituent at the 4-position, a fluoro substituent at the 5-position and a piperazin-1-yl group at the 7 position. An antibacterial, it is used in the treatment of urinary-tract infections and gonorrhoea. cas:74011-58-8|drugbank:DB00467|drugcentral:1013|kegg.compound:C06979|kegg.drug:D00310|lincs.smallmolecule:LSM-5848|patent:EP9425|patent:US4352803|patent:US4359578|pubmed:16644219|pubmed:8741236|reaxys:3628995|vsdb:1896|wikipedia.en:Enoxacin Graph 1-Ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid|1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-naphthyridine-3-carboxylic acid|1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid|ENOXACIN|Enoxacin|enoxacin|enoxacine|enoxacino|enoxacinum 1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 1-Ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid|1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-naphthyridine-3-carboxylic acid|1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid|ENOXACIN|Enoxacin|enoxacin|enoxacine|enoxacino|enoxacinum http://purl.obolibrary.org/obo/CHEBI_157175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15718 biolink:ChemicalEntity 2,3',4,6-tetrahydroxybenzophenone kegg.compound:C06355 Graph (3-hydroxyphenyl)(2,4,6-trihydroxyphenyl)methanone|2,3',4,6-Tetrahydroxybenzophenone (3-hydroxyphenyl)(2,4,6-trihydroxyphenyl)methanone (3-hydroxyphenyl)(2,4,6-trihydroxyphenyl)methanone|2,3',4,6-Tetrahydroxybenzophenone http://purl.obolibrary.org/obo/CHEBI_15718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15719 biolink:ChemicalEntity ferricytochrome Any cytochrome containing a ferriheme. kegg.compound:C00923 Graph Ferricytochrome Ferricytochrome http://purl.obolibrary.org/obo/CHEBI_15719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15721 biolink:ChemicalEntity sedoheptulose 7-phosphate A ketoheptose phosphate consisting of sedoheptulose having a phosphate group at the 7-position. It is an intermediate metabolite in the pentose phosphate pathway. cas:2646-35-7|hmdb:HMDB0001068|kegg.compound:C05382|knapsack:C00019575|metacyc.compound:D-SEDOHEPTULOSE-7-P|pubmed:13989902|pubmed:165386|pubmed:23514175|pubmed:33257730|pubmed:38029258|pubmed:3826613|pubmed:38685871|pubmed:5844826|wikipedia.en:Sedoheptulose_7-phosphate Graph D-Sedoheptulose 7-phosphate|D-altro-Heptulose 7-phosphate|D-altro-hept-2-ulose 7-phosphate|Sedoheptulose 7-phosphate|altro-Heptulose 7-phosphate D-altro-hept-2-ulose 7-phosphate D-Sedoheptulose 7-phosphate|D-altro-Heptulose 7-phosphate|D-altro-hept-2-ulose 7-phosphate|Sedoheptulose 7-phosphate|altro-Heptulose 7-phosphate http://purl.obolibrary.org/obo/CHEBI_15721 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15722 biolink:ChemicalEntity peptidyl amide A peptide that has a carbamoyl group at the C-terminus. kegg.compound:C02179|metacyc.compound:PEPTIDAMIDE-CPD Graph peptidyl amides peptidyl amides http://purl.obolibrary.org/obo/CHEBI_15722 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15723 biolink:ChemicalEntity 1,6-bis-O-galloyl-beta-D-glucose A galloyl-β-D-glucose compound having two galloyl groups in the 1- and 6-positions. kegg.compound:C04101 Graph 1,6-bis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1,6-bis-O-galloyl-beta-D-glucose|1-O,6-O-Digalloyl-beta-D-glucose|1-O,6-O-digalloyl-beta-D-glucose 1,6-bis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose 1,6-bis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1,6-bis-O-galloyl-beta-D-glucose|1-O,6-O-Digalloyl-beta-D-glucose|1-O,6-O-digalloyl-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_15723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15724 biolink:ChemicalEntity trimethylamine N-oxide A tertiary amine oxide resulting from the oxidation of the amino group of trimethylamine. cas:1184-78-7|gmelin:1839|hmdb:HMDB0000925|kegg.compound:C01104|metacyc.compound:TRIMENTHLAMINE-N-O|pdb-ccd:TMO|pubmed:12683801|pubmed:1453985|pubmed:17697669|pubmed:19425246|pubmed:22770225|pubmed:3170512|pubmed:3674879|reaxys:1734787|wikipedia.en:Trimethylamine_oxide Graph (CH3)3NO|Me3N(+)O(-)|Me3N(O)|N(CH3)3O|N,N-dimethylmethanamine oxide|TMAO|Trimethylamine N-oxide|Trimethylaminoxid|trimethylamine N-oxide|trimethylamine oxide|trimethyloxamine N,N-dimethylmethanamine oxide (CH3)3NO|Me3N(+)O(-)|Me3N(O)|N(CH3)3O|N,N-dimethylmethanamine oxide|TMAO|Trimethylamine N-oxide|Trimethylaminoxid|trimethylamine N-oxide|trimethylamine oxide|trimethyloxamine http://purl.obolibrary.org/obo/CHEBI_15724 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15725 biolink:ChemicalEntity trimethylenediamine An alkane-α,ω-diamine comprising a propane skeleton with amino substituents at positions 1 and 3. cas:109-76-2|gmelin:1298|hmdb:HMDB0000002|kegg.compound:C00986|knapsack:C00007404|metacyc.compound:CPD-313|pdb-ccd:13D|pubmed:1035932|pubmed:10930630|pubmed:1238529|pubmed:17668437|pubmed:4798530|pubmed:6042782|pubmed:739391|pubmed:987217|reaxys:605277|wikipedia.en:1,3-Diaminopropane Graph 1,3-diamino-n-propane|1,3-diaminopropane|1,3-propanediamine|1,3-propylenediamine|1,3-trimethylenediamine|3-aminopropylamine|Propane-1,3-diamine|alpha,omega-propanediamine|propane-1,3-diamine|tn|trimethylenediamine Propane-1,3-diamine|propane-1,3-diamine 1,3-diamino-n-propane|1,3-diaminopropane|1,3-propanediamine|1,3-propylenediamine|1,3-trimethylenediamine|3-aminopropylamine|Propane-1,3-diamine|alpha,omega-propanediamine|propane-1,3-diamine|tn|trimethylenediamine http://purl.obolibrary.org/obo/CHEBI_15725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15727 biolink:ChemicalEntity carnosine A dipeptide that is the N-(β-alanyl) derivative of L-histidine. cas:305-84-0|chemspider:388363|drugbank:DB11695|hmdb:HMDB0000033|kegg.compound:C00386|knapsack:C00052222|pdb-ccd:8V0|pubmed:10841274|pubmed:10951105|pubmed:10951108|pubmed:11470131|pubmed:11707898|pubmed:11911459|pubmed:11976203|pubmed:12139778|pubmed:15853927|pubmed:15878720|pubmed:15941308|pubmed:16162015|pubmed:16181134|pubmed:16287364|pubmed:16406688|pubmed:16804013|pubmed:17031479|pubmed:1735411|pubmed:17443912|pubmed:18019400|pubmed:18076890|pubmed:18773880|pubmed:19309105|pubmed:20017611|pubmed:20681748|pubmed:24398899|pubmed:2674258|pubmed:29463897|pubmed:31951767|pubmed:33586561|pubmed:33704575|pubmed:34067694|pubmed:8689392|pubmed:9029640|pubmed:9928418|reaxys:87671|wikipedia.en:Carnosine Graph (2S)-2-(3-aminopropanamido)-3-(1H-imidazol-4-yl)propanoic acid|Carnosine|Karnozin|Karnozzn|L-carnosine|N(alpha)-(beta-alanyl)-L-histidine|N-(3-aminopropanoyl)-L-histidine|N-2-M|N-beta-alanyl-L-histidine|Nalpha-(beta-alanyl)-L-histidine|beta-alanyl-L-histidine|ignotine N(alpha)-(beta-alanyl)-L-histidine (2S)-2-(3-aminopropanamido)-3-(1H-imidazol-4-yl)propanoic acid|Carnosine|Karnozin|Karnozzn|L-carnosine|N(alpha)-(beta-alanyl)-L-histidine|N-(3-aminopropanoyl)-L-histidine|N-2-M|N-beta-alanyl-L-histidine|Nalpha-(beta-alanyl)-L-histidine|beta-alanyl-L-histidine|ignotine http://purl.obolibrary.org/obo/CHEBI_15727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15728 biolink:ChemicalEntity 4-guanidinobutanoic acid The 4-guanidino derivative of butanoic acid. cas:463-00-3|hmdb:HMDB0003464|kegg.compound:C01035|pdb-ccd:ALG|pubmed:22735334|reaxys:1766447 Graph 4-(carbamimidamido)butanoic acid|4-Guanidinobutanoate|4-Guanidinobutyric acid|4-carbamimidamidobutanoic acid|gamma-Guanidinobutyrate|gamma-Guanidinobutyric acid 4-(carbamimidamido)butanoic acid 4-(carbamimidamido)butanoic acid|4-Guanidinobutanoate|4-Guanidinobutyric acid|4-carbamimidamidobutanoic acid|gamma-Guanidinobutyrate|gamma-Guanidinobutyric acid http://purl.obolibrary.org/obo/CHEBI_15728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15729 biolink:ChemicalEntity L-ornithine An optically active form of ornithine having L-configuration. cas:70-26-8|drugbank:DB00129|drugcentral:3401|gmelin:327282|hmdb:HMDB0000214|kegg.compound:C00077|kegg.drug:D08302|knapsack:C00001384|metacyc.compound:ORNITHINE|pdb-ccd:ORN|pubmed:15576628|pubmed:17190852|pubmed:18676473|pubmed:19083482|pubmed:19173225|pubmed:22033378|pubmed:22133808|pubmed:22387109|pubmed:22735334|reaxys:1722298|wikipedia.en:Ornithine Graph (2S)-2,5-diaminopentanoic acid|(S)-2,5-Diaminopentanoate|(S)-2,5-Diaminopentanoic acid|(S)-2,5-diaminovaleric acid|(S)-alpha,delta-diaminovaleric acid|(S)-ornithine|L-Ornithine|L-ornithine (2S)-2,5-diaminopentanoic acid|L-Ornithine|L-ornithine (2S)-2,5-diaminopentanoic acid|(S)-2,5-Diaminopentanoate|(S)-2,5-Diaminopentanoic acid|(S)-2,5-diaminovaleric acid|(S)-alpha,delta-diaminovaleric acid|(S)-ornithine|L-Ornithine|L-ornithine http://purl.obolibrary.org/obo/CHEBI_15729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15730 biolink:ChemicalEntity pyruvic oxime An oxime obtained via formal condensation of pyruvic acid with hydroxylamine. beilstein:1747144|cas:2211-14-5|gmelin:217667|kegg.compound:C02193 Graph 2-(hydroxyimino)propanoic acid|2-oximinopropanoic acid|Pyruvate oxime|pyruvatoxime 2-(hydroxyimino)propanoic acid 2-(hydroxyimino)propanoic acid|2-oximinopropanoic acid|Pyruvate oxime|pyruvatoxime http://purl.obolibrary.org/obo/CHEBI_15730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15732 biolink:ChemicalEntity phosphonoacetic acid A member of the class of phosphonic acids that is phosphonic acid in which the hydrogen attached to the phosphorous is replaced by a carboxymethyl group. cas:4408-78-0|drugbank:DB02823|hmdb:HMDB0004110|kegg.compound:C05682|pdb-ccd:PAE|pubmed:16282466|pubmed:24335308|pubmed:24570323|reaxys:1764355 Graph Fosfonet|Phosphonoacetate|Phosphonoacetic acid|phosphonoacetic acid Phosphonoacetic acid|phosphonoacetic acid Fosfonet|Phosphonoacetate|Phosphonoacetic acid|phosphonoacetic acid http://purl.obolibrary.org/obo/CHEBI_15732 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15733 biolink:ChemicalEntity N-methylaniline A methylaniline that is aniline carrying a methyl substituent at the nitrogen atom. cas:100-61-8|kegg.compound:C02299|pdb-ccd:1MR|pubmed:19223035|pubmed:23357676|reaxys:741982|wikipedia.en:N-Methylaniline Graph (Methylamino)benzene|Methylaniline|Methylphenylamine|Monomethylaniline|N-Methyl-N-phenylamine|N-Methylaminobenzene|N-Methylaniline|N-Methylbenzenamine|N-Methylphenylamine|N-Monomethylaniline|N-Phenylmethylamine|N-methylaniline (Methylamino)benzene|Methylaniline|Methylphenylamine|Monomethylaniline|N-Methyl-N-phenylamine|N-Methylaminobenzene|N-Methylaniline|N-Methylbenzenamine|N-Methylphenylamine|N-Monomethylaniline|N-Phenylmethylamine|N-methylaniline http://purl.obolibrary.org/obo/CHEBI_15733 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15734 biolink:ChemicalEntity primary alcohol A primary alcohol is a compound in which a hydroxy group, ‒OH, is attached to a saturated carbon atom which has either three hydrogen atoms attached to it or only one other carbon atom and two hydrogen atoms attached to it. kegg.compound:C00226 Graph 1-Alcohol|Primary alcohol|a primary alcohol|primary alcohols 1-Alcohol|Primary alcohol|a primary alcohol|primary alcohols http://purl.obolibrary.org/obo/CHEBI_15734 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15735 biolink:ChemicalEntity S-formylmycothiol kegg.compound:C06718 Graph (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-S-formyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside|1D-1-O-[2-(N-acetyl-S-formyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-myo-inositol|S-Formylmycothiol|S-formylmycothiol (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-S-formyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-S-formyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside|1D-1-O-[2-(N-acetyl-S-formyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-myo-inositol|S-Formylmycothiol|S-formylmycothiol http://purl.obolibrary.org/obo/CHEBI_15735 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15737 biolink:ChemicalEntity N-carbamoylsarcosine The N-carbamoyl derivative of sarcosine. kegg.compound:C01043|pdb-ccd:CMS Graph N-Carbamoylsarcosine|[carbamoyl(methyl)amino]acetic acid [carbamoyl(methyl)amino]acetic acid N-Carbamoylsarcosine|[carbamoyl(methyl)amino]acetic acid http://purl.obolibrary.org/obo/CHEBI_15737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15738 biolink:ChemicalEntity staurosporine cas:62996-74-1|drugbank:DB02010|kegg.compound:C02079|knapsack:C00018127|lincs.smallmolecule:LSM-1103|pdb-ccd:STU|pubmed:15613975|pubmed:15682296|pubmed:18478334|pubmed:22363408|pubmed:32800439|pubmed:34428735|wikipedia.en:Staurosporine Graph (+)-Staurosporine|(5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one|AM-2282|STS|Staurosporin|Staurosporine|antibiotic AM 2282 (5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one (+)-Staurosporine|(5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylamino-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-one|AM-2282|STS|Staurosporin|Staurosporine|antibiotic AM 2282 http://purl.obolibrary.org/obo/CHEBI_15738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15739 biolink:ChemicalEntity isopropylamine A member of the class of alkylamines that is propane carrying an amino group at position 2. cas:75-31-0|kegg.compound:C06748|metacyc.compound:ISOPROPYLAMINE|pubmed:23897436|pubmed:24365708|reaxys:605259|umbbd.compound:c0656|wikipedia.en:Isopropylamine Graph 2-Aminopropane|2-Propanamine|2-aminopropane|2-propanamine|Isopropylamine|Monoisopropylamine|propan-2-amine propan-2-amine 2-Aminopropane|2-Propanamine|2-aminopropane|2-propanamine|Isopropylamine|Monoisopropylamine|propan-2-amine http://purl.obolibrary.org/obo/CHEBI_15739 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15740 biolink:ChemicalEntity formate A monocarboxylic acid anion that is the conjugate base of formic acid. Induces severe metabolic acidosis and ocular injury in human subjects. cas:71-47-6|gmelin:1006|hmdb:HMDB0000142|kegg.compound:C00058|metacyc.compound:FORMATE|pubmed:17190852|pubmed:3946945|reaxys:1901205|umbbd.compound:c0106|wikipedia.en:Formate Graph HCO2 anion|aminate|formate|formiate|formic acid, ion(1-)|formylate|hydrogen carboxylate|methanoate formate HCO2 anion|aminate|formate|formiate|formic acid, ion(1-)|formylate|hydrogen carboxylate|methanoate http://purl.obolibrary.org/obo/CHEBI_15740 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15741 biolink:ChemicalEntity succinic acid An α,ω-dicarboxylic acid resulting from the formal oxidation of each of the terminal methyl groups of butane to the corresponding carboxy group. It is an intermediate metabolite in the citric acid cycle. cas:110-15-6|drugbank:DB00139|drugcentral:2487|ecmdb:ECMDB00254|gmelin:2785|hmdb:HMDB0000254|kegg.compound:C00042|knapsack:C00001205|lipidmaps:LMFA01170043|metacyc.compound:SUC|pdb-ccd:SIN|pubmed:17439666|reaxys:1754069|wikipedia.en:Succinic_acid|ymdb:YMDB00338 Graph 1,2-ethanedicarboxylic acid|Bernsteinsaeure|Butandisaeure|Butanedionic acid|Dihydrofumaric acid|E363|Ethylenesuccinic acid|HOOC-CH2-CH2-COOH|SUCCINIC ACID|Succinic acid|acide butanedioique|acide succinique|acidum succinicum|amber acid|asuccin|butanedioic acid|spirit of amber|succinic acid SUCCINIC ACID|Succinic acid|butanedioic acid|succinic acid 1,2-ethanedicarboxylic acid|Bernsteinsaeure|Butandisaeure|Butanedionic acid|Dihydrofumaric acid|E363|Ethylenesuccinic acid|HOOC-CH2-CH2-COOH|SUCCINIC ACID|Succinic acid|acide butanedioique|acide succinique|acidum succinicum|amber acid|asuccin|butanedioic acid|spirit of amber|succinic acid http://purl.obolibrary.org/obo/CHEBI_15741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15742 biolink:ChemicalEntity pseudotropine beilstein:80189|cas:135-97-7|drugbank:DB04026|kegg.compound:C02066|knapsack:C00002301|pdb-ccd:PTO Graph (3-exo)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|1alphaH,5alphaH-tropan-3beta-ol|3-pseudotropanol|3beta-tropanol|PSEUDOTROPINE|Pseudotropine|exo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|pseudotropanol|psi-tropine|tropan-3beta-ol tropan-3beta-ol (3-exo)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|1alphaH,5alphaH-tropan-3beta-ol|3-pseudotropanol|3beta-tropanol|PSEUDOTROPINE|Pseudotropine|exo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|pseudotropanol|psi-tropine|tropan-3beta-ol http://purl.obolibrary.org/obo/CHEBI_15742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15743 biolink:ChemicalEntity butanal A member of the class of butanals that consists of propane bearing a formyl substituent at the 1-position. The parent of the class of butanals. cas:123-72-8|hmdb:HMDB0003543|kegg.compound:C01412|metacyc.compound:BUTANAL|pubmed:16347493|pubmed:20833537|reaxys:506061|wikipedia.en:Butanal Graph 1-Butanal|Aldehyde butyrique|Aldeide butirrica|Butal|Butaldehyde|Butanal|Butanaldehyde|Butyl aldehyde|Butylaldehyde|Butyral|Butyraldehyd|Butyraldehyde|Butyric aldehyde|Butyrylaldehyde|butan-1-al|butanal|n-Butanal|n-Butyl aldehyde|n-Butyraldehyde|n-C3H7CHO Butanal|butanal 1-Butanal|Aldehyde butyrique|Aldeide butirrica|Butal|Butaldehyde|Butanal|Butanaldehyde|Butyl aldehyde|Butylaldehyde|Butyral|Butyraldehyd|Butyraldehyde|Butyric aldehyde|Butyrylaldehyde|butan-1-al|butanal|n-Butanal|n-Butyl aldehyde|n-Butyraldehyde|n-C3H7CHO http://purl.obolibrary.org/obo/CHEBI_15743 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15745 biolink:ChemicalEntity 2-aminomuconic 6-semialdehyde A muconic semialdehyde having a 2-amino substituent. kegg.compound:C03824|knapsack:C00007492|umbbd.compound:c0318 Graph (2E,4Z)-2-amino-6-oxohexa-2,4-dienoic acid|2-Aminomuconate 6-semialdehyde|2-Aminomuconate semialdehyde|2-aminomuconic semialdehyde (2E,4Z)-2-amino-6-oxohexa-2,4-dienoic acid (2E,4Z)-2-amino-6-oxohexa-2,4-dienoic acid|2-Aminomuconate 6-semialdehyde|2-Aminomuconate semialdehyde|2-aminomuconic semialdehyde http://purl.obolibrary.org/obo/CHEBI_15745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15746 biolink:ChemicalEntity spermine A polyazaalkane that is tetradecane in which the carbons at positions 1, 5, 10 and 14 are replaced by nitrogens. Spermine has broad actions on cellular metabolism. cas:71-44-3|drugbank:DB00127|gmelin:454653|hmdb:HMDB0001256|kegg.compound:C00750|knapsack:C00001432|metacyc.compound:SPERMINE|pdb-ccd:SPM|pubmed:10873205|pubmed:10930630|pubmed:11341774|pubmed:11543598|pubmed:11805860|pubmed:15145762|pubmed:15308338|pubmed:15500473|pubmed:15972654|pubmed:16146631|pubmed:16253230|pubmed:16664713|pubmed:19275753|pubmed:19593412|pubmed:19962967|pubmed:22735334|pubmed:23289636|pubmed:23418509|pubmed:23506248|pubmed:23820617|pubmed:23887925|pubmed:7521253|pubmed:7721849|pubmed:8524182|pubmed:8832899|pubmed:9151701|reaxys:1750791|wikipedia.en:Spermine Graph 4,9-diaza-1,12-dodecanediamine|4,9-diazadodecane-1,12-diamine|N,N'-Bis(3-aminopropyl)-1,4-butanediamine|N,N'-bis(3-aminopropyl)butane-1,4-diamine|SPERMINE|Spermine N,N'-bis(3-aminopropyl)butane-1,4-diamine 4,9-diaza-1,12-dodecanediamine|4,9-diazadodecane-1,12-diamine|N,N'-Bis(3-aminopropyl)-1,4-butanediamine|N,N'-bis(3-aminopropyl)butane-1,4-diamine|SPERMINE|Spermine http://purl.obolibrary.org/obo/CHEBI_15746 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15748 biolink:ChemicalEntity D-glucuronate kegg.compound:C00191 Graph D-Glucuronate|D-glucuronate|Glucuronate D-glucuronate D-Glucuronate|D-glucuronate|Glucuronate http://purl.obolibrary.org/obo/CHEBI_15748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15749 biolink:ChemicalEntity 3-carboxy-cis,cis-muconic acid The 3-carboxy derivative of cis,cis-muconic acid. cas:1116-26-3|kegg.compound:C01163|knapsack:C00007499|umbbd.compound:c0191 Graph (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylic acid|3-Carboxy-cis,cis-muconate|3-carboxy-cis,cis-muconate|beta-Carboxy-cis,cis-muconate|beta-carboxy-cis,cis-muconate|cis,cis-Butadiene-1,2,4-tricarboxylate|cis,cis-butadiene-1,2,4-tricarboxylate (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylic acid (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylic acid|3-Carboxy-cis,cis-muconate|3-carboxy-cis,cis-muconate|beta-Carboxy-cis,cis-muconate|beta-carboxy-cis,cis-muconate|cis,cis-Butadiene-1,2,4-tricarboxylate|cis,cis-butadiene-1,2,4-tricarboxylate http://purl.obolibrary.org/obo/CHEBI_15749 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15750 biolink:ChemicalEntity dolichyl diphosphate cas:37247-98-6|kegg.compound:C00621 Graph Dolichol diphosphate|Dolichol pyrophosphate|Dolichyl diphosphate|Dolichyl pyrophosphate|alpha-(3-methylbut-2-en-1-yl)-omega-(4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbutyl)poly[(2E)-2-methylbut-2-ene-1,4-diyl] alpha-(3-methylbut-2-en-1-yl)-omega-(4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbutyl)poly[(2E)-2-methylbut-2-ene-1,4-diyl] Dolichol diphosphate|Dolichol pyrophosphate|Dolichyl diphosphate|Dolichyl pyrophosphate|alpha-(3-methylbut-2-en-1-yl)-omega-(4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbutyl)poly[(2E)-2-methylbut-2-ene-1,4-diyl] http://purl.obolibrary.org/obo/CHEBI_15750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15751 biolink:ChemicalEntity ADP alpha-D-glucoside An ADP-aldose having α-D-glucopyranose as the sugar moiety. cas:2140-58-1|ecmdb:ECMDB06557|hmdb:HMDB0006557|kegg.compound:C00498|kegg.glycan:G11109|pdb-ccd:ADQ|pubmed:15951568|pubmed:23292602|pubmed:23537328|pubmed:24762788|pubmed:25133777|reaxys:1207857 Graph ADP-glucose|ADPG|ADPglucose|Adenosine diphosphate glucose|Adenosine diphosphoglucose|Adenosine pyrophosphateglucose|adenosine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] adenosine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] ADP-glucose|ADPG|ADPglucose|Adenosine diphosphate glucose|Adenosine diphosphoglucose|Adenosine pyrophosphateglucose|adenosine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15751 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15753 biolink:ChemicalEntity 2-oxoadipic acid An oxo dicarboxylic acid that is adipic acid substituted by an oxo group at position 2. cas:3184-35-8|chemspider:70|foodb.food:FDB003362|hmdb:HMDB0000225|kegg.compound:C00322|knapsack:C00000770|lipidmaps:LMFA01170121|pdb-ccd:OOG|pubmed:10655159|pubmed:11013234|pubmed:11083877|pubmed:14163891|pubmed:16183823|pubmed:16349595|pubmed:21228461|pubmed:23150724|pubmed:25454257|pubmed:27082660|pubmed:28780854|pubmed:29082669|pubmed:30175794|pubmed:30742897|pubmed:32160276|pubmed:32523014|pubmed:33401897|pubmed:33642466|pubmed:34091113|pubmed:4284830|pubmed:5836515|pubmed:8087979|pubmed:8495733|pubmed:9869358|reaxys:1772134|wikipedia.en:Alpha-Ketoadipic_acid Graph 2-Oxoadipic acid|2-ketoadipic acid|2-oxo-hexanedioic acid|2-oxohexanedioic acid|alpha-ketoadipic acid|alpha-oxoadipic acid 2-oxohexanedioic acid 2-Oxoadipic acid|2-ketoadipic acid|2-oxo-hexanedioic acid|2-oxohexanedioic acid|alpha-ketoadipic acid|alpha-oxoadipic acid http://purl.obolibrary.org/obo/CHEBI_15753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15754 biolink:ChemicalEntity 3-O-beta-D-galactopyranosyl-sn-glycerol glytoucan:G98889VY|kegg.compound:C05401|knapsack:C00019351|pdb-ccd:RGG Graph (2R)-2,3-dihydroxypropyl beta-D-galactopyranoside|3-O-beta-D-galactosyl-sn-glycerol|3-beta-D-Galactosyl-sn-glycerol|3-beta-D-galactosyl-sn-glycerol|Galactosylglycerol (2R)-2,3-dihydroxypropyl beta-D-galactopyranoside|3-O-beta-D-galactosyl-sn-glycerol (2R)-2,3-dihydroxypropyl beta-D-galactopyranoside|3-O-beta-D-galactosyl-sn-glycerol|3-beta-D-Galactosyl-sn-glycerol|3-beta-D-galactosyl-sn-glycerol|Galactosylglycerol http://purl.obolibrary.org/obo/CHEBI_15754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15755 biolink:ChemicalEntity 3alpha,7alpha,12beta-trihydroxy-5beta-cholanate A bile acid anion that is the conjugate base of 3α,7α,12β-trihydroxy-5β-cholanic acid, obtained by deprotonation of the carboxy group. Graph 3-alpha,7-alpha,12-beta-trihydroxy-5-beta-cholanate|3alpha,7alpha,12beta-trihydroxy-5beta-cholan-24-oate 3alpha,7alpha,12beta-trihydroxy-5beta-cholan-24-oate 3-alpha,7-alpha,12-beta-trihydroxy-5-beta-cholanate|3alpha,7alpha,12beta-trihydroxy-5beta-cholan-24-oate http://purl.obolibrary.org/obo/CHEBI_15755 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15756 biolink:ChemicalEntity hexadecanoic acid A straight-chain, sixteen-carbon, saturated long-chain fatty acid. cas:57-10-3|drugbank:DB03796|gmelin:190200|hmdb:HMDB0000220|kegg.compound:C00249|kegg.drug:D05341|knapsack:C00001233|knapsack:C00030479|lipidmaps:LMFA01010001|metacyc.compound:PALMITATE|pdb-ccd:PLM|ppdb:1336|pubmed:12492626|pubmed:15357969|pubmed:1589452|pubmed:16509590|pubmed:16884313|pubmed:17439666|pubmed:17502136|pubmed:20001317|pubmed:22735334|pubmed:25584012|pubmed:28600633|reaxys:607489|wikipedia.en:Palmitic_acid Graph 1-Pentadecanecarboxylic acid|1-hexyldecanoic acid|16:00|C16|C16 fatty acid|C16:0|CH3-[CH2]14-COOH|FA 16:0|Hexadecanoate|Hexadecylic acid|Hexaectylic acid|PALMITIC ACID|Palmitate|Palmitic acid|Palmitinic acid|Palmitinsaeure|Pentadecanecarboxylic acid|cetylic acid|hexadecanoic acid|hexadecoic acid|n-hexadecanoic acid|n-hexadecoic acid|palmitic acid hexadecanoic acid 1-Pentadecanecarboxylic acid|1-hexyldecanoic acid|16:00|C16|C16 fatty acid|C16:0|CH3-[CH2]14-COOH|FA 16:0|Hexadecanoate|Hexadecylic acid|Hexaectylic acid|PALMITIC ACID|Palmitate|Palmitic acid|Palmitinic acid|Palmitinsaeure|Pentadecanecarboxylic acid|cetylic acid|hexadecanoic acid|hexadecoic acid|n-hexadecanoic acid|n-hexadecoic acid|palmitic acid http://purl.obolibrary.org/obo/CHEBI_15756 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15757 biolink:ChemicalEntity (S)-4-amino-5-oxopentanoic acid A 5-oxo monocarboxylic acid that is 5-oxopentanoic acid substituted by an amino group at position 4 (the 4S-stereoisomer). cas:68462-55-5|kegg.compound:C03741|knapsack:C00007379|knapsack:C00019659 Graph (4S)-4-amino-5-oxopentanoic acid|(S)-4-Amino-5-oxopentanoate|(S)-4-amino-5-oxopentanoic acid|4-AMINO-5-OXO-PENTANOIC ACID|L-Glutamate 1-semialdehyde|glutamate-1-semialdehyde (4S)-4-amino-5-oxopentanoic acid (4S)-4-amino-5-oxopentanoic acid|(S)-4-Amino-5-oxopentanoate|(S)-4-amino-5-oxopentanoic acid|4-AMINO-5-OXO-PENTANOIC ACID|L-Glutamate 1-semialdehyde|glutamate-1-semialdehyde http://purl.obolibrary.org/obo/CHEBI_15757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15758 biolink:ChemicalEntity leucocyanidin cas:480-17-1|kegg.compound:C05906 Graph (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|3,3',4,4',5,7-Flavanhexol|3,4-Cyanidiol|Leucoanthocyanidol|Leucocianidol|Leucocyanidin|Leucocyanidol|Leukocyanidine|Procyanidol|Resivit (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrol|3,3',4,4',5,7-Flavanhexol|3,4-Cyanidiol|Leucoanthocyanidol|Leucocianidol|Leucocyanidin|Leucocyanidol|Leukocyanidine|Procyanidol|Resivit http://purl.obolibrary.org/obo/CHEBI_15758 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15759 biolink:ChemicalEntity 2,3-epoxyphylloquinone cas:25486-55-9|pubmed:17101711|pubmed:17124179|pubmed:25524619|pubmed:35411052|pubmed:849285 Graph 1a-methyl-7a-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione|2,3-epoxy-2,3-dihydro-2-methyl-3-phytyl-1,4-naphthoquinone|2,3-epoxyphylloquinone|vitamin K1 2,3-epoxide 1a-methyl-7a-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione 1a-methyl-7a-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione|2,3-epoxy-2,3-dihydro-2-methyl-3-phytyl-1,4-naphthoquinone|2,3-epoxyphylloquinone|vitamin K1 2,3-epoxide http://purl.obolibrary.org/obo/CHEBI_15759 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157597 biolink:ChemicalEntity N-tetracosenoyl-sphingoid base A ceramide having a tetracosenoyl fatty chain where the double bond position is not defined, and also the sphingoid base is undefined. Graph C24:1 ceramide|an N-tetracosenoyl-sphingoid base C24:1 ceramide|an N-tetracosenoyl-sphingoid base http://purl.obolibrary.org/obo/CHEBI_157597 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15760 biolink:ChemicalEntity tyramine A primary amino compound obtained by formal decarboxylation of the amino acid tyrosine. cas:51-67-2|drugcentral:2784|gmelin:82946|hmdb:HMDB0000306|kegg.compound:C00483|knapsack:C00001435|lincs.smallmolecule:LSM-19016|metacyc.compound:TYRAMINE|pdb-ccd:AEF|pubmed:11361052|pubmed:11919655|pubmed:12183041|pubmed:12707242|pubmed:12811595|pubmed:15000446|pubmed:15848803|pubmed:15932098|pubmed:18422653|pubmed:18970430|pubmed:19137318|pubmed:19189084|pubmed:21570963|pubmed:21628600|pubmed:21651557|pubmed:21679153|pubmed:21850574|pubmed:21909937|pubmed:22735334|pubmed:3137238|pubmed:319927|pubmed:6501508|pubmed:9282832|pubmed:9731223|reaxys:1099914|wikipedia.en:Tyramine Graph 2-(p-Hydroxyphenyl)ethylamine|4-(2-aminoethyl)phenol|4-Hydroxy-beta-phenylethylamine|4-Hydroxyphenylethylamine|4-hydroxyphenethylamine|Tyramin|Tyramine|beta-(4-Hydroxyphenyl)ethylamine|p-(2-Aminoethyl)phenol|p-(2-aminoethyl)phenol|p-hydroxyphenethylamine|p-hydroxyphenylethylamine|p-tyramine 4-(2-aminoethyl)phenol 2-(p-Hydroxyphenyl)ethylamine|4-(2-aminoethyl)phenol|4-Hydroxy-beta-phenylethylamine|4-Hydroxyphenylethylamine|4-hydroxyphenethylamine|Tyramin|Tyramine|beta-(4-Hydroxyphenyl)ethylamine|p-(2-Aminoethyl)phenol|p-(2-aminoethyl)phenol|p-hydroxyphenethylamine|p-hydroxyphenylethylamine|p-tyramine http://purl.obolibrary.org/obo/CHEBI_15760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15761 biolink:ChemicalEntity N-methylpyridinium cas:694-56-4|kegg.compound:C02724 Graph 1-Methylpyridinium|1-methylpyridinium|N-Methylpyridinium|N-methylpyridinium 1-methylpyridinium 1-Methylpyridinium|1-methylpyridinium|N-Methylpyridinium|N-methylpyridinium http://purl.obolibrary.org/obo/CHEBI_15761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157629 biolink:ChemicalEntity (1R,2S)-cicloxilic acid A 2-hydroxy-2-phenylcyclohexanecarboxylic acid that has (1R,2S)-stereoconfiguration. Graph (1R,2S)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|(1R,2S)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|2beta-hydroxy-2-phenylcyclohexane-1beta-carboxylic acid (1R,2S)-2-hydroxy-2-phenylcyclohexanecarboxylic acid (1R,2S)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|(1R,2S)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|2beta-hydroxy-2-phenylcyclohexane-1beta-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_157629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15763 biolink:ChemicalEntity nicotinic acid D-ribonucleotide A D-ribonucleotide having nicotinic acid as the nucleobase. kegg.compound:C01185|knapsack:C00007447|pdb-ccd:NCN Graph 3-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium|Nicotinate D-ribonucleotide|Nicotinate ribonucleotide|Nicotinic acid ribonucleotide|beta-Nicotinate D-ribonucleotide 3-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium 3-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium|Nicotinate D-ribonucleotide|Nicotinate ribonucleotide|Nicotinic acid ribonucleotide|beta-Nicotinate D-ribonucleotide http://purl.obolibrary.org/obo/CHEBI_15763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157630 biolink:ChemicalEntity (1S,2R)-cicloxilic acid A 2-hydroxy-2-phenylcyclohexanecarboxylic acid that has (1S,2R)-stereoconfiguration. Graph (1S,2R)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|(1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|2alpha-hydroxy-2-phenylcyclohexane-1alpha-carboxylic acid (1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid (1S,2R)-2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|(1S,2R)-2-hydroxy-2-phenylcyclohexanecarboxylic acid|2alpha-hydroxy-2-phenylcyclohexane-1alpha-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_157630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157631 biolink:ChemicalEntity 2-hydroxy-2-phenylcyclohexanecarboxylic acid A member of the class of cyclohexanols that is cyclohexane substituted by carboxy, hydroxy and phenyl groups at positions 1, 2 and 2, respectively. Graph 2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|2-hydroxy-2-phenylcyclohexanecarboxylic acid 2-hydroxy-2-phenylcyclohexanecarboxylic acid 2-hydroxy-2-phenylcyclohexane-1-carboxylic acid|2-hydroxy-2-phenylcyclohexanecarboxylic acid http://purl.obolibrary.org/obo/CHEBI_157631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157642 biolink:ChemicalEntity (aminooxy)acetate A monocarboxylic acid anion that is the conjugate base of (aminooxy)acetic acid, resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3. pubmed:24186512|pubmed:24190668 Graph (aminooxy)acetate|2-(aminooxy)acetate|2-aminooxyethanoate|aminooxyacetate (aminooxy)acetate (aminooxy)acetate|2-(aminooxy)acetate|2-aminooxyethanoate|aminooxyacetate http://purl.obolibrary.org/obo/CHEBI_157642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15765 biolink:ChemicalEntity L-dopa An optically active form of dopa having L-configuration. Used to treat the stiffness, tremors, spasms, and poor muscle control of Parkinson's disease beilstein:6060047|cas:59-92-7|drugbank:DB01235|drugcentral:1567|gmelin:365846|hmdb:HMDB0000181|kegg.compound:C00355|kegg.drug:D00059|knapsack:C00001357|lincs.smallmolecule:LSM-5481|metacyc.compound:L-DIHYDROXY-PHENYLALANINE|pdb-ccd:DAH_LFOH|pubmed:18690870|pubmed:22491024|pubmed:22592937|pubmed:23038403|pubmed:23127496|pubmed:23196068|pubmed:23206800|pubmed:23211937|pubmed:23357114|pubmed:23389842|pubmed:23389938|pubmed:23390548|pubmed:29438107|pubmed:8301021|reaxys:2215169|wikipedia.en:L-DOPA|wikipedia.en:Levodopa Graph (-)-3-(3,4-dihydroxyphenyl)-L-alanine|(-)-dopa|(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid|3,4-DIHYDROXYPHENYLALANINE|3,4-Dihydroxy-L-phenylalanine|3-Hydroxy-L-tyrosine|Dihydroxy-L-phenylalanine|Dopar|L-DOPA|L-Dopa|L-beta-(3,4-Dihydroxyphenyl)alanine|L-dopa|beta-(3,4-dihydroxyphenyl)-L-alanine|beta-(3,4-dihydroxyphenyl)alanine|levodopa|levodopum (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid|L-Dopa|L-dopa (-)-3-(3,4-dihydroxyphenyl)-L-alanine|(-)-dopa|(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid|3,4-DIHYDROXYPHENYLALANINE|3,4-Dihydroxy-L-phenylalanine|3-Hydroxy-L-tyrosine|Dihydroxy-L-phenylalanine|Dopar|L-DOPA|L-Dopa|L-beta-(3,4-Dihydroxyphenyl)alanine|L-dopa|beta-(3,4-dihydroxyphenyl)-L-alanine|beta-(3,4-dihydroxyphenyl)alanine|levodopa|levodopum http://purl.obolibrary.org/obo/CHEBI_15765 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15766 biolink:ChemicalEntity N-benzoyl-D-arginine-4-nitroanilide The 4-nitroanilide of N-benzoyl-D-arginine. kegg.compound:C04303 Graph Bz-Arg-p-nitroanilide|N(2)-benzoyl-N-(4-nitrophenyl)-D-argininamide|N-Benzoyl-D-arginine-4-nitroanilide N(2)-benzoyl-N-(4-nitrophenyl)-D-argininamide Bz-Arg-p-nitroanilide|N(2)-benzoyl-N-(4-nitrophenyl)-D-argininamide|N-Benzoyl-D-arginine-4-nitroanilide http://purl.obolibrary.org/obo/CHEBI_15766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157662 biolink:ChemicalEntity N-(omega-linoleoyloxy-ultra-long chain fatty acyl)sphingosine An N-(ω-linoleoyloxy-acyl)sphingosine where R1 is an ULCFA. pubmed:28248300 Graph N-(omega-linoleoyloxy-ultra-long chain fatty acyl)sphing-4E-enine|an N-(omega-(9Z,12Z-octadecadienoyloxy)-ultra-long chain fatty acyl)-sphing-4-enine N-(omega-linoleoyloxy-ultra-long chain fatty acyl)sphing-4E-enine|an N-(omega-(9Z,12Z-octadecadienoyloxy)-ultra-long chain fatty acyl)-sphing-4-enine http://purl.obolibrary.org/obo/CHEBI_157662 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157663 biolink:ChemicalEntity N-(omega-hydroxy-ultra-long chain fatty acyl)sphingosine An N-(ω-hydroxyacyl)sphingosine where R1 is an ULCFA. pubmed:28248300 Graph N-(omega-hydroxy-ultra-long chain fatty acyl)-sphing-4E-enine|an N-(omega-hydroxy-ultra-long chain fatty acyl)-sphing-4-enine N-(omega-hydroxy-ultra-long chain fatty acyl)-sphing-4E-enine|an N-(omega-hydroxy-ultra-long chain fatty acyl)-sphing-4-enine http://purl.obolibrary.org/obo/CHEBI_157663 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157668 biolink:ChemicalEntity carbocyclic fatty acid anion Any fatty acid anion containing a ring composed of carbon atoms. Major microspecies at pH 7.3 Graph http://purl.obolibrary.org/obo/CHEBI_157668 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15767 biolink:ChemicalEntity dichloromethane A member of the class of chloromethanes that is methane in which two of the hydrogens have been replaced by chlorine. A dense, non-flammible colourless liquid at room temperature (b.p. 40°C, d = 1.33) which is immiscible with water, it is widely used as a solvent, a paint stripper, and for the removal of caffeine from coffee and tea. cas:75-09-2|gmelin:1302|hmdb:HMDB0031548|kegg.compound:C02271|kegg.drug:D02330|metacyc.compound:CPD-681|patent:US2792435|patent:US2979541|patent:US3126419|pubmed:11884241|pubmed:19091298|pubmed:8465711|reaxys:1730800|umbbd.compound:c0233|wikipedia.en:Dichloromethane Graph DCM|Dichlormethan|Dichloromethane|Methylenchlorid|Methylene chloride|Methylene dichloride|chlorure de methylene|dichloromethane|methane dichloride|methylene bichloride Dichloromethane|dichloromethane DCM|Dichlormethan|Dichloromethane|Methylenchlorid|Methylene chloride|Methylene dichloride|chlorure de methylene|dichloromethane|methane dichloride|methylene bichloride http://purl.obolibrary.org/obo/CHEBI_15767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157670 biolink:ChemicalEntity alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranosyl-diphospho-ditrans,octacis-undecaprenol(2-) metacyc.compound:D-MANNOSYL-RHAMNOSYL-ETCETERA Graph alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-PP-Und|alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-di-trans,octa-cis-undecaprenyl diphosphate alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-PP-Und|alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_157670 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157673 biolink:ChemicalEntity alpha-D-abequose-(1->3)-alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranosyl-diphospho-ditrans,octacis-undecaprenol(2-) metacyc.compound:CPD-23725 Graph alpha-D-Abe-(1->3)-alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-di-trans,octa-cis-undecaprenyl diphosphate alpha-D-Abe-(1->3)-alpha-D-Man-(1->4)-alpha-L-Rha-(1->3)-alpha-D-Gal-di-trans,octa-cis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_157673 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157677 biolink:ChemicalEntity prednisolone succinate(1-) A dicarboxylic acid monoester(1−) that is the conjugate base of prednisolone succinate resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3. Graph 4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoate|prednisolone hemisuccinate anion|prednisolone hemisuccinate(1-)|prednisolone succinate anion 4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoate 4-[(11beta,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoate|prednisolone hemisuccinate anion|prednisolone hemisuccinate(1-)|prednisolone succinate anion http://purl.obolibrary.org/obo/CHEBI_157677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15768 biolink:ChemicalEntity 3,5-diiodo-L-tyrosine A diiodotyrosine that is L-tyrosine carrying iodo-substituents at positions C-3 and C-5 of the benzyl group. It is an intermediate in the thyroid hormone synthesis. cas:300-39-0|drugbank:DB03374|drugcentral:3146|gmelin:1128682|hmdb:HMDB0003474|kegg.compound:C01060|lincs.smallmolecule:LSM-5697|pdb-ccd:TYI|pubmed:11344555|pubmed:15206581|pubmed:15589368|reaxys:2218691 Graph (2S)-2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid|3,5-DIIODOTYROSINE|3,5-Diiodo-L-tyrosine|3,5-Diiodotyrosine|3,5-diiodo-L-tyrosine|DIT|DiIY|L-3,5-diiodotyrosine|L-Diiodotyrosine|diiodotyrosine 3,5-Diiodo-L-tyrosine|3,5-diiodo-L-tyrosine (2S)-2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid|3,5-DIIODOTYROSINE|3,5-Diiodo-L-tyrosine|3,5-Diiodotyrosine|3,5-diiodo-L-tyrosine|DIT|DiIY|L-3,5-diiodotyrosine|L-Diiodotyrosine|diiodotyrosine http://purl.obolibrary.org/obo/CHEBI_15768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157685 biolink:ChemicalEntity primary linear alkyl sulfate ester(1-) metacyc.compound:Primary-Alkyl-Sulfate-Esters|pubmed:10913158 Graph a primary linear alkyl sulfate ester a primary linear alkyl sulfate ester http://purl.obolibrary.org/obo/CHEBI_157685 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15769 biolink:ChemicalEntity N-[(R)-4-phosphopantothenoyl]-L-cysteine The N-[(R)-4-phosphopantothenoyl] derivative of L-cysteine. kegg.compound:C04352|knapsack:C00019633 Graph (R)-4'-Phosphopantothenoyl-L-cysteine|N-((R)-4'-phosphopantothenoyl)-L-cysteine|N-[(R)-4'-Phosphopantothenoyl]-L-cysteine|N-{N-[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]-beta-alanyl}-L-cysteine N-{N-[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]-beta-alanyl}-L-cysteine (R)-4'-Phosphopantothenoyl-L-cysteine|N-((R)-4'-phosphopantothenoyl)-L-cysteine|N-[(R)-4'-Phosphopantothenoyl]-L-cysteine|N-{N-[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]-beta-alanyl}-L-cysteine http://purl.obolibrary.org/obo/CHEBI_15769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157692 biolink:ChemicalEntity (2S)-2-amino-5-hydroxy-4-oxopentanoate residue metacyc.compound:Prot-1-hydroxy-2-oxopropylalanine|pubmed:22568620 Graph (2S)-2-amino-5-hydroxy-4-oxopentanoate residue (2S)-2-amino-5-hydroxy-4-oxopentanoate residue http://purl.obolibrary.org/obo/CHEBI_157692 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157693 biolink:ChemicalEntity 3-(3,4-substituted-phenyl)-1,1-dimethylurea A member of the class of phenylureas that is urea in which one of the nitrogens is substituted by two methyl groups while the other is substituted by a phenyl group which carries two unspecified groups at positions 3 and 4 of the phenyl ring. metacyc.compound:11-Dimethyl-3-Phenylureas|pubmed:24123738 Graph 3-(3,4-substituted-phenyl)-1,1-dimethylureas|N'-(3,4-substituted-phenyl)-N,N-dimethylurea|N'-(3,4-substituted-phenyl)-N,N-dimethylureas|a 1,1-dimethyl-3-phenylurea 3-(3,4-substituted-phenyl)-1,1-dimethylureas|N'-(3,4-substituted-phenyl)-N,N-dimethylurea|N'-(3,4-substituted-phenyl)-N,N-dimethylureas|a 1,1-dimethyl-3-phenylurea http://purl.obolibrary.org/obo/CHEBI_157693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157695 biolink:ChemicalEntity 3'-end deoxyribonucleotide 2,3-dehydro-2,3-deoxyribose phosphate(2-) residue metacyc.compound:a-DNA-3-alpha-beta-unsaturated-aldehyde|pubmed:22375014 Graph 3'-end deoxyribonucleotide 2,3-dehydro-2,3-deoxyribose phosphate residue 3'-end deoxyribonucleotide 2,3-dehydro-2,3-deoxyribose phosphate residue http://purl.obolibrary.org/obo/CHEBI_157695 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157698 biolink:ChemicalEntity glucohexaose Any hexasaccharide composed of 6 glucose moieties. Graph http://purl.obolibrary.org/obo/CHEBI_157698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15770 biolink:ChemicalEntity D-erythritol 4-phosphate A tetritol phosphate consisting of D-erythritol having the phosphate at the 4-position. beilstein:1725684|kegg.compound:C03494 Graph (2R,3S)-2,3,4-trihydroxybutyl dihydrogen phosphate|4-O-phosphono-D-erythritol|D-Erythritol 4-phosphate|D-erythritol 4-(dihydrogen phosphate)|L-Erythritol 1-phosphate (2R,3S)-2,3,4-trihydroxybutyl dihydrogen phosphate|D-Erythritol 4-phosphate|D-erythritol 4-(dihydrogen phosphate) (2R,3S)-2,3,4-trihydroxybutyl dihydrogen phosphate|4-O-phosphono-D-erythritol|D-Erythritol 4-phosphate|D-erythritol 4-(dihydrogen phosphate)|L-Erythritol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_15770 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157706 biolink:ChemicalEntity (2E,4S)-4,5-dihydroxypent-2-enal pubmed:22375014 Graph (2E,4S)-4,5-dihydroxypent-2-enal (2E,4S)-4,5-dihydroxypent-2-enal http://purl.obolibrary.org/obo/CHEBI_157706 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15771 biolink:ChemicalEntity loganin An iridoid monoterpenoid with formula C17H26O10 that is isolated from several plant species and exhibits neuroprotective and anti-inflammatory properties. agr:IND500719365|cas:18524-94-2|kegg.compound:C01433|knapsack:C00003088|lipidmaps:LMPR0102070001|metacyc.compound:LOGANIN|pubmed:19666019|pubmed:22931211|pubmed:25778782|pubmed:26231452|pubmed:26287995|pubmed:26407655|pubmed:26591537|pubmed:26619955|pubmed:26720701|pubmed:27106028|pubmed:27128898|pubmed:27155393|pubmed:27241020|pubmed:27416474|pubmed:27446632|pubmed:27534097|pubmed:27662601|pubmed:27710888|pubmed:27739659|reaxys:55724|wikipedia.en:Loganin Graph 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-6-hydroxy-7-methylcyclopenta[c]pyran-4-carboxylic acid methyl ester|Loganin|loganin|loganoside|methyl (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate methyl (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-6-hydroxy-7-methylcyclopenta[c]pyran-4-carboxylic acid methyl ester|Loganin|loganin|loganoside|methyl (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate http://purl.obolibrary.org/obo/CHEBI_15771 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15772 biolink:ChemicalEntity L-dopachrome The L-enantiomer of dopachrome. beilstein:5532979|kegg.compound:C01693 Graph (2S)-5,6-dioxo-2,3,5,6-tetrahydro-1H-indole-2-carboxylic acid|2-L-Carboxy-2,3-dihydroindole-5,6-quinone|L-Dopachrome (2S)-5,6-dioxo-2,3,5,6-tetrahydro-1H-indole-2-carboxylic acid (2S)-5,6-dioxo-2,3,5,6-tetrahydro-1H-indole-2-carboxylic acid|2-L-Carboxy-2,3-dihydroindole-5,6-quinone|L-Dopachrome http://purl.obolibrary.org/obo/CHEBI_15772 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157725 biolink:ChemicalEntity Flavokawain A chemspider:4511445|hmdb:HMDB0033586 Graph (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_157725 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15773 biolink:ChemicalEntity cyclohexylamine A primary aliphatic amine consisting of cyclohexane carrying an amino substituent. cas:108-91-8|hmdb:HMDB0031404|kegg.compound:C00571|metacyc.compound:CPD-303|pdb-ccd:HAI|pubmed:14726272|pubmed:7766708|reaxys:471175|umbbd.compound:c0690|wikipedia.en:Cyclohexylamine Graph Cyclohexanamine|Cyclohexylamine|cyclohexanamine Cyclohexanamine|cyclohexanamine Cyclohexanamine|Cyclohexylamine|cyclohexanamine http://purl.obolibrary.org/obo/CHEBI_15773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157739 biolink:ChemicalEntity N(6)-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-2-(methylsulfanyl)adenine 5'-monophosphate(1-) residue metacyc.compound:tRNA-ms2io6A37-trans|pubmed:23906247|pubmed:8253666|pubmed:9620964 Graph N(6)-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-2-(methylsulfanyl)adenosine 5'-phosphate residue N(6)-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-2-(methylsulfanyl)adenosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_157739 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15774 biolink:ChemicalEntity dTDP-beta-L-rhamnose The β-anomer of dTDP-L-rhamnose. cas:2147-59-3|kegg.compound:C03319|knapsack:C00007662|reaxys:8098043 Graph Thymidine 5'-(trihydrogen diphosphate), P'-(6-deoxy-beta-L-mannopyranosyl) ester|Thymidine diphosphate-L-rhamnose|dTDP-6-deoxy-L-mannose|dTDP-6-deoxy-beta-L-mannose|dTDP-L-rhamnose|thymidine 5'-[3-(6-deoxy-beta-L-mannopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-beta-L-mannopyranosyl) dihydrogen diphosphate] Thymidine 5'-(trihydrogen diphosphate), P'-(6-deoxy-beta-L-mannopyranosyl) ester|Thymidine diphosphate-L-rhamnose|dTDP-6-deoxy-L-mannose|dTDP-6-deoxy-beta-L-mannose|dTDP-L-rhamnose|thymidine 5'-[3-(6-deoxy-beta-L-mannopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157740 biolink:ChemicalEntity N-(fatty acyl)-dopamine A fatty acid conjugated to dopamine Graph an N-(fatty acyl)-dopamine|fatty acyl dopamine an N-(fatty acyl)-dopamine|fatty acyl dopamine http://purl.obolibrary.org/obo/CHEBI_157740 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15775 biolink:ChemicalEntity 3-oxoadipate(2-) A dicarboxylic acid dianion resuting from deprotonation of both carboxy groups of 3-oxoadipic acid. kegg.compound:C00846|reaxys:11212454|umbbd.compound:c0100 Graph 3-Keto-adipate|3-Oxoadipate|3-oxoadipate|3-oxohexanedioate 3-oxohexanedioate 3-Keto-adipate|3-Oxoadipate|3-oxoadipate|3-oxohexanedioate http://purl.obolibrary.org/obo/CHEBI_15775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157750 biolink:ChemicalEntity heparan sulfate polyanion A carbohydrate acid derivative anion that is a polyanionic form of heparan sulfate arising from global deprotonation of the carboxy and N-sulfo groups; major species at pH 7.3. Graph heparan sulfate group heparan sulfate group http://purl.obolibrary.org/obo/CHEBI_157750 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15776 biolink:ChemicalEntity cephalosporin C A cephalosporin antibiotic carrying a 3-acetoxymethyl substituent and a 6-oxo-N6-L-lysino group at position 7. cas:61-24-5|drugbank:DB03313|hmdb:HMDB0060450|kegg.compound:C00916|metacyc.compound:CSC|pdb-ccd:CSC|pubmed:13315229|pubmed:14370161|pubmed:18279889|pubmed:19787461|pubmed:20171092|pubmed:20391764|pubmed:2083978|pubmed:21219942|pubmed:21866341|pubmed:22068491|pubmed:23053347|pubmed:23334835|pubmed:23828600|pubmed:9131470|reaxys:65348|wikipedia.en:Cephalosporin_C Graph (6R,7R)-3-[(acetyloxy)methyl]-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|7-(5-Amino-5-carboxyvaleramido)cephalosporanic acid|Cephalosporin C (6R,7R)-3-[(acetyloxy)methyl]-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-3-[(acetyloxy)methyl]-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|7-(5-Amino-5-carboxyvaleramido)cephalosporanic acid|Cephalosporin C http://purl.obolibrary.org/obo/CHEBI_15776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157763 biolink:ChemicalEntity polyprenol phosphate anion A polyprenol phosphate in which the hydroxyl hydrogen is replaced by a phospho group, major species at pH 7.3. Graph a polyprenol phosphate a polyprenol phosphate http://purl.obolibrary.org/obo/CHEBI_157763 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15777 biolink:ChemicalEntity 4-oxocyclohexanecarboxylate kegg.compound:C03767 Graph 4-Oxocyclohexanecarboxylate|4-ketocyclohexanecarboxylate|4-oxocyclohexane-1-carboxylate|4-oxocyclohexanecarboxylate 4-oxocyclohexanecarboxylate 4-Oxocyclohexanecarboxylate|4-ketocyclohexanecarboxylate|4-oxocyclohexane-1-carboxylate|4-oxocyclohexanecarboxylate http://purl.obolibrary.org/obo/CHEBI_15777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157770 biolink:ChemicalEntity short-chain primary fatty alcohol Any primary fatty alcohol with a chain length less than 6 carbons. Graph short-chain primary fatty alcohols short-chain primary fatty alcohols http://purl.obolibrary.org/obo/CHEBI_157770 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157771 biolink:ChemicalEntity hydroperoxydocosapentaenoate A docosanoid anion arising from deprotonation of the carboxylic acid function of any hydroperoxydocosapentaenoic acid. Graph hydroperoxydocosapentaenoates hydroperoxydocosapentaenoates http://purl.obolibrary.org/obo/CHEBI_157771 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:157773 biolink:ChemicalEntity epoxydocosapentaenoate A docosanoid anion arising from deprotonation of the carboxylic acid function of any epoxydocosapentaenoic acid. Graph http://purl.obolibrary.org/obo/CHEBI_157773 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157774 biolink:ChemicalEntity epoxydocosahexaenoate A docosanoid anion arising from deprotonation of the carboxylic acid function of any epoxydocosahexaenoic acid. Graph http://purl.obolibrary.org/obo/CHEBI_157774 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:157775 biolink:ChemicalEntity N-acyl-beta-D-galactosylphytosphingosine Graph a beta-D-galactosyl-(1<->1')-N-acyl-(4R)-hydroxysphinganine|beta-D-GalCer(t18:0) a beta-D-galactosyl-(1<->1')-N-acyl-(4R)-hydroxysphinganine|beta-D-GalCer(t18:0) http://purl.obolibrary.org/obo/CHEBI_157775 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15778 biolink:ChemicalEntity N-acyl-D-amino acid Any N-acyl-amino acid in which the amino acid moiety has D configuration. Graph http://purl.obolibrary.org/obo/CHEBI_15778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15779 biolink:ChemicalEntity N-acyl-D-aspartic acid A D-aspartic acid derivative that is D-aspartic acid in which one of the hydrogens attached to the nitrogen is replaced by an acyl group. kegg.compound:C06380 Graph N-Acyl-D-aspartate|N-acyl-D-aspartic acids N-Acyl-D-aspartate|N-acyl-D-aspartic acids http://purl.obolibrary.org/obo/CHEBI_15779 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15781 biolink:ChemicalEntity N(alpha),N(alpha),N(alpha)-trimethyl-L-histidine cas:534-30-5|kegg.compound:C05575 Graph (2S)-3-(1H-imidazol-4-yl)-2-(trimethylammonio)propanoate|(S)-alpha-Carboxy-N,N,N-trimethyl-1H-imidazole-4-ethanaminium hydroxide, inner salt|Hercynine|Nalpha,Nalpha,Nalpha-Trimethyl-L-histidine|hercynine (2S)-3-(1H-imidazol-4-yl)-2-(trimethylammonio)propanoate (2S)-3-(1H-imidazol-4-yl)-2-(trimethylammonio)propanoate|(S)-alpha-Carboxy-N,N,N-trimethyl-1H-imidazole-4-ethanaminium hydroxide, inner salt|Hercynine|Nalpha,Nalpha,Nalpha-Trimethyl-L-histidine|hercynine http://purl.obolibrary.org/obo/CHEBI_15781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15782 biolink:ChemicalEntity viomycin A cyclic peptide antibiotic produced by the actinomycete Streptomyces puniceus, used in the treatment of tuberculosis. beilstein:11141953|cas:32988-50-4|drugcentral:2830|kegg.compound:C01540 Graph (3S)-3,6-diamino-N-[(3S,6Z,9S,12S,15S)-6-[(carbamoylamino)methylene]-3-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-15-yl]hexanamide|Viomycin|viomicina|viomycin|viomycine|viomycinum (3S)-3,6-diamino-N-[(3S,6Z,9S,12S,15S)-6-[(carbamoylamino)methylene]-3-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-15-yl]hexanamide (3S)-3,6-diamino-N-[(3S,6Z,9S,12S,15S)-6-[(carbamoylamino)methylene]-3-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-15-yl]hexanamide|Viomycin|viomicina|viomycin|viomycine|viomycinum http://purl.obolibrary.org/obo/CHEBI_15782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15783 biolink:ChemicalEntity N,N-dimethyl-1,4-phenylenediamine cas:99-98-9|kegg.compound:C04203 Graph N,N-Dimethyl-1,4-phenylenediamine|N,N-Dimethyl-p-phenylenediamine|N,N-dimethyl-1,4-phenylenediamine|N,N-dimethyl-p-phenylenediamine|N,N-dimethylbenzene-1,4-diamine|p-Amino-N,N-dimethylaniline|p-amino-N,N-dimethylaniline N,N-dimethylbenzene-1,4-diamine N,N-Dimethyl-1,4-phenylenediamine|N,N-Dimethyl-p-phenylenediamine|N,N-dimethyl-1,4-phenylenediamine|N,N-dimethyl-p-phenylenediamine|N,N-dimethylbenzene-1,4-diamine|p-Amino-N,N-dimethylaniline|p-amino-N,N-dimethylaniline http://purl.obolibrary.org/obo/CHEBI_15783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15784 biolink:ChemicalEntity N-acetyl-D-glucosamine 6-phosphate An N-acyl-D-glucosamine 6-phosphate that is the N-acetyl derivative of D-glucosamine 6-phosphate. It is a component of the aminosugar metabolism. drugbank:DB03951|hmdb:HMDB0001062|kegg.compound:C00357|knapsack:C00019661|pubmed:17077487|pubmed:8125098|pubmed:8747459|reaxys:2337906 Graph 2-acetamido-2-deoxy-6-O-phosphono-D-glucopyranose|2-acetamido-2-deoxy-D-glucopyranose 6-(dihydrogen phosphate)|N-Acetyl-D-glucosamine 6-phosphate|N-acetyl-D-glucosamine 6-phosphate 2-acetamido-2-deoxy-D-glucopyranose 6-(dihydrogen phosphate) 2-acetamido-2-deoxy-6-O-phosphono-D-glucopyranose|2-acetamido-2-deoxy-D-glucopyranose 6-(dihydrogen phosphate)|N-Acetyl-D-glucosamine 6-phosphate|N-acetyl-D-glucosamine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_15784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15785 biolink:ChemicalEntity 1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine kegg.compound:C04635 Graph 1-(1-Alkenyl)-sn-glycero-3-phosphoethanolamine|1-Alkenylglycerophosphoethanolamine 1-(1-Alkenyl)-sn-glycero-3-phosphoethanolamine|1-Alkenylglycerophosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_15785 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15786 biolink:ChemicalEntity 3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine The 3-hydroxy derivative of N6,N6,N6-trimethyl-L-lysine kegg.compound:C01259 Graph 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine|3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium 3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine|3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium http://purl.obolibrary.org/obo/CHEBI_15786 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15787 biolink:ChemicalEntity deoxylimonoic acid D-ring-lactone kegg.compound:C04251 Graph 2,2'-[(2S,3R,4R)-3-[(1R,6S,8aR)-1-(3-furyl)-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-6-yl]-3-(hydroxymethyl)-5,5-dimethyltetrahydrofuran-2,4-diyl]diacetic acid|Deoxylimononic acid D-ring-lactone 2,2'-[(2S,3R,4R)-3-[(1R,6S,8aR)-1-(3-furyl)-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-6-yl]-3-(hydroxymethyl)-5,5-dimethyltetrahydrofuran-2,4-diyl]diacetic acid 2,2'-[(2S,3R,4R)-3-[(1R,6S,8aR)-1-(3-furyl)-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-6-yl]-3-(hydroxymethyl)-5,5-dimethyltetrahydrofuran-2,4-diyl]diacetic acid|Deoxylimononic acid D-ring-lactone http://purl.obolibrary.org/obo/CHEBI_15787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15788 biolink:ChemicalEntity 3,5-dichlorocatechol A dichlorocatechol carrying chloro groups at positions 3 and 5. cas:13673-92-2|gmelin:936961|kegg.compound:C02933|metacyc.compound:35-DICHLOROCATECHOL|pdb-ccd:35C|pubmed:16637006|pubmed:23409454|reaxys:2209259|umbbd.compound:c0290 Graph 1,2-dihydroxy-4,6-dichlorobenzene|3,5-Dichlorocatechol|3,5-dichlorobenzene-1,2-diol|3,5-dichlorocatechol 3,5-dichlorobenzene-1,2-diol 1,2-dihydroxy-4,6-dichlorobenzene|3,5-Dichlorocatechol|3,5-dichlorobenzene-1,2-diol|3,5-dichlorocatechol http://purl.obolibrary.org/obo/CHEBI_15788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15789 biolink:ChemicalEntity 2'-O-methyllicodione A β-diketone that is licodione in which the hydroxy group at position 2 of the 2,4-dihyroxyphenyl moiety has been converted into the its methyl ether. kegg.compound:C02922|knapsack:C00006995|lipidmaps:LMPK12120397|metacyc.compound:CPD-4302|reaxys:3619661 Graph 1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione|2'-O-Methyllicodione 1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione 1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione|2'-O-Methyllicodione http://purl.obolibrary.org/obo/CHEBI_15789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15791 biolink:ChemicalEntity (S)-2-halocarboxylic acid Any carboxylic acid carrying an unspecified halogen substituent at the 2S-position. kegg.compound:C02103|metacyc.compound:S-2-Haloacids Graph (S)-2-haloacid|(S)-2-haloacids|(S)-2-halocarboxylic acids (S)-2-haloacid|(S)-2-haloacids|(S)-2-halocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_15791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15792 biolink:ChemicalEntity malonate(2-) A dicarboxylic acid dianion obtained by the deprotonation of the carboxy groups of malonic acid. cas:156-80-9|drugbank:DB02201|gmelin:141932|kegg.compound:C00383|pdb-ccd:MLI|reaxys:3904386 Graph (-)OOC-CH2-COO(-)|MALONATE ION|malo|malonate|malonic acid, ion(2-)|propanedioate|propanedioic acid, ion(2-) propanedioate (-)OOC-CH2-COO(-)|MALONATE ION|malo|malonate|malonic acid, ion(2-)|propanedioate|propanedioic acid, ion(2-) http://purl.obolibrary.org/obo/CHEBI_15792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15793 biolink:ChemicalEntity 3-hydroxyanthranilic acid An aminobenzoic acid that is benzoic acid substituted at C-2 by an amine group and at C-3 by a hydroxy group. It is an intermediate in the metabolism of the amino acid tryptophan. cas:548-93-6|drugbank:DB03644|hmdb:HMDB0001476|kegg.compound:C00632|knapsack:C00007568|lincs.smallmolecule:LSM-20979|metacyc.compound:3-HYDROXY-ANTHRANILATE|pdb-ccd:3HA|pubmed:11392499|pubmed:13321971|pubmed:22711758|pubmed:22770225|pubmed:24200862|pubmed:9126284|reaxys:973356|wikipedia.en:3-hydroxyanthranilic_acid Graph 2-Amino-3-hydroxy-benzoic acid|2-Amino-3-hydroxybenzoic acid|2-amino-3-hydroxybenzoic acid|3-Hydroxyanthranilic acid|3-Ohaa|3-Oxyanthranilic acid 2-amino-3-hydroxybenzoic acid 2-Amino-3-hydroxy-benzoic acid|2-Amino-3-hydroxybenzoic acid|2-amino-3-hydroxybenzoic acid|3-Hydroxyanthranilic acid|3-Ohaa|3-Oxyanthranilic acid http://purl.obolibrary.org/obo/CHEBI_15793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15794 biolink:ChemicalEntity juglone A hydroxy-1,4-naphthoquinone that is 1,4-naphthoquinone in which the hydrogen at position 5 has been replaced by a hydroxy group. A plant-derived 1,4-naphthoquinone with confirmed antibacterial and antitumor activities. cas:481-39-0|gmelin:219094|kegg.compound:C03840|knapsack:C00000144|pdb-ccd:JUG|pubmed:19597959|pubmed:23163769|pubmed:27322260|pubmed:27600097|pubmed:27816681|pubmed:28069455|pubmed:28166217|reaxys:1909764 Graph 5-Hydroxy-1,4-naphthoquinone|5-hydroxy-1,4-naphthalenedione|5-hydroxy-1,4-naphthoquinone|8-hydroxy-1,4-naphthoquinone|Juglone|juglone 5-Hydroxy-1,4-naphthoquinone|5-hydroxy-1,4-naphthoquinone 5-Hydroxy-1,4-naphthoquinone|5-hydroxy-1,4-naphthalenedione|5-hydroxy-1,4-naphthoquinone|8-hydroxy-1,4-naphthoquinone|Juglone|juglone http://purl.obolibrary.org/obo/CHEBI_15794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15795 biolink:ChemicalEntity protoaphin aglucone The aglycone of protaphin, a yellow hydroxylated quinoid pigment found in aphids. kegg.compound:C02879 Graph (1R,1'R,3R,3'R,4S,4'S)-4,4',7,7',9,9',10-heptahydroxy-1,1',3,3'-tetramethyl-3,3',4,4'-tetrahydro-1H,1'H-5,6'-binaphtho[2,3-c]pyran-5',10'-dione|Protoaphin aglucone|protaphin aglucone|protaphin aglycone|protoaphin aglycone (1R,1'R,3R,3'R,4S,4'S)-4,4',7,7',9,9',10-heptahydroxy-1,1',3,3'-tetramethyl-3,3',4,4'-tetrahydro-1H,1'H-5,6'-binaphtho[2,3-c]pyran-5',10'-dione (1R,1'R,3R,3'R,4S,4'S)-4,4',7,7',9,9',10-heptahydroxy-1,1',3,3'-tetramethyl-3,3',4,4'-tetrahydro-1H,1'H-5,6'-binaphtho[2,3-c]pyran-5',10'-dione|Protoaphin aglucone|protaphin aglucone|protaphin aglycone|protoaphin aglycone http://purl.obolibrary.org/obo/CHEBI_15795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15799 biolink:ChemicalEntity 1-palmitoyl-sn-glycerol 3-phosphate A 1-acyl-sn-glycerol 3-phosphate having palmitoyl as the acyl group. hmdb:HMDB0007853|kegg.compound:C04036|lipidmaps:LMGP10050006 Graph (2R)-2-hydroxy-3-(phosphonooxy)propyl hexadecanoate|(2R)-2-hydroxy-3-(phosphonooxy)propyl palmitate|1-Hexadecanoyl-sn-glycero-3-phosphate|1-Palmitoylglycerol 3-phosphate|LPA(16:0/0:0)|LysoPA(16:0/0:0)|Lysophosphatidic acid(16:0)|Lysophosphatidic acid(16:0/0:0) (2R)-2-hydroxy-3-(phosphonooxy)propyl hexadecanoate (2R)-2-hydroxy-3-(phosphonooxy)propyl hexadecanoate|(2R)-2-hydroxy-3-(phosphonooxy)propyl palmitate|1-Hexadecanoyl-sn-glycero-3-phosphate|1-Palmitoylglycerol 3-phosphate|LPA(16:0/0:0)|LysoPA(16:0/0:0)|Lysophosphatidic acid(16:0)|Lysophosphatidic acid(16:0/0:0) http://purl.obolibrary.org/obo/CHEBI_15799 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15801 biolink:ChemicalEntity (R)-2-hydroxyglutarate(2-) A 2-hydroxyglutarate(2−) that has (2R)-configuration. kegg.compound:C01087|metacyc.compound:R-2-HYDROXYGLUTARATE Graph (2R)-2-hydroxypentanedioate|(R)-2-hydroxyglutarate (2R)-2-hydroxypentanedioate (2R)-2-hydroxypentanedioate|(R)-2-hydroxyglutarate http://purl.obolibrary.org/obo/CHEBI_15801 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15802 biolink:ChemicalEntity alpha,beta-didehydrotryptophan A dehydroamino acid that is the 2,3-didehydro derivative of tryptophan. cas:57361-88-3|kegg.compound:C06732|pdb-ccd:TRY|reaxys:6327993 Graph (2Z)-2-amino-3-(1H-indol-3-yl)acrylic acid|(2Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid|(Z)-2-amino-3-(1H-indol-3-yl)acrylic acid|(Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid|alpha,beta-Didehydrotryptophan (2Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid (2Z)-2-amino-3-(1H-indol-3-yl)acrylic acid|(2Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid|(Z)-2-amino-3-(1H-indol-3-yl)acrylic acid|(Z)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid|alpha,beta-Didehydrotryptophan http://purl.obolibrary.org/obo/CHEBI_15802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15805 biolink:ChemicalEntity D-octopine The (1R)-1-carboxyethyl derivative of L-arginine. It is a metabolite released by plant tumours. cas:34522-32-2|kegg.compound:C04137|knapsack:C00001549|metacyc.compound:CPD-309|pubmed:16662161|pubmed:22496288|pubmed:8188582|reaxys:1729145|wikipedia.en:Octopine Graph Arginine, N2-(1-carboxyethyl)-, L-|D-(+)-Octopine|D-Octopine|D-octopine|L-Arginine, N2-(1-carboxyethyl)-, (R)-|L-Arginine, N2-[(1R)-1-carboxyethyl]-|N(2)-(D-1-carboxyethyl)-L-arginine|N(2)-[(1R)-1-carboxyethyl]-L-arginine|N2-(1-Carboxyethyl)-L-arginine|N2-(D-1-Carboxyethyl)-L-arginine|Octopine N(2)-[(1R)-1-carboxyethyl]-L-arginine Arginine, N2-(1-carboxyethyl)-, L-|D-(+)-Octopine|D-Octopine|D-octopine|L-Arginine, N2-(1-carboxyethyl)-, (R)-|L-Arginine, N2-[(1R)-1-carboxyethyl]-|N(2)-(D-1-carboxyethyl)-L-arginine|N(2)-[(1R)-1-carboxyethyl]-L-arginine|N2-(1-Carboxyethyl)-L-arginine|N2-(D-1-Carboxyethyl)-L-arginine|Octopine http://purl.obolibrary.org/obo/CHEBI_15805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15807 biolink:ChemicalEntity beta-L-arabinose 1-phosphate The β-anomer of L-arabinose 1-phosphate. kegg.compound:C03906 Graph 1-O-phosphono-beta-L-arabinopyranose|beta-L-Arabinose 1-phosphate|beta-L-arabinopyranose 1-(dihydrogen phosphate) beta-L-arabinopyranose 1-(dihydrogen phosphate) 1-O-phosphono-beta-L-arabinopyranose|beta-L-Arabinose 1-phosphate|beta-L-arabinopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15808 biolink:ChemicalEntity 12-dehydrotetracycline The 12-dehydro derivative of tetracycline. kegg.compound:C03206 Graph (4S,4aS,6S,12aS)-4-dimethylamino-3,6,10,12a-tetrahydroxy-6-methyl-1,11,12-trioxo-1,4,4a,5,6,11,12,12a-octahydrotetracene-2-carboxamide|12-Dehydrotetracycline (4S,4aS,6S,12aS)-4-dimethylamino-3,6,10,12a-tetrahydroxy-6-methyl-1,11,12-trioxo-1,4,4a,5,6,11,12,12a-octahydrotetracene-2-carboxamide (4S,4aS,6S,12aS)-4-dimethylamino-3,6,10,12a-tetrahydroxy-6-methyl-1,11,12-trioxo-1,4,4a,5,6,11,12,12a-octahydrotetracene-2-carboxamide|12-Dehydrotetracycline http://purl.obolibrary.org/obo/CHEBI_15808 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15809 biolink:ChemicalEntity dolichyl D-mannosyl phosphate A polyprenyl glycosyl phosphate having dolichyl as the polyprenyl component and D-mannose as the glycosyl component. kegg.compound:C03862|kegg.glycan:G10617|pubmed:1176461 Graph Dolichyl D-mannosyl phosphate|Dolichyl phosphate D-mannose|alpha-{4-[hydroxy(D-mannopyranosyloxy)phosphoryloxy]-2-methylbutyl}-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] alpha-{4-[hydroxy(D-mannopyranosyloxy)phosphoryloxy]-2-methylbutyl}-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] Dolichyl D-mannosyl phosphate|Dolichyl phosphate D-mannose|alpha-{4-[hydroxy(D-mannopyranosyloxy)phosphoryloxy]-2-methylbutyl}-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] http://purl.obolibrary.org/obo/CHEBI_15809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15811 biolink:ChemicalEntity O-phospho-L-serine The L-enantiomer of O-phosphoserine. cas:407-41-0|drugcentral:4120|gmelin:675662|hmdb:HMDB0000272|kegg.compound:C01005|knapsack:C00007287|metacyc.compound:3-P-SERINE|patent:EP2444481|pdb-ccd:SEP|pubmed:1368590|pubmed:1550070|pubmed:16665799|pubmed:17765195|pubmed:20696157|pubmed:2190623|pubmed:22581076|pubmed:3924662|pubmed:5583990|pubmed:6526818|pubmed:8017107|reaxys:1726826|wikipedia.en:3-phosphoserine Graph (+)-L-serine dihydrogen phosphate (ester)|(2S)-2-amino-3-(phosphonooxy)propanoic acid|(S)-2-amino-3-hydroxypropanoic acid 3-phosphate|3-Phosphoserine|Dexfosfoserine|L-O-Phosphoserine|O-Phospho-L-serine|O-phosphono-L-serine|O-phosphoserine|dexfosfoserine|phosphoserine O-phosphono-L-serine (+)-L-serine dihydrogen phosphate (ester)|(2S)-2-amino-3-(phosphonooxy)propanoic acid|(S)-2-amino-3-hydroxypropanoic acid 3-phosphate|3-Phosphoserine|Dexfosfoserine|L-O-Phosphoserine|O-Phospho-L-serine|O-phosphono-L-serine|O-phosphoserine|dexfosfoserine|phosphoserine http://purl.obolibrary.org/obo/CHEBI_15811 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15812 biolink:ChemicalEntity dolichyl beta-D-glucosyl phosphate A polyprenyl glycosyl phosphate having dolichyl as the polyprenyl component and β-D-glucose as the glycosyl component. kegg.compound:C01246|kegg.glycan:G10618 Graph Dolichyl beta-D-glucosyl phosphate|alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(beta-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(beta-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] Dolichyl beta-D-glucosyl phosphate|alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(beta-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] http://purl.obolibrary.org/obo/CHEBI_15812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15815 biolink:ChemicalEntity quinolin-4-ol A monohydroxyquinoline carrying a hydroxy group at position 4. cas:611-36-9|kegg.compound:C06343|metacyc.compound:QUINOLIN-4-OL|pdb-ccd:ES1|pubmed:19862413|pubmed:20642456|pubmed:20990977|pubmed:30809547|reaxys:1524969 Graph 4-Chinolinol|4-hydroxyquinoline|4-quinolinol|Quinolin-4-ol|kynurine|quinolin-4-ol Quinolin-4-ol|quinolin-4-ol 4-Chinolinol|4-hydroxyquinoline|4-quinolinol|Quinolin-4-ol|kynurine|quinolin-4-ol http://purl.obolibrary.org/obo/CHEBI_15815 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15816 biolink:ChemicalEntity D-arginine A D-α-amino acid that is the D-isomer of arginine. cas:157-06-2|drugbank:DB04027|gmelin:364938|hmdb:HMDB0003416|kegg.compound:C00792|metacyc.compound:CPD-220|pdb-ccd:DAR|pubmed:15540275|pubmed:15723827|pubmed:16912865|pubmed:19651461|pubmed:22518022|reaxys:1725412 Graph (2R)-2-amino-5-(carbamimidamido)pentanoic acid|(2R)-2-amino-5-guanidinopentanoic acid|(R)-2-amino-5-guanidinopentanoic acid|D-2-Amino-5-guanidinovaleric acid|D-Arginin|D-Arginine|D-arginine|DAR D-Arginine|D-arginine (2R)-2-amino-5-(carbamimidamido)pentanoic acid|(2R)-2-amino-5-guanidinopentanoic acid|(R)-2-amino-5-guanidinopentanoic acid|D-2-Amino-5-guanidinovaleric acid|D-Arginin|D-Arginine|D-arginine|DAR http://purl.obolibrary.org/obo/CHEBI_15816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15817 biolink:ChemicalEntity semiquinone An organic radical resulting from the formal addition of one hydrogen atom with its electron to a quinone (or from the formal removal of one hydrogen atom with its electron from the corresponding hydroquinone). kegg.compound:C05309|wikipedia.en:Semiquinone Graph Benzosemiquinone|Semidione|Semiquinone|Semiquinone radical|semiquinones Benzosemiquinone|Semidione|Semiquinone|Semiquinone radical|semiquinones http://purl.obolibrary.org/obo/CHEBI_15817 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15819 biolink:ChemicalEntity N(6)-(dimethylallyl)adenosine 5'-monophosphate The N6-dimethylallyl derivative of adenosine 5'-monophosphate. cas:20268-93-3|kegg.compound:C04713|knapsack:C00007239|metacyc.compound:CPD-4205|pubmed:6712260|reaxys:1054610 Graph Isopentenyl-AMP|N(6)-(3-methylbut-2-en-1-yl)adenosine 5'-(dihydrogen phosphate)|N(6)-(Delta(2)-isopentenyl)adenosine 5'-monophosphate|N(6)-(dimethylallyl)adenosine 5'-(dihydrogen phosphate)|N(6)-(dimethylallyl)adenosine 5'-phosphate|N(6)-dimethylallyl-5'-adenylic acid|N(6)-dimethylallyl-AMP|N(6)-isopentenyladenosine-5'-monophosphate|N-(3-Methyl-2-butenyl)-5'-adenylic acid|N6-(Dimethylallyl)adenosine 5'-phosphate|N6-(delta(2)-isopentenyl)adenosine 5'-monophosphate|N6-(delta2-Isopentenyl)-adenosine 5'-monophosphate|isopentenyl-AMP|isopentenyladenosine riboside-5'-monophosphate|isopentenyladenosine-5'-monophosphate N(6)-(3-methylbut-2-en-1-yl)adenosine 5'-(dihydrogen phosphate) Isopentenyl-AMP|N(6)-(3-methylbut-2-en-1-yl)adenosine 5'-(dihydrogen phosphate)|N(6)-(Delta(2)-isopentenyl)adenosine 5'-monophosphate|N(6)-(dimethylallyl)adenosine 5'-(dihydrogen phosphate)|N(6)-(dimethylallyl)adenosine 5'-phosphate|N(6)-dimethylallyl-5'-adenylic acid|N(6)-dimethylallyl-AMP|N(6)-isopentenyladenosine-5'-monophosphate|N-(3-Methyl-2-butenyl)-5'-adenylic acid|N6-(Dimethylallyl)adenosine 5'-phosphate|N6-(delta(2)-isopentenyl)adenosine 5'-monophosphate|N6-(delta2-Isopentenyl)-adenosine 5'-monophosphate|isopentenyl-AMP|isopentenyladenosine riboside-5'-monophosphate|isopentenyladenosine-5'-monophosphate http://purl.obolibrary.org/obo/CHEBI_15819 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1582 biolink:ChemicalEntity 3-methoxytyramine A monomethoxybenzene that is dopamine in which the hydroxy group at position 3 is replaced by a methoxy group. It is a metabolite of the neurotransmitter dopamine and considered a potential biomarker of pheochromocytomas and paragangliomas. cas:554-52-9|chemspider:1606|foodb.food:FDB021876|hmdb:HMDB0000022|kegg.compound:C05587|knapsack:C00042132|pmc:PMC2965771|pubmed:12105105|pubmed:12138004|pubmed:12649306|pubmed:15120096|pubmed:15542730|pubmed:15556832|pubmed:17954499|pubmed:19309105|pubmed:19897674|pubmed:20976142|pubmed:22008135|pubmed:22563039|pubmed:262188|pubmed:26425473|pubmed:26680494|pubmed:27208558|pubmed:27235704|pubmed:2927387|pubmed:29274926|pubmed:30813742|pubmed:30904545|pubmed:31724812|pubmed:31872013|pubmed:32101397|pubmed:32829134|pubmed:33096053|pubmed:33279210|pubmed:33927450|pubmed:33993248|pubmed:34110302|pubmed:3434205|pubmed:34454132|pubmed:34486152|pubmed:34570657|pubmed:34820673|pubmed:35085004|pubmed:35234981|pubmed:35343638|pubmed:35598694|pubmed:4073504|pubmed:4281061|pubmed:6749220|pubmed:7004664|pubmed:7251775|pubmed:872373|pubmed:9834968|wikipedia.en:3-Methoxytyramine Graph 2-(4-hydroxy-3-methoxyphenyl)ethylamine|2-methoxy-4-(2-aminoethyl)phenol|3-MT|3-O-methyldopamine|3-methoxy-4-hydroxyphenethylamine|3-methoxy-p-tyramine|3-methoxydopamine|3MT|4-(2-amino-ethyl)-2-methoxy-phenol|4-(2-aminoethyl)-2-methoxy-phenol|4-(2-aminoethyl)-2-methoxyphenol|4-(2-azanylethyl)-2-methoxy-phenol|4-hydroxy-3-methoxy-2-phenethylamine|4-hydroxy-3-methoxy-beta-phenethylamine|4-hydroxy-3-methoxyphenethylamine|4-hydroxy-3-methoxyphenylethylamine|5-(2-aminoethyl)guaiacol|beta-(4-hydroxy-3-methoxyphenyl)ethylamine|homovanillinamine|homovanillylamine 4-(2-aminoethyl)-2-methoxyphenol 2-(4-hydroxy-3-methoxyphenyl)ethylamine|2-methoxy-4-(2-aminoethyl)phenol|3-MT|3-O-methyldopamine|3-methoxy-4-hydroxyphenethylamine|3-methoxy-p-tyramine|3-methoxydopamine|3MT|4-(2-amino-ethyl)-2-methoxy-phenol|4-(2-aminoethyl)-2-methoxy-phenol|4-(2-aminoethyl)-2-methoxyphenol|4-(2-azanylethyl)-2-methoxy-phenol|4-hydroxy-3-methoxy-2-phenethylamine|4-hydroxy-3-methoxy-beta-phenethylamine|4-hydroxy-3-methoxyphenethylamine|4-hydroxy-3-methoxyphenylethylamine|5-(2-aminoethyl)guaiacol|beta-(4-hydroxy-3-methoxyphenyl)ethylamine|homovanillinamine|homovanillylamine http://purl.obolibrary.org/obo/CHEBI_1582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15820 biolink:ChemicalEntity GDP-alpha-D-mannose The α-anomer of GDP-D-mannose. cas:3123-67-9|hmdb:HMDB0001163|kegg.compound:C00096|kegg.glycan:G10614|knapsack:C00007246|metacyc.compound:GDP-MANNOSE|pdb-ccd:GDD|pubmed:12651883|pubmed:13143040|pubmed:22539165|pubmed:5131017|reaxys:79013 Graph GDP-D-mannose|GDPmannose|Guanosine 5'-(trihydrogen diphosphate), mono-alpha-D-mannopyranosyl ester|Guanosine diphosphate mannose|Guanosine diphosphomannose|Guanosine pyrophosphate mannose|guanosine 5'-[3-(alpha-D-mannopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(alpha-D-mannopyranosyl) dihydrogen diphosphate] GDP-D-mannose|GDPmannose|Guanosine 5'-(trihydrogen diphosphate), mono-alpha-D-mannopyranosyl ester|Guanosine diphosphate mannose|Guanosine diphosphomannose|Guanosine pyrophosphate mannose|guanosine 5'-[3-(alpha-D-mannopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15821 biolink:ChemicalEntity 5-hydroxy-6-methylpyridine-3-carboxylic acid The 5-hydroxy-6-methyl derivative of nicotinic acid. kegg.compound:C01270|pdb-ccd:3HM Graph 3-Hydroxy-2-methylpyridine-5-carboxylate|5-hydroxy-6-methylnicotinic acid|5-hydroxy-6-methylpyridine-3-carboxylic acid 5-hydroxy-6-methylpyridine-3-carboxylic acid 3-Hydroxy-2-methylpyridine-5-carboxylate|5-hydroxy-6-methylnicotinic acid|5-hydroxy-6-methylpyridine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_15821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15822 biolink:ChemicalEntity 17alpha-estradiol 3-glucosiduronic acid A steroid glucosiduronic acid that is 17α-estradiol having a single β-D-glucuronic acid residue attached at position 3. kegg.compound:C04300 Graph 17alpha-estradiol 3-glucuronide|17alpha-hydroxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid|Estradiol-17alpha 3-D-glucuronoside 17alpha-hydroxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid 17alpha-estradiol 3-glucuronide|17alpha-hydroxyestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid|Estradiol-17alpha 3-D-glucuronoside http://purl.obolibrary.org/obo/CHEBI_15822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15824 biolink:ChemicalEntity D-fructose Fructose is a levorotatory monosaccharide and an isomer of glucose. Although fructose is a hexose (6 carbon sugar), it generally exists as a 5-member hemiketal ring (a furanose). cas:57-48-7|hmdb:HMDB0000660|kegg.compound:C00095|metacyc.compound:FRU|pdb-ccd:FRU|pubmed:22735334 Graph D-Fru|D-arabino-Hexulose|D-arabino-hex-2-ulose|D-fructose|D-laevulose|Fruit sugar|Laevulose|Levulose D-arabino-hex-2-ulose|D-fructose D-Fru|D-arabino-Hexulose|D-arabino-hex-2-ulose|D-fructose|D-laevulose|Fruit sugar|Laevulose|Levulose http://purl.obolibrary.org/obo/CHEBI_15824 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15825 biolink:ChemicalEntity 3-methylbut-2-enal An enal consisting of but-2-ene with a methyl substituent at position 3 and an oxo group at position 1. cas:107-86-8|hmdb:HMDB0012157|kegg.compound:C07330|metacyc.compound:PRENAL|pubmed:1120289|pubmed:24254865|pubmed:8319634|reaxys:1734740 Graph 3,3-Dimethyl-acrylaldehyde|3,3-Dimethylacrolein|3-Methyl-2-butenal|3-Methylbut-2-enal|3-Methylcrotonaldehyde|3-methyl-2-butenal|3-methylbut-2-enal|Prenal|Senecialdehyde|Senecioaldehyde|beta,beta-Dimethylacrolein|beta-Methylcrotonaldehyde 3-Methylbut-2-enal|3-methylbut-2-enal 3,3-Dimethyl-acrylaldehyde|3,3-Dimethylacrolein|3-Methyl-2-butenal|3-Methylbut-2-enal|3-Methylcrotonaldehyde|3-methyl-2-butenal|3-methylbut-2-enal|Prenal|Senecialdehyde|Senecioaldehyde|beta,beta-Dimethylacrolein|beta-Methylcrotonaldehyde http://purl.obolibrary.org/obo/CHEBI_15825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15826 biolink:ChemicalEntity 16alpha-hydroxyprogesterone beilstein:3105361|cas:438-07-3|kegg.compound:C03748 Graph 16-alpha-Hydroxyprogesterone|16-alpha-hydroxyprogesterone|16alpha-Hydroxyprogesterone|16alpha-hydroxypregn-4-ene-3,20-dione 16alpha-hydroxypregn-4-ene-3,20-dione 16-alpha-Hydroxyprogesterone|16-alpha-hydroxyprogesterone|16alpha-Hydroxyprogesterone|16alpha-hydroxypregn-4-ene-3,20-dione http://purl.obolibrary.org/obo/CHEBI_15826 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15829 biolink:ChemicalEntity L-serine O-sulfate A non-proteinogenic L-α-amino acid that is the O-sulfo derivative of L-serine. cas:626-69-7|kegg.compound:C02703|metacyc.compound:CPD-673|pdb-ccd:OSE|pubmed:4311034|pubmed:6812624 Graph L-Serine O-sulfate|L-serine O-(hydrogen sulfate)|O-sulfonato-L-serine|Serine O-sulfate L-serine O-(hydrogen sulfate) L-Serine O-sulfate|L-serine O-(hydrogen sulfate)|O-sulfonato-L-serine|Serine O-sulfate http://purl.obolibrary.org/obo/CHEBI_15829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15830 biolink:ChemicalEntity 8-amino-7-oxononanoic acid The 8-amino-7-oxo derivative of nonanoic acid. kegg.compound:C01092|knapsack:C00000758|lipidmaps:LMFA01060168 Graph 8-Amino-7-oxononanoic acid 8-Amino-7-oxononanoic acid http://purl.obolibrary.org/obo/CHEBI_15830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15831 biolink:ChemicalEntity geranylgeranyl diphosphate A polyprenol diphosphate having geranylgeranyl as the polyprenyl component. drugbank:DB07841|lincs.smallmolecule:LSM-36848 Graph 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_15831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15832 biolink:ChemicalEntity urea-1-carboxylate An organic anion resulting from the deprotonation of the carboxy group of urea-1-carboxylic acid. kegg.compound:C01010|umbbd.compound:c0777 Graph (aminocarbonyl)carbamate|urea-1-carboxylate (aminocarbonyl)carbamate (aminocarbonyl)carbamate|urea-1-carboxylate http://purl.obolibrary.org/obo/CHEBI_15832 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15833 biolink:ChemicalEntity sulcatol agr:IND23339368|cas:1569-60-4|cas:4630-06-2|kegg.compound:C07288 Graph 6-Methyl-5-hepten-2-ol|6-Methylhept-5-en-2-ol|6-methyl-5-hepten-2-ol|6-methylhept-5-en-2-ol|Sulcatol|sulcatol 6-Methylhept-5-en-2-ol|6-methylhept-5-en-2-ol 6-Methyl-5-hepten-2-ol|6-Methylhept-5-en-2-ol|6-methyl-5-hepten-2-ol|6-methylhept-5-en-2-ol|Sulcatol|sulcatol http://purl.obolibrary.org/obo/CHEBI_15833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15834 biolink:ChemicalEntity 1-O-galloyl-beta-D-glucose A galloyl-β-D-glucose compound having a galloyl group at the 1-position. cas:554-37-0|kegg.compound:C01158|knapsack:C00002652|wikipedia.en:Glucogallin Graph 1-Galloyl-beta-D-glucose|1-Galloyl-beta-glucose|1-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1-O-Galloyl-beta-D-glucose|1-O-galloyl-beta-D-glucose|beta-Glucogallin 1-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose 1-Galloyl-beta-D-glucose|1-Galloyl-beta-glucose|1-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1-O-Galloyl-beta-D-glucose|1-O-galloyl-beta-D-glucose|beta-Glucogallin http://purl.obolibrary.org/obo/CHEBI_15834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15835 biolink:ChemicalEntity 1-acylglycerone 3-phosphate A glycerone 3-phosphate having an unspecified O-acyl substituent at the 1-position. kegg.compound:C03372 Graph 1-Acyl-glycerone 3-phosphate|1-acylglycerone 3-phosphates|Acylglycerone phosphate|Dihydroxyacetone phosphate acyl ester 1-Acyl-glycerone 3-phosphate|1-acylglycerone 3-phosphates|Acylglycerone phosphate|Dihydroxyacetone phosphate acyl ester http://purl.obolibrary.org/obo/CHEBI_15835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15836 biolink:ChemicalEntity 4-phospho-L-aspartic acid The 4-phospho derivative of L-aspartic acid. cas:22138-53-0|kegg.compound:C03082|knapsack:C00007471|pdb-ccd:PHD Graph (2S)-2-amino-4-oxo-4-(phosphonooxy)butanoic acid|4-oxo-O-phosphono-L-homoserine|4-phospho-L-aspartic acid|L-4-Aspartyl phosphate|L-aspart-4-yl phosphate|L-beta-aspartyl dihydrogen phosphate (2S)-2-amino-4-oxo-4-(phosphonooxy)butanoic acid|4-oxo-O-phosphono-L-homoserine|L-beta-aspartyl dihydrogen phosphate (2S)-2-amino-4-oxo-4-(phosphonooxy)butanoic acid|4-oxo-O-phosphono-L-homoserine|4-phospho-L-aspartic acid|L-4-Aspartyl phosphate|L-aspart-4-yl phosphate|L-beta-aspartyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_15836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15837 biolink:ChemicalEntity isoamylol An primary alcohol that is butan-1-ol in which a hydrogen at position 3 has been replaced by a methyl group. cas:123-51-3|drugbank:DB02296|gmelin:49460|hmdb:HMDB0006007|kegg.compound:C07328|pubmed:23043843|pubmed:23698045|pubmed:24487533|pubmed:24767042|pubmed:24804072|pubmed:24862930|reaxys:1718835|ymdb:YMDB00570 Graph 1-HYDROXY-3-METHYLBUTANE|2-methyl-4-butanol|3-Methylbutanol|3-methyl-1-butanol|3-methylbutan-1-ol|Iso-amylalkohol|Isoamyl alcohol|Isopentyl alcohol|Isopentylalkohol|alcool isoamylique|i-amyl alcohol|isoamylol|isobutylcarbinol|isopentan-1-ol|isopentanol|primary isoamyl alcohol 3-methylbutan-1-ol 1-HYDROXY-3-METHYLBUTANE|2-methyl-4-butanol|3-Methylbutanol|3-methyl-1-butanol|3-methylbutan-1-ol|Iso-amylalkohol|Isoamyl alcohol|Isopentyl alcohol|Isopentylalkohol|alcool isoamylique|i-amyl alcohol|isoamylol|isobutylcarbinol|isopentan-1-ol|isopentanol|primary isoamyl alcohol http://purl.obolibrary.org/obo/CHEBI_15837 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15838 biolink:ChemicalEntity (7R)-7-(5-carboxy-5-oxopentanamido)cephalosporanic acid A cephalosporin having an acetoxy group at the 3-position and a 5-carboxy-5-oxopentanamido group at the 7-position. beilstein:5395497|kegg.compound:C04712 Graph (6R,7R)-3-(acetoxymethyl)-7-[(5-carboxy-5-oxopentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7R)-7-(5-Carboxy-5-oxopentanoyl)aminocephalosporinate|(7R)-7-(5-carboxy-5-oxopentanoyl)aminocephalosporinic acid|7-(5-Carboxyl-5-oxopentanyl)-aminocephalosporinate (6R,7R)-3-(acetoxymethyl)-7-[(5-carboxy-5-oxopentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-3-(acetoxymethyl)-7-[(5-carboxy-5-oxopentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7R)-7-(5-Carboxy-5-oxopentanoyl)aminocephalosporinate|(7R)-7-(5-carboxy-5-oxopentanoyl)aminocephalosporinic acid|7-(5-Carboxyl-5-oxopentanyl)-aminocephalosporinate http://purl.obolibrary.org/obo/CHEBI_15838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15840 biolink:ChemicalEntity N-acylneuraminic acid 9-phosphate An N-acylneuraminic acid phosphate having the phosphate group at the 9-position. kegg.compound:C01200 Graph N-Acylneuraminate 9-phosphate|N-acylneuraminic acid 9-phosphate|N-acylneuraminic acid 9-phosphates N-Acylneuraminate 9-phosphate|N-acylneuraminic acid 9-phosphate|N-acylneuraminic acid 9-phosphates http://purl.obolibrary.org/obo/CHEBI_15840 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15841 biolink:ChemicalEntity polypeptide A peptide containing ten or more amino acid residues. kegg.compound:C00403 Graph Polypeptid|Polypeptide|polipeptido|polypeptides polypeptides Polypeptid|Polypeptide|polipeptido|polypeptides http://purl.obolibrary.org/obo/CHEBI_15841 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15842 biolink:ChemicalEntity orotidine 5'-phosphate A pyrimidine ribonucleoside 5'-monophosphate having 6-carboxyuracil as the nucleobase. cas:2149-82-8|kegg.compound:C01103|knapsack:C00007583|pdb-ccd:OMP Graph 2,6-dioxo-3-(5-O-phosphono-beta-D-ribofuranosyl)-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid|6-carboxy-5'-uridylic acid|Orotidine 5'-phosphate|Orotidylic acid|orotidine 5'-(dihydrogen phosphate) 2,6-dioxo-3-(5-O-phosphono-beta-D-ribofuranosyl)-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid 2,6-dioxo-3-(5-O-phosphono-beta-D-ribofuranosyl)-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid|6-carboxy-5'-uridylic acid|Orotidine 5'-phosphate|Orotidylic acid|orotidine 5'-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15843 biolink:ChemicalEntity arachidonic acid A long-chain fatty acid that is a C20, polyunsaturated fatty acid having four (Z)-double bonds at positions 5, 8, 11 and 14. cas:506-32-1|drugbank:DB04557|gmelin:58972|hmdb:HMDB0001043|kegg.compound:C00219|knapsack:C00000388|lipidmaps:LMFA01030001|metacyc.compound:ARACHIDONIC_ACID|pdb-ccd:ACD|pubmed:15129302|pubmed:18931599|pubmed:18973997|pubmed:25584012|pubmed:2820055|reaxys:1913991|wikipedia.en:Arachidonic_acid Graph (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoic acid|(5Z,8Z,11Z,14Z)-Icosatetraenoic acid|(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid|AA|ARA|ARACHIDONIC ACID|Arachidonate|Arachidonic acid|Arachidonsaeure|all-cis-5,8,11,14-eicosatetraenoic acid|cis-5,8,11,14-Eicosatetraenoic acid|cis-Delta(5,8,11,14)-eicosatetraenoic acid (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid (5Z,8Z,11Z,14Z)-5,8,11,14-icosatetraenoic acid|(5Z,8Z,11Z,14Z)-Icosatetraenoic acid|(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid|AA|ARA|ARACHIDONIC ACID|Arachidonate|Arachidonic acid|Arachidonsaeure|all-cis-5,8,11,14-eicosatetraenoic acid|cis-5,8,11,14-Eicosatetraenoic acid|cis-Delta(5,8,11,14)-eicosatetraenoic acid http://purl.obolibrary.org/obo/CHEBI_15843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15844 biolink:ChemicalEntity 1D-myo-inositol 3,4,5,6-tetrakisphosphate A myo-inositol tetrakisphosphate having the four phosphate groups placed at the 3-, 4-, 5- and 6-positions. beilstein:5466782|cas:112791-61-4|kegg.compound:C04520 Graph 1D-myo-Inositol 3,4,5,6-tetrakisphosphate|1L-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate)|D-myo-Inositol 3,4,5,6-tetrakisphosphate|Inositol-3,4,5,6-tetraphosphate|Ins-3,4,5,6-P4|myo-Inositol-3,4,5,6-tetrakisphosphate 1L-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate) 1D-myo-Inositol 3,4,5,6-tetrakisphosphate|1L-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate)|D-myo-Inositol 3,4,5,6-tetrakisphosphate|Inositol-3,4,5,6-tetraphosphate|Ins-3,4,5,6-P4|myo-Inositol-3,4,5,6-tetrakisphosphate http://purl.obolibrary.org/obo/CHEBI_15844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15845 biolink:ChemicalEntity keto-L-tagatose 6-phosphate The open chain form of L-tagatose 6-phosphate metacyc.compound:CPD-15828 Graph 6-O-phosphono-L-tagatose|keto-L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|keto-L-tagatose 6-(dihydrogen phosphate) keto-L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|keto-L-tagatose 6-(dihydrogen phosphate) 6-O-phosphono-L-tagatose|keto-L-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|keto-L-tagatose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15846 biolink:ChemicalEntity NAD(+) The oxidised form of nicotinamide adenine dinucleotide found in all living cells. In metabolism, NAD+ is involved in redox reactions, carrying electrons from one reaction to another. beilstein:4120619|cas:53-84-9|drugbank:DB01907|ecmdb:ECMDB00902|gmelin:544242|hmdb:HMDB0000902|kegg.compound:C00003|kegg.drug:D00002|knapsack:C00007256|lincs.smallmolecule:LSM-4965|pdb-ccd:NAJ|reaxys:3584133|ymdb:YMDB00110 Graph DPN|Diphosphopyridine nucleotide|NAD|NAD+|Nadide|Nicotinamide adenine dinucleotide|adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|beta-NAD adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate} DPN|Diphosphopyridine nucleotide|NAD|NAD+|Nadide|Nicotinamide adenine dinucleotide|adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|beta-NAD http://purl.obolibrary.org/obo/CHEBI_15846 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15847 biolink:ChemicalEntity 2-(alpha-D-mannosyl)-D-glyceric acid A D-mannosyl-D-glyceric acid where an α-D-mannosyl residue is attached at the 2-position. kegg.compound:C11544 Graph (2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid|2(alpha-D-Mannosyl)-D-glycerate|2-O-alpha-Mannosyl-D-glycerate|alpha-Mannosylglycerate (2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid (2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid|2(alpha-D-Mannosyl)-D-glycerate|2-O-alpha-Mannosyl-D-glycerate|alpha-Mannosylglycerate http://purl.obolibrary.org/obo/CHEBI_15847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15848 biolink:ChemicalEntity dTDP-galactose kegg.compound:C02097 Graph dTDPgalactose|thymidine 5'-(3-galactopyranosyl dihydrogen diphosphate) thymidine 5'-(3-galactopyranosyl dihydrogen diphosphate) dTDPgalactose|thymidine 5'-(3-galactopyranosyl dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_15848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15849 biolink:ChemicalEntity aryl(methyl)malonic acid kegg.compound:C06388 Graph 2-Aryl-2-methylmalonate|aryl(methyl)malonic acids 2-Aryl-2-methylmalonate|aryl(methyl)malonic acids http://purl.obolibrary.org/obo/CHEBI_15849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15850 biolink:ChemicalEntity 1-O-alkyl-sn-glycerol A chiral alkylglycerol having the alkyl group at the 1-position. kegg.compound:C02773 Graph 1-Alkyl-sn-glycerol|1-O-alkyl-sn-glycerols|1-alkyl-sn-glycerols|a 1-O-alkyl-sn-glycerol 1-Alkyl-sn-glycerol|1-O-alkyl-sn-glycerols|1-alkyl-sn-glycerols|a 1-O-alkyl-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_15850 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15851 biolink:ChemicalEntity 3-(uracil-1-yl)-L-alanine The 3-(uracil-1-yl) derivative of L-alanine. beilstein:20710|cas:21416-43-3|drugbank:DB04129|kegg.compound:C03584|knapsack:C00001399|pdb-ccd:HWD Graph 2-AMINO-3-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID|3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine|3-(Uracil-1-yl)-L-alanine|3-(uracil-1-yl)-L-alanine|Willardiine 3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine 2-AMINO-3-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID|3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine|3-(Uracil-1-yl)-L-alanine|3-(uracil-1-yl)-L-alanine|Willardiine http://purl.obolibrary.org/obo/CHEBI_15851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15852 biolink:ChemicalEntity aquacob(III)alamin cas:13422-52-1|hmdb:HMDB0003458|kegg.compound:C00992|metacyc.compound:AQUACOBIIIALAMIN Graph Aquacob(III)alamin|Aquacobalamin|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-aquacobamide|H2OCbl|aquacob(III)alamin|aquacobalamin|vitamin B-12a Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-aquacobamide Aquacob(III)alamin|Aquacobalamin|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-aquacobamide|H2OCbl|aquacob(III)alamin|aquacobalamin|vitamin B-12a http://purl.obolibrary.org/obo/CHEBI_15852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15854 biolink:ChemicalEntity quinine A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy. beilstein:91867|cas:130-95-0|drugbank:DB00468|drugcentral:4523|kegg.compound:C06526|kegg.drug:D08460|knapsack:C00002193|pubmed:10821711|pubmed:10891117|pubmed:10937718|pubmed:11212126|pubmed:11549443|pubmed:11728183|pubmed:11844668|pubmed:11855978|pubmed:12127529|pubmed:12213073|pubmed:12217353|pubmed:12477351|pubmed:12502361|pubmed:12798326|pubmed:12873511|pubmed:14761192|pubmed:15026051|pubmed:15027870|pubmed:15225721|pubmed:15857133|pubmed:16524728|pubmed:16933872|pubmed:17482816|pubmed:17506538|pubmed:17570664|pubmed:17850126|pubmed:18348514|pubmed:18788725|pubmed:2579237|pubmed:2657065|pubmed:7009867|pubmed:8182707|wikipedia.en:Quinine Graph (-)-Quinine|(-)-quinine|(8S,9R)-quinine|(9R)-6'-methoxy-8alpha-cinchonan-9-ol|(R)-(-)-quinine|(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol|6'-methoxycinchonidine|Chinin|Quinine|chinine|chininum|quinina|quinine (9R)-6'-methoxy-8alpha-cinchonan-9-ol (-)-Quinine|(-)-quinine|(8S,9R)-quinine|(9R)-6'-methoxy-8alpha-cinchonan-9-ol|(R)-(-)-quinine|(R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol|6'-methoxycinchonidine|Chinin|Quinine|chinine|chininum|quinina|quinine http://purl.obolibrary.org/obo/CHEBI_15854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15855 biolink:ChemicalEntity UDP-6-sulfoquinovose A UDP-sugar having 6-sulfoquinovose as the sugar component. kegg.compound:C11521|pdb-ccd:USQ Graph UDP-6-sulfoquinovose|uridine 5'-[3-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl) dihydrogen diphosphate]|uridine 5'-[3-(6-sulfo-alpha-D-quinovopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl) dihydrogen diphosphate] UDP-6-sulfoquinovose|uridine 5'-[3-(6-deoxy-6-sulfo-alpha-D-glucopyranosyl) dihydrogen diphosphate]|uridine 5'-[3-(6-sulfo-alpha-D-quinovopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15857 biolink:ChemicalEntity 5-L-glutamyl amino acid A dipeptide that consists of any C-terminal amino acid having an L-γ-glutamyl residue attached at the Nα-position. kegg.compound:C03363 Graph 5-L-Glutamyl amino acid|L-gamma-Glutamyl amino acid|L-gamma-glutamyl amino acid|N(alpha)-(L-gamma-glutamyl) amino acid 5-L-Glutamyl amino acid|L-gamma-Glutamyl amino acid|L-gamma-glutamyl amino acid|N(alpha)-(L-gamma-glutamyl) amino acid http://purl.obolibrary.org/obo/CHEBI_15857 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15858 biolink:ChemicalEntity bromide beilstein:3587179|cas:24959-67-9|gmelin:14908|kegg.compound:C00720|kegg.compound:C01324|pdb-ccd:BR Graph BROMIDE ION|Br(-)|Br-|Bromide|bromide|bromide(1-)|bromine anion Bromide|bromide|bromide(1-) BROMIDE ION|Br(-)|Br-|Bromide|bromide|bromide(1-)|bromine anion http://purl.obolibrary.org/obo/CHEBI_15858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15859 biolink:ChemicalEntity N-carbamoyl-L-aspartic acid The L-enantiomer N-carbamoylaspartic acid. cas:13184-27-5|drugbank:DB04252|hmdb:HMDB0000828|kegg.compound:C00438|knapsack:C00007265|pdb-ccd:NCD|pubmed:17439666|reaxys:1726860|wikipedia.en:Carbamoyl_aspartic_acid Graph Carbamyl-L-aspartic acid|L-ureidosuccinic acid|N-(aminocarbonyl)-L-aspartic acid|N-CARBAMOYL-L-ASPARTATE|N-Carbamoyl-L-aspartate|N-carbamoyl-L-aspartic acid|N-carbamoyl-S-aspartic acid|carbamyl-L-aspartic acid N-CARBAMOYL-L-ASPARTATE|N-Carbamoyl-L-aspartate|N-carbamoyl-L-aspartic acid Carbamyl-L-aspartic acid|L-ureidosuccinic acid|N-(aminocarbonyl)-L-aspartic acid|N-CARBAMOYL-L-ASPARTATE|N-Carbamoyl-L-aspartate|N-carbamoyl-L-aspartic acid|N-carbamoyl-S-aspartic acid|carbamyl-L-aspartic acid http://purl.obolibrary.org/obo/CHEBI_15859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15860 biolink:ChemicalEntity N-methylhexanamide kegg.compound:C02722 Graph N-Methylhexanamide|N-methylcaproamide|N-methylhexanamide N-Methylhexanamide|N-methylhexanamide N-Methylhexanamide|N-methylcaproamide|N-methylhexanamide http://purl.obolibrary.org/obo/CHEBI_15860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15861 biolink:ChemicalEntity trichodiene cas:28624-60-4|kegg.compound:C01860|knapsack:C00012601|lipidmaps:LMPR0103180001 Graph (4S)-1,4-dimethyl-4-[(1S)-1-methyl-2-methylidenecyclopentyl]cyclohexene|1,4-dimethyl-4-(1-methyl-2-methylenecyclopentyl)cyclohexene|Trichodiene|trichodiene (4S)-1,4-dimethyl-4-[(1S)-1-methyl-2-methylidenecyclopentyl]cyclohexene (4S)-1,4-dimethyl-4-[(1S)-1-methyl-2-methylidenecyclopentyl]cyclohexene|1,4-dimethyl-4-(1-methyl-2-methylenecyclopentyl)cyclohexene|Trichodiene|trichodiene http://purl.obolibrary.org/obo/CHEBI_15861 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15862 biolink:ChemicalEntity ethylamine A two-carbon primary aliphatic amine. cas:75-04-7|gmelin:897|hmdb:HMDB0013231|kegg.compound:C00797|metacyc.compound:ETHANAMINE|pdb-ccd:NEH|pubmed:10930630|pubmed:11074065|reaxys:505933|wikipedia.en:Ethylamine Graph 1-aminoethane|ETHANAMINE|Ethylamine|aminoethane|ethanamine ETHANAMINE|ethanamine 1-aminoethane|ETHANAMINE|Ethylamine|aminoethane|ethanamine http://purl.obolibrary.org/obo/CHEBI_15862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15864 biolink:ChemicalEntity luteolin A tetrahydroxyflavone in which the four hydroxy groups are located at positions 3', 4', 5 and 7. It is thought to play an important role in the human body as an antioxidant, a free radical scavenger, an anti-inflammatory agent and an immune system modulator as well as being active against several cancers. cas:491-70-3|chemspider:4444102|drugbank:DB15584|foodb.food:FDB013255|hmdb:HMDB0005800|kegg.compound:C01514|knapsack:C00000674|lincs.smallmolecule:LSM-5229|lipidmaps:LMPK12110006|metacyc.compound:5734-TETRAHYDROXYFLAVONE|pdb-ccd:LU2|pubmed:11478688|pubmed:11897650|pubmed:14574115|pubmed:18720166|pubmed:18946424|pubmed:18991571|pubmed:19263826|pubmed:19509250|pubmed:19854181|pubmed:21899269|pubmed:22391103|pubmed:22749133|pubmed:22794353|pubmed:22842046|pubmed:23035972|pubmed:23229294|pubmed:23574272|pubmed:26020516|pubmed:26322379|pubmed:27595800|pubmed:27764981|pubmed:27853236|pubmed:27878246|pubmed:27879665|pubmed:27886116|pubmed:27919958|pubmed:27927066|pubmed:27959422|pubmed:28004344|pubmed:28029146|pubmed:28031430|pubmed:28035396|pubmed:28067377|pubmed:28069121|pubmed:28071803|pubmed:28090531|pubmed:28096694|pubmed:28101184|pubmed:28101223|pubmed:28110189|pubmed:28111945|pubmed:28112209|pubmed:28113103|pubmed:28166217|pubmed:29423013|pubmed:30624931|pubmed:32883638|reaxys:292084|wikipedia.en:Luteolin Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-benzopyrone|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one|3',4',5,7-Tetrahydroxyflavone|5,7,3',4'-Tetrahydroxyflavone|Luteolin|Luteolol|Salifazide|digitoflavone|flacitran 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-benzopyrone|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one|3',4',5,7-Tetrahydroxyflavone|5,7,3',4'-Tetrahydroxyflavone|Luteolin|Luteolol|Salifazide|digitoflavone|flacitran http://purl.obolibrary.org/obo/CHEBI_15864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15865 biolink:ChemicalEntity 6-phospho-2-dehydro-D-gluconate(1-) Graph 6-O-phosphono-D-arabino-hex-2-ulosonate|6-O-phosphono-D-fructosonate 6-O-phosphono-D-arabino-hex-2-ulosonate 6-O-phosphono-D-arabino-hex-2-ulosonate|6-O-phosphono-D-fructosonate http://purl.obolibrary.org/obo/CHEBI_15865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15866 biolink:ChemicalEntity 2-deoxy-D-glucose A deoxyglucose that is D-glucose in which the hydroxy group at position 2 has been replaced by a hydrogen. It is an antimetabolite of glucose with antiviral activity, which acts by inhibiting the glycosylation of glycoproteins and glycolipids. Used as an antiherpes agent. cas:154-17-6|kegg.compound:C00586|metacyc.compound:2-DEOXY-D-GLUCOSE|pubmed:17908557|wikipedia.en:2-Deoxy-D-glucose Graph 2-Deoxy-D-arabino-hexose|2-Deoxy-D-glucose|2-Deoxy-D-mannose|2-deoxy-D-arabino-hexose|D-2dGlc|D-arabino-2-Deoxyhexose|Deoxyglucose 2-Deoxy-D-arabino-hexose|2-deoxy-D-arabino-hexose 2-Deoxy-D-arabino-hexose|2-Deoxy-D-glucose|2-Deoxy-D-mannose|2-deoxy-D-arabino-hexose|D-2dGlc|D-arabino-2-Deoxyhexose|Deoxyglucose http://purl.obolibrary.org/obo/CHEBI_15866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15867 biolink:ChemicalEntity D-xylono-1,5-lactone beilstein:7020302|kegg.compound:C02266 Graph (3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-one|D-Xylono-1,5-lactone|D-Xylonolactone|D-xylono-1,5-lactone (3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-one (3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-one|D-Xylono-1,5-lactone|D-Xylonolactone|D-xylono-1,5-lactone http://purl.obolibrary.org/obo/CHEBI_15867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15868 biolink:ChemicalEntity CDP-N-methylethanolamine A nucleotide-(amino alcohol) that is the N-methyl derivative of CDP-ethanolamine. kegg.compound:C03486 Graph CDP-N-methylethanolamine|cytidine 5'-{3-[2-(methylamino)ethyl] dihydrogen diphosphate} cytidine 5'-{3-[2-(methylamino)ethyl] dihydrogen diphosphate} CDP-N-methylethanolamine|cytidine 5'-{3-[2-(methylamino)ethyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15870 biolink:ChemicalEntity betaine aldehyde hydrate A quaternary ammonium ion that is the hydrate of betaine aldehyde. kegg.compound:C07345|metacyc.compound:BETAINE-ALDEHYDE-HYDRATE|reaxys:1741515 Graph 2,2-dihydroxy-N,N,N-trimethylethanaminium|betaine aldehyde hydrate|glycine betaine aldehyde hydrate 2,2-dihydroxy-N,N,N-trimethylethanaminium 2,2-dihydroxy-N,N,N-trimethylethanaminium|betaine aldehyde hydrate|glycine betaine aldehyde hydrate http://purl.obolibrary.org/obo/CHEBI_15870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15871 biolink:ChemicalEntity o-orsellinate depside cas:480-56-8|kegg.compound:C02868|knapsack:C00017999|lincs.smallmolecule:LSM-25637|lipidmaps:LMPK13080001 Graph 2,4-Dihydroxy-6-methylbenzoic acid 4-carboxy-3-hydroxy-5-methylphenyl ester|4-(2,4-dihydroxy-6-methylbenzoyloxy)-2-hydroxy-6-methylbenzoic acid|Lecanoric acid|Orsellinate depside 4-(2,4-dihydroxy-6-methylbenzoyloxy)-2-hydroxy-6-methylbenzoic acid 2,4-Dihydroxy-6-methylbenzoic acid 4-carboxy-3-hydroxy-5-methylphenyl ester|4-(2,4-dihydroxy-6-methylbenzoyloxy)-2-hydroxy-6-methylbenzoic acid|Lecanoric acid|Orsellinate depside http://purl.obolibrary.org/obo/CHEBI_15871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15873 biolink:ChemicalEntity alpha-D-glucosamine 6-phosphate A 2-amino-2-deoxy-D-glucopyranose 6-phosphate that has an α-configuration at the anomeric position. drugbank:DB02657|hmdb:HMDB0001254|kegg.compound:C00352|metacyc.compound:CPD-13469|pdb-ccd:GLP|pubmed:18842060|reaxys:8137152 Graph 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose|2-amino-2-deoxy-alpha-D-glucopyranose 6-(dihydrogen phosphate)|GLUCOSAMINE 6-PHOSPHATE|alpha-D-glucosamine 6-(dihydrogen phosphate) 2-amino-2-deoxy-alpha-D-glucopyranose 6-(dihydrogen phosphate) 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose|2-amino-2-deoxy-alpha-D-glucopyranose 6-(dihydrogen phosphate)|GLUCOSAMINE 6-PHOSPHATE|alpha-D-glucosamine 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15874 biolink:ChemicalEntity N(2)-malonyl-D-tryptophan kegg.compound:C03414|knapsack:C00000118 Graph (2R)-2-[(carboxyacetyl)amino]-3-(1H-indol-3-yl)propanoic acid|N-(carboxyacetyl)-D-tryptophan|N2-Malonyl-D-tryptophan (2R)-2-[(carboxyacetyl)amino]-3-(1H-indol-3-yl)propanoic acid|N-(carboxyacetyl)-D-tryptophan (2R)-2-[(carboxyacetyl)amino]-3-(1H-indol-3-yl)propanoic acid|N-(carboxyacetyl)-D-tryptophan|N2-Malonyl-D-tryptophan http://purl.obolibrary.org/obo/CHEBI_15874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15877 biolink:ChemicalEntity L-lupinate kegg.compound:C01513 Graph (S)-2-amino-3-{[(E)-4-hydroxy-3-methylbut-2-enylamino]purin-9-yl}propanoate|3-[N(6)-(4-hydroxyisopentenyl)adeninyl]-L-alaninate|3-{6-[(2E)-4-hydroxy-3-methylbut-2-en-1-ylamino]-9H-purin-9-yl}-L-alaninate 3-{6-[(2E)-4-hydroxy-3-methylbut-2-en-1-ylamino]-9H-purin-9-yl}-L-alaninate (S)-2-amino-3-{[(E)-4-hydroxy-3-methylbut-2-enylamino]purin-9-yl}propanoate|3-[N(6)-(4-hydroxyisopentenyl)adeninyl]-L-alaninate|3-{6-[(2E)-4-hydroxy-3-methylbut-2-en-1-ylamino]-9H-purin-9-yl}-L-alaninate http://purl.obolibrary.org/obo/CHEBI_15877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15878 biolink:ChemicalEntity 10-hydroxydihydrosanguinarine A benzophenanthridine alkaloid comprising dihydrosanguinarine carrying a hydroxy substituent at the 10-position. kegg.compound:C05247|pubmed:15921406|reaxys:5832685 Graph 10-Hydroxydihydrosanguinarine|10-hydroxydihydrosanguinarine|13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-5-ol 13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-5-ol 10-Hydroxydihydrosanguinarine|10-hydroxydihydrosanguinarine|13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-5-ol http://purl.obolibrary.org/obo/CHEBI_15878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15880 biolink:ChemicalEntity S-methyl 3-phospho-1-thio-D-glycerate The methyl thiolester of 3-phospho-1-thio-D-glyceric acid. kegg.compound:C04399 Graph S-Methyl-3-phospho-1-thio-D-glycerate|S-methyl (2R)-2-hydroxy-3-(phosphonooxy)propanethioate S-methyl (2R)-2-hydroxy-3-(phosphonooxy)propanethioate S-Methyl-3-phospho-1-thio-D-glycerate|S-methyl (2R)-2-hydroxy-3-(phosphonooxy)propanethioate http://purl.obolibrary.org/obo/CHEBI_15880 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15881 biolink:ChemicalEntity 2-oxopropyl-CoM The S-(2-oxopropyl) derivative of coenzyme M. kegg.compound:C11497|pdb-ccd:KPC|umbbd.compound:c0781 Graph 2-(2-Oxopropylthio)ethanesulfonate|2-Oxopropyl-CoM|2-[(2-oxopropyl)sulfanyl]ethanesulfonic acid|2-ketopropyl-CoM 2-[(2-oxopropyl)sulfanyl]ethanesulfonic acid 2-(2-Oxopropylthio)ethanesulfonate|2-Oxopropyl-CoM|2-[(2-oxopropyl)sulfanyl]ethanesulfonic acid|2-ketopropyl-CoM http://purl.obolibrary.org/obo/CHEBI_15881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15882 biolink:ChemicalEntity phenol An organic hydroxy compound that consists of benzene bearing a single hydroxy substituent. The parent of the class of phenols. cas:108-95-2|drugbank:DB03255|drugcentral:4266|gmelin:2794|hmdb:HMDB0000228|kegg.compound:C00146|kegg.compound:C15584|kegg.drug:D00033|kegg.drug:D06536|knapsack:C00002664|pdb-ccd:IPH|pubmed:12058733|pubmed:16953321|pubmed:17852157|pubmed:19029204|pubmed:20886261|pubmed:21492257|pubmed:21689881|pubmed:21809019|pubmed:21822930|reaxys:969616|umbbd.compound:c0128|wikipedia.en:Phenol Graph Benzenol|Carbolsaeure|Hydroxybenzene|Karbolsaeure|Oxybenzene|PHENOL|PhOH|Phenic acid|Phenol|Phenylic acid|Phenylic alcohol|acide carbolique|acide phenique|carbolic acid|phenol PHENOL|Phenol|phenol Benzenol|Carbolsaeure|Hydroxybenzene|Karbolsaeure|Oxybenzene|PHENOL|PhOH|Phenic acid|Phenol|Phenylic acid|Phenylic alcohol|acide carbolique|acide phenique|carbolic acid|phenol http://purl.obolibrary.org/obo/CHEBI_15882 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15883 biolink:ChemicalEntity P(1),P(4)-bis(5'-guanosyl) tetraphosphate A purine ribonucleoside 5'-tetraphosphate compound having 5'-guanosyl residues at the P1- and P4-positions. cas:4130-19-2|kegg.compound:C01261 Graph (ppG)2|Bis(5'-guanosyl) tetraphosphate|Diguanosine tetraphosphate|G(5')p4(5')G|GP4G|GppppG|P(1),P(4)-bis(5'-guanosyl) tetrahydrogen tetraphosphate|P1,P4-Bis(5'-guanosyl) tetraphosphate|P1,P4-bis(5'-guanosyl) tetraphosphate|bis(guanylyl) diphosphate|guanosine(5')tetraphospho(5')guanosine P(1),P(4)-bis(5'-guanosyl) tetrahydrogen tetraphosphate (ppG)2|Bis(5'-guanosyl) tetraphosphate|Diguanosine tetraphosphate|G(5')p4(5')G|GP4G|GppppG|P(1),P(4)-bis(5'-guanosyl) tetrahydrogen tetraphosphate|P1,P4-Bis(5'-guanosyl) tetraphosphate|P1,P4-bis(5'-guanosyl) tetraphosphate|bis(guanylyl) diphosphate|guanosine(5')tetraphospho(5')guanosine http://purl.obolibrary.org/obo/CHEBI_15883 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15884 biolink:ChemicalEntity tropine A derivative of tropane having a hydroxy group at the 3-position. beilstein:80188|cas:120-29-6|kegg.compound:C00729|knapsack:C00002306|patent:CN101643472|patent:CN101643473|patent:US2010087364|pubmed:19924779|pubmed:21420927|pubmed:22349358 Graph (3-endo)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|1alphaH,5alphaH-tropan-3alpha-ol|3alpha-Tropanol|3alpha-tropanol|8-methyl-8-azabicyclo[3.2.1]octan-3-ol|Tropine|endo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|tropan-3alpha-ol|tropanol tropan-3alpha-ol (3-endo)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|1alphaH,5alphaH-tropan-3alpha-ol|3alpha-Tropanol|3alpha-tropanol|8-methyl-8-azabicyclo[3.2.1]octan-3-ol|Tropine|endo-8-methyl-8-azabicyclo[3.2.1]octan-3-ol|tropan-3alpha-ol|tropanol http://purl.obolibrary.org/obo/CHEBI_15884 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15885 biolink:ChemicalEntity L-2-amino-4-chloropent-4-enoic acid An α-amino acid having a 2-chloro-2-propenyl group at the α-position and L-configuration. beilstein:3933203|cas:55528-30-8|kegg.compound:C04075 Graph (2S)-2-amino-4-chloropent-4-enoic acid|(S)-2-amino-4-chloro-4-pentenoic acid|2-Amino-4-chloro-4-pentenoic acid (2S)-2-amino-4-chloropent-4-enoic acid (2S)-2-amino-4-chloropent-4-enoic acid|(S)-2-amino-4-chloro-4-pentenoic acid|2-Amino-4-chloro-4-pentenoic acid http://purl.obolibrary.org/obo/CHEBI_15885 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15886 biolink:ChemicalEntity UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate kegg.compound:C04573 Graph UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate|UDP-N-acetyl-D-glucosaminouronate UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate|UDP-N-acetyl-D-glucosaminouronate http://purl.obolibrary.org/obo/CHEBI_15886 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15887 biolink:ChemicalEntity 5-aminopentanoic acid A δ-amino acid comprising pentanoic acid with an amino substituent at C-5; a methylene homologue of γ-aminobutyric acid (GABA) that is a weak GABA agonist. cas:660-88-8|gmelin:405633|hmdb:HMDB0003355|kegg.compound:C00431|lipidmaps:LMFA01100040|metacyc.compound:5-AMINOPENTANOATE|pubmed:10930630|pubmed:11991139|pubmed:1268741|pubmed:1316620|pubmed:15150230|pubmed:2823166|pubmed:3004997|pubmed:4031870|pubmed:4301045|pubmed:494814|pubmed:6031429|pubmed:6408913|pubmed:6436440|reaxys:906833 Graph 5-Aminopentanoate|5-Aminopentanoic acid|5-Aminovaleric acid|5-amino-n-valeric acid|5-aminopentanoic acid|DANVA|delta-Amino-n-valeric acid|delta-aminovaleric acid 5-Aminopentanoate|5-Aminopentanoic acid|5-aminopentanoic acid 5-Aminopentanoate|5-Aminopentanoic acid|5-Aminovaleric acid|5-amino-n-valeric acid|5-aminopentanoic acid|DANVA|delta-Amino-n-valeric acid|delta-aminovaleric acid http://purl.obolibrary.org/obo/CHEBI_15887 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15888 biolink:ChemicalEntity 5-oxohexanoic acid A medium-chain fatty acid comprising hexanoic acid carrying a 5-oxo group. cas:3128-06-1|kegg.compound:C02129|lipidmaps:LMFA01060010|patent:EP0062305|pdb-ccd:4AT|pubmed:2505723|pubmed:3715925|reaxys:385840 Graph 4-Acetylbutyric acid|4-acetyl-butanoic acid|4-acetyl-butyric acid|5-Ketocaproic acid|5-Ketohexanoic acid|5-Oxohexanoate|5-Oxohexanoic acid|5-keto-n-caproic acid|5-oxocaproic acid|5-oxohexanoic acid|delta-Ketocaproic acid|delta-Oxocaproic acid|gamma-Acetylbutyric acid 5-Oxohexanoic acid|5-oxohexanoic acid 4-Acetylbutyric acid|4-acetyl-butanoic acid|4-acetyl-butyric acid|5-Ketocaproic acid|5-Ketohexanoic acid|5-Oxohexanoate|5-Oxohexanoic acid|5-keto-n-caproic acid|5-oxocaproic acid|5-oxohexanoic acid|delta-Ketocaproic acid|delta-Oxocaproic acid|gamma-Acetylbutyric acid http://purl.obolibrary.org/obo/CHEBI_15888 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15889 biolink:ChemicalEntity sterol Any 3-hydroxy steroid whose skeleton is closely related to cholestan-3-ol (additional carbon atoms may be present in the side chain). kegg.compound:C00370|lipidmaps_class:LMST01|metacyc.compound:Sterols|wikipedia.en:Sterol Graph 3-hydroxysteroids|Sterol|a sterol|sterols sterols 3-hydroxysteroids|Sterol|a sterol|sterols http://purl.obolibrary.org/obo/CHEBI_15889 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15890 biolink:ChemicalEntity 5,6-dimethylbenzimidazole A dimethylbenzimidazole carrying methyl substituents at positions 5 and 6. cas:582-60-5|drugbank:DB02591|gmelin:279255|hmdb:HMDB0003701|kegg.compound:C03114|metacyc.compound:DIMETHYLBENZIMIDAZOLE|pdb-ccd:DMD|pubmed:23479751|reaxys:116595|wikipedia.en:Dimethylbenzimidazole Graph 5,6-DIMETHYLBENZIMIDAZOLE|5,6-Dimethylbenzimidazole|5,6-dimethyl-1H-benzimidazole|5,6-dimethylbenzimidazole|Dimedazol|Dimedazole|Dimesol|Dimethylbenzimidazole|Dimezol 5,6-dimethyl-1H-benzimidazole 5,6-DIMETHYLBENZIMIDAZOLE|5,6-Dimethylbenzimidazole|5,6-dimethyl-1H-benzimidazole|5,6-dimethylbenzimidazole|Dimedazol|Dimedazole|Dimesol|Dimethylbenzimidazole|Dimezol http://purl.obolibrary.org/obo/CHEBI_15890 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15891 biolink:ChemicalEntity taurine An amino sulfonic acid that is the 2-amino derivative of ethanesulfonic acid. It is a naturally occurring amino acid derived from methionine and cysteine metabolism. An abundant component of fish- and meat-based foods, it has been used as an oral supplement in the treatment of disorders such as cystic fibrosis and hypertension. cas:107-35-7|drugbank:DB01956|drugcentral:4486|gmelin:82121|hmdb:HMDB0000251|kegg.compound:C00245|kegg.drug:D00047|knapsack:C00048188|metacyc.compound:TAURINE|pdb-ccd:TAU|pubmed:10098958|pubmed:10325611|pubmed:10349454|pubmed:10827156|pubmed:11162030|pubmed:11842876|pubmed:11918831|pubmed:11931837|pubmed:12297216|pubmed:12499349|pubmed:12834252|pubmed:14992292|pubmed:15503229|pubmed:15780050|pubmed:15911239|pubmed:16169526|pubmed:16444816|pubmed:16923232|pubmed:17053427|pubmed:17081118|pubmed:17875433|pubmed:17997039|pubmed:18060526|pubmed:18171928|pubmed:19074966|pubmed:19212411|pubmed:19309105|pubmed:19940987|pubmed:2122710|pubmed:21761941|pubmed:22770225|pubmed:2370482|pubmed:24027187|pubmed:2494044|pubmed:27291853|pubmed:27334436|pubmed:27345710|pubmed:27380030|pubmed:27412799|pubmed:27471162|pubmed:27535560|pubmed:3106924|pubmed:3393260|pubmed:6198473|pubmed:7588651|pubmed:8692051|pubmed:8818047|pubmed:9635063|reaxys:1751215|wikipedia.en:Taurine Graph 2-Aminoethanesulfonic acid|2-aminoethanesulfonic acid|2-aminoethyl sulfonate|Aminoethylsulfonic acid|Taurine|beta-aminoethylsulfonic acid 2-Aminoethanesulfonic acid|2-aminoethanesulfonic acid 2-Aminoethanesulfonic acid|2-aminoethanesulfonic acid|2-aminoethyl sulfonate|Aminoethylsulfonic acid|Taurine|beta-aminoethylsulfonic acid http://purl.obolibrary.org/obo/CHEBI_15891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15892 biolink:ChemicalEntity S-succinylglutathione The S-succinoyl derivative of glutathione. beilstein:2189884|kegg.compound:C03174 Graph L-gamma-glutamyl-S-(3-carboxypropanoyl)-L-cysteinylglycine|S-Succinylglutathione L-gamma-glutamyl-S-(3-carboxypropanoyl)-L-cysteinylglycine L-gamma-glutamyl-S-(3-carboxypropanoyl)-L-cysteinylglycine|S-Succinylglutathione http://purl.obolibrary.org/obo/CHEBI_15892 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15893 biolink:ChemicalEntity 1-pyrroline-5-carboxylate A 1-pyrrolinecarboxylate resulting from the removal of the proton from the carboxy group of 1-pyrroline-5-carboxylic acid. kegg.compound:C04322 Graph 1-pyrroline-5-carboxylate|3,4-dihydro-2H-pyrrole-2-carboxylate 3,4-dihydro-2H-pyrrole-2-carboxylate 1-pyrroline-5-carboxylate|3,4-dihydro-2H-pyrrole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_15893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15894 biolink:ChemicalEntity (2-trans,6-trans)-farnesal beilstein:1723428|cas:502-67-0|kegg.compound:C03461 Graph (2-trans,6-trans)-3,7,11-trimethyldodeca-2,6,10-trienal|(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienal|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienal|(2E,6E)-farnesal|(E,E)-3,7,11-trimethyl-2,6,10-dodecatrienal|2-trans,6-trans-Farnesal|E,E-farnesal|Farnesal|trans,trans-2,6-farnesal|trans,trans-Farnesal|trans-farnesal (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienal (2-trans,6-trans)-3,7,11-trimethyldodeca-2,6,10-trienal|(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienal|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienal|(2E,6E)-farnesal|(E,E)-3,7,11-trimethyl-2,6,10-dodecatrienal|2-trans,6-trans-Farnesal|E,E-farnesal|Farnesal|trans,trans-2,6-farnesal|trans,trans-Farnesal|trans-farnesal http://purl.obolibrary.org/obo/CHEBI_15894 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15895 biolink:ChemicalEntity D-galactono-1,4-lactone A galactonolactone derived from D-galactonic acid. cas:2782-07-2|ecmdb:ECMDB21440|hmdb:HMDB0002541|kegg.compound:C03383|pubmed:1797843|pubmed:20094898|reaxys:83008 Graph 1,4-D-Galactonolactone|D-Galactonic acid, gamma-lactone|D-Galactono-1,4-lactone|D-galactonic acid gamma-lactone|D-galactonic acid, gamma-lactone|D-galactono-1,4-lactone|gamma-D-Galactonolactone D-Galactono-1,4-lactone|D-galactono-1,4-lactone 1,4-D-Galactonolactone|D-Galactonic acid, gamma-lactone|D-Galactono-1,4-lactone|D-galactonic acid gamma-lactone|D-galactonic acid, gamma-lactone|D-galactono-1,4-lactone|gamma-D-Galactonolactone http://purl.obolibrary.org/obo/CHEBI_15895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15896 biolink:ChemicalEntity 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione A seco-androstane that is 9,10-secoandrostane which is substituted by oxo groups at positions 9 and 17 and in which the A-ring is aromatic and bears hydroxy groups at positions 3 and 4. kegg.compound:C04793|lipidmaps:LMST02020062|pdb-ccd:SDT|pubmed:20448045|reaxys:21218726 Graph 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione|3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione|3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione|3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione http://purl.obolibrary.org/obo/CHEBI_15896 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:158966 biolink:ChemicalEntity Arg-Gly-Asp cas:99896-85-2|chemspider:94603 Graph (2S)-2-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid (2S)-2-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid (2S)-2-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid http://purl.obolibrary.org/obo/CHEBI_158966 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:15897 biolink:ChemicalEntity N-(long-chain-acyl)ethanolamine Any N-acylethanolamine in which the acyl group has a chain length of C12 or greater. Graph an N-(long-chain fatty acyl)ethanolamine an N-(long-chain fatty acyl)ethanolamine http://purl.obolibrary.org/obo/CHEBI_15897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15899 biolink:ChemicalEntity (R)-5-diphosphomevalonic acid The 5-diphospho derivative of (R)-mevalonic acid. kegg.compound:C01143|knapsack:C00007615|pdb-ccd:DP6 Graph (3R)-3-hydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}-3-methylpentanoic acid|(R)-5-Diphosphomevalonate|(R)-5-diphosphomevalonate (3R)-3-hydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}-3-methylpentanoic acid (3R)-3-hydroxy-5-{[hydroxy(phosphonooxy)phosphoryl]oxy}-3-methylpentanoic acid|(R)-5-Diphosphomevalonate|(R)-5-diphosphomevalonate http://purl.obolibrary.org/obo/CHEBI_15899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15900 biolink:ChemicalEntity trans-2,3-epoxysuccinic acid The trans-2,3-epoxy derivative of succinic acid. kegg.compound:C03548 Graph rel-(2R,3R)-oxirane-2,3-dicarboxylic acid|trans-2,3-Epoxysuccinate|trans-2,3-epoxysuccinate rel-(2R,3R)-oxirane-2,3-dicarboxylic acid rel-(2R,3R)-oxirane-2,3-dicarboxylic acid|trans-2,3-Epoxysuccinate|trans-2,3-epoxysuccinate http://purl.obolibrary.org/obo/CHEBI_15900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15901 biolink:ChemicalEntity 5,6-dihydrouracil A pyrimidine obtained by formal addition of hydrogen across the 5,6-position of uracil. beilstein:1851498|cas:504-07-4|hmdb:HMDB0000076|kegg.compound:C00429|metacyc.compound:DI-H-URACIL|pdb-ccd:DUC|pubmed:15724255|pubmed:18619742|pubmed:20926004|pubmed:22770225|reaxys:112496|wikipedia.en:Dihydrouracil Graph 2,4(1H,3H)-Pyrimidinedione, dihydro-|2,4-Dioxotetrahydropyrimidine|5,6-Dihydro-2,4-dihydroxypyrimidine|5,6-Dihydrouracil|5,6-dihydrouracil|DIHYDROPYRIMIDINE-2,4(1H,3H)-DIONE|Dihydro-2,4(1H,3H)-pyrimidinedione|Dihydrouracil|Dihydrouracile|Hydrouracil|dihydropyrimidine-2,4(1H,3H)-dione DIHYDROPYRIMIDINE-2,4(1H,3H)-DIONE|dihydropyrimidine-2,4(1H,3H)-dione 2,4(1H,3H)-Pyrimidinedione, dihydro-|2,4-Dioxotetrahydropyrimidine|5,6-Dihydro-2,4-dihydroxypyrimidine|5,6-Dihydrouracil|5,6-dihydrouracil|DIHYDROPYRIMIDINE-2,4(1H,3H)-DIONE|Dihydro-2,4(1H,3H)-pyrimidinedione|Dihydrouracil|Dihydrouracile|Hydrouracil|dihydropyrimidine-2,4(1H,3H)-dione http://purl.obolibrary.org/obo/CHEBI_15901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15902 biolink:ChemicalEntity alpha-D-xylose 1-phosphate A xylose phosphate that is α-D-xylose carrying a phosphate group at position 1. kegg.compound:C03737|metacyc.compound:CPD-490|pdb-ccd:X1P|pubmed:14499574|pubmed:15535798|pubmed:17803683|reaxys:85827 Graph 1-O-phosphono-alpha-D-xylopyranose|alpha-D-Xylose 1-phosphate|alpha-D-xylopyranose 1-(dihydrogen phosphate) alpha-D-xylopyranose 1-(dihydrogen phosphate) 1-O-phosphono-alpha-D-xylopyranose|alpha-D-Xylose 1-phosphate|alpha-D-xylopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15903 biolink:ChemicalEntity beta-D-glucose D-Glucopyranose with β configuration at the anomeric centre. cas:492-61-5|drugbank:DB02379|drugcentral:845|glygen:G71142DF|glytoucan:G71142DF|gmelin:648637|kegg.compound:C00221|pdb-ccd:BGC|pubmed:19443021|pubmed:25568069|pubmed:31537530|pubmed:32568414|reaxys:1281607 Graph BETA-D-GLUCOSE|D-gluco-Hexose|beta-D-Glucose|beta-D-glucopyranose|beta-D-glucose beta-D-glucopyranose BETA-D-GLUCOSE|D-gluco-Hexose|beta-D-Glucose|beta-D-glucopyranose|beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_15903 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15904 biolink:ChemicalEntity long-chain fatty acid A fatty acid with a chain length ranging from C13 to C22. kegg.compound:C00638 Graph Higher fatty acid|LCFA|LCFAs|Long-chain fatty acid|long-chain fatty acids Higher fatty acid|LCFA|LCFAs|Long-chain fatty acid|long-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_15904 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15905 biolink:ChemicalEntity (R)-4'-phosphopantothenic acid An amidoalkyl phosphate that is the 4-phosphate derivative of (R)-pantothenic acid. beilstein:4754999|cas:5875-50-3|kegg.compound:C03492|knapsack:C00019685|pdb-ccd:PAZ|pubmed:19666462 Graph (R)-4'-Phosphopantothenate|(R)-N-(2-hydroxy-3,3-dimethyl-1-oxo-4-(phosphonooxy)butyl)-beta-alanine|3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoic acid|D-4'-Phosphopantothenate|N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanine|phosphopantothenic acid 3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoic acid (R)-4'-Phosphopantothenate|(R)-N-(2-hydroxy-3,3-dimethyl-1-oxo-4-(phosphonooxy)butyl)-beta-alanine|3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanamido]propanoic acid|D-4'-Phosphopantothenate|N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanine|phosphopantothenic acid http://purl.obolibrary.org/obo/CHEBI_15905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15906 biolink:ChemicalEntity demethylmacrocin A macrolide antibiotic that is tylonolide having mono- and diglycosyl moieties attached to two of its hydroxy groups.. kegg.compound:C02400|knapsack:C00018437|metacyc.compound:DEMETHYLMACROCIN Graph 2'''-O-Demethyllactenocin|Demethylmacrocin|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-beta-D-allopyranoside 2'''-O-Demethyllactenocin|Demethylmacrocin|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-beta-D-allopyranoside http://purl.obolibrary.org/obo/CHEBI_15906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15907 biolink:ChemicalEntity phosphoramidic acid cas:2817-45-0|kegg.compound:C02306 Graph Amidophosphoric acid|H2NH2PO3|Phosphoramide|Phosphoramidic acid|[P(NH2)O(OH)2]|amidodihydroxidooxidophosphorus|phosphoramidic acid Phosphoramidic acid|amidodihydroxidooxidophosphorus|phosphoramidic acid Amidophosphoric acid|H2NH2PO3|Phosphoramide|Phosphoramidic acid|[P(NH2)O(OH)2]|amidodihydroxidooxidophosphorus|phosphoramidic acid http://purl.obolibrary.org/obo/CHEBI_15907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15908 biolink:ChemicalEntity L-threonic acid The L-enantiomer of threonic acid. cas:7306-96-9|kegg.compound:C01620|knapsack:C00034314|pubmed:12961869|pubmed:16662405|pubmed:17098753|pubmed:22770225|reaxys:1722841|wikipedia.en:Threonic_acid Graph (2R,3S)-2,3,4-trihydroxybutanoic acid|L-threonic acid (2R,3S)-2,3,4-trihydroxybutanoic acid|L-threonic acid (2R,3S)-2,3,4-trihydroxybutanoic acid|L-threonic acid http://purl.obolibrary.org/obo/CHEBI_15908 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15911 biolink:ChemicalEntity desulfoglucotropeolin A desulfoglucosinolic acid resulting from the formal condensation of the thiol group of N-hydroxy(phenyl)ethanethioamide with β-D-glucopyranose. kegg.compound:C01069|reaxys:39056 Graph 1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose|Desulfoglucotropeolin|desulfoglucotropeolin 1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose 1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose|Desulfoglucotropeolin|desulfoglucotropeolin http://purl.obolibrary.org/obo/CHEBI_15911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15913 biolink:ChemicalEntity (R)-2-hydroxyoctadecanoic acid The (R)-enantiomer of 2-hydroxyoctadecanoic acid. cas:629-22-1|kegg.compound:C03042 Graph (2R)-2-hydroxyoctadecanoic acid|(R)-2-hydroxystearic acid (2R)-2-hydroxyoctadecanoic acid (2R)-2-hydroxyoctadecanoic acid|(R)-2-hydroxystearic acid http://purl.obolibrary.org/obo/CHEBI_15913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15915 biolink:ChemicalEntity ADP-L-glycero-D-manno-heptose An ADP-glycero-D-manno-heptose having L-glycero-configuration at the 6-position of the heptose portion. kegg.compound:C06398 Graph ADP-L-glycero-D-manno-heptose|adenine 5'-[3-(L-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] adenine 5'-[3-(L-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] ADP-L-glycero-D-manno-heptose|adenine 5'-[3-(L-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15915 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15916 biolink:ChemicalEntity serine phosphoethanolamine The O-phosphoethanolamine derivative of serine. pubmed:5636380|pubmed:5705212|pubmed:6244784 Graph O-[(2-aminoethoxy)(hydroxy)phosphoryl]serine|O-[(2-aminoethoxy)hydroxyphosphinyl]serine|serine ethanolamine phosphate|serine phosphoethanolamine O-[(2-aminoethoxy)(hydroxy)phosphoryl]serine O-[(2-aminoethoxy)(hydroxy)phosphoryl]serine|O-[(2-aminoethoxy)hydroxyphosphinyl]serine|serine ethanolamine phosphate|serine phosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_15916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15917 biolink:ChemicalEntity N-(D-glucopyranosyl)nicotinate beilstein:4157144 Graph 1-D-glucopyranosylpyridinium-3-carboxylate|N-glucosylnicotinate 1-D-glucopyranosylpyridinium-3-carboxylate 1-D-glucopyranosylpyridinium-3-carboxylate|N-glucosylnicotinate http://purl.obolibrary.org/obo/CHEBI_15917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15918 biolink:ChemicalEntity 2'-deoxycytosine 5'-monophosphate A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having cytosine as the nucleobase. cas:1032-65-1|drugbank:DB03798|kegg.compound:C00239|pdb-ccd:DCM Graph 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE|2'-Deoxycytidine 5'-monophosphate|2'-deoxy-5'-cytidylic acid|2'-deoxycytosine 5'-monophosphate|Deoxycytidine monophosphate|Deoxycytidylate|Deoxycytidylic acid|dCMP 2'-deoxy-5'-cytidylic acid 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE|2'-Deoxycytidine 5'-monophosphate|2'-deoxy-5'-cytidylic acid|2'-deoxycytosine 5'-monophosphate|Deoxycytidine monophosphate|Deoxycytidylate|Deoxycytidylic acid|dCMP http://purl.obolibrary.org/obo/CHEBI_15918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15919 biolink:ChemicalEntity N(6)-(1,2-dicarboxyethyl)-AMP The N6-(1,2-dicarboxyethyl) derivative of adenosine 5'-monophosphate. cas:19046-78-7|drugbank:DB04418|ecmdb:ECMDB01332|hmdb:HMDB0059653|kegg.compound:C03794|knapsack:C00007229|pdb-ccd:2SA|pubmed:23404497|pubmed:25036129|reaxys:71618|ymdb:YMDB00871 Graph Adenylosuccinate|Adenylosuccinic acid|N-[9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purin-6-yl]aspartic acid|N6-(1,2-Dicarboxyethyl)-AMP|N6-(1,2-dicarboxyethyl)-AMP|aspartyl adenylate N-[9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purin-6-yl]aspartic acid Adenylosuccinate|Adenylosuccinic acid|N-[9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purin-6-yl]aspartic acid|N6-(1,2-Dicarboxyethyl)-AMP|N6-(1,2-dicarboxyethyl)-AMP|aspartyl adenylate http://purl.obolibrary.org/obo/CHEBI_15919 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15920 biolink:ChemicalEntity columbamine cas:3621-36-1|kegg.compound:C01795|knapsack:C00024667 Graph 2-hydroxy-3,9,10-trimethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium|5,6-dihydro-2-hydroxy-3,9,10-trimethoxydibenzo[a,g]quinolizinium|Columbamine|columbamine 2-hydroxy-3,9,10-trimethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium 2-hydroxy-3,9,10-trimethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium|5,6-dihydro-2-hydroxy-3,9,10-trimethoxydibenzo[a,g]quinolizinium|Columbamine|columbamine http://purl.obolibrary.org/obo/CHEBI_15920 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15925 biolink:ChemicalEntity 2-dehydro-3-deoxy-6-phospho-D-gluconic acid The 5-phospho derivative of 2-dehydro-D-gluconic acid. cas:27244-54-8|kegg.compound:C04442|knapsack:C00019434 Graph 2-Dehydro-3-deoxy-6-phospho-D-gluconate|2-Dehydro-3-deoxy-D-gluconate 6-phosphate|2-Keto-3-deoxy-6-phosphogluconate|2-dehydro-3-deoxy-6-phospho-D-gluconate|2-dehydro-3-deoxy-D-gluconate 6-phosphate|2-keto-3-deoxy-6-phosphogluconate|3-Deoxy-D-erythro-hex-2-ulosonic acid 6-phosphate|3-deoxy-6-O-phosphono-D-erythro-hex-2-ulosonic acid|6-Phospho-2-dehydro-3-deoxy-D-gluconate|6-phospho-2-dehydro-3-deoxy-D-gluconate|Kdpg intermediate 3-deoxy-6-O-phosphono-D-erythro-hex-2-ulosonic acid 2-Dehydro-3-deoxy-6-phospho-D-gluconate|2-Dehydro-3-deoxy-D-gluconate 6-phosphate|2-Keto-3-deoxy-6-phosphogluconate|2-dehydro-3-deoxy-6-phospho-D-gluconate|2-dehydro-3-deoxy-D-gluconate 6-phosphate|2-keto-3-deoxy-6-phosphogluconate|3-Deoxy-D-erythro-hex-2-ulosonic acid 6-phosphate|3-deoxy-6-O-phosphono-D-erythro-hex-2-ulosonic acid|6-Phospho-2-dehydro-3-deoxy-D-gluconate|6-phospho-2-dehydro-3-deoxy-D-gluconate|Kdpg intermediate http://purl.obolibrary.org/obo/CHEBI_15925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15926 biolink:ChemicalEntity dolichyl diphosphooligosaccharide kegg.compound:C04213 Graph Dolichyl diphosphooligosaccharide|Oligosaccharide-PP-Dol|Oligosaccharide-diphosphodolichol|dolichyl diphosphooligosaccharides Dolichyl diphosphooligosaccharide|Oligosaccharide-PP-Dol|Oligosaccharide-diphosphodolichol|dolichyl diphosphooligosaccharides http://purl.obolibrary.org/obo/CHEBI_15926 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15927 biolink:ChemicalEntity N-ribosylnicotinamide A pyridine nucleoside consisting of nicotinamide with a β-D-ribofuranosyl moiety at the 1-position. beilstein:3912857|cas:1341-23-7|kegg.compound:C03150|pdb-ccd:NNR|pubmed:15137942|pubmed:17482543|pubmed:18429699|pubmed:22682224 Graph 1-(beta-D-Ribofuranosyl)nicotinamide|3-carbamoyl-1-beta-D-ribofuranosylpyridinium|N-Ribosylnicotinamide|Nicotinamide riboside|beta-nicotinamide D-riboside|nicotinamide ribonucleoside|nicotinamide ribose|nicotinamide-beta-riboside 3-carbamoyl-1-beta-D-ribofuranosylpyridinium 1-(beta-D-Ribofuranosyl)nicotinamide|3-carbamoyl-1-beta-D-ribofuranosylpyridinium|N-Ribosylnicotinamide|Nicotinamide riboside|beta-nicotinamide D-riboside|nicotinamide ribonucleoside|nicotinamide ribose|nicotinamide-beta-riboside http://purl.obolibrary.org/obo/CHEBI_15927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15929 biolink:ChemicalEntity (-)-methyl jasmonate A jasmonate ester that is the methyl ester of jasmonic acid. cas:1211-29-6|hmdb:HMDB0036583|kegg.compound:C11512|knapsack:C00000219|lipidmaps:LMFA02020010|metacyc.compound:CPD1F-2|pubmed:17043086|pubmed:18038760|pubmed:24497113|reaxys:4232548|wikipedia.en:Methyl_jasmonate Graph (-)-Methyl jasmonate|3-oxo-2-(2-pentenyl)cyclopentaneacetic acid methyl ester|Methyl jasmonate|methyl (-)-jasmonate|methyl {(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate methyl {(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate (-)-Methyl jasmonate|3-oxo-2-(2-pentenyl)cyclopentaneacetic acid methyl ester|Methyl jasmonate|methyl (-)-jasmonate|methyl {(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate http://purl.obolibrary.org/obo/CHEBI_15929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15930 biolink:ChemicalEntity atrazine A diamino-1,3,5-triazine that is 1,3,5-triazine-2,4-diamine substituted by a chloro group at position 6 while one of hydrogens of each amino group is replaced respectively by an ethyl and a propan-2-yl group. cas:1912-24-9|drugbank:DB07392|hmdb:HMDB0041830|kegg.compound:C06551|lincs.smallmolecule:LSM-18990|metacyc.compound:ATRAZINE|pdb-ccd:ATZ|ppdb:43|pubmed:24211529|pubmed:24239819|pubmed:24246238|reaxys:612020|umbbd.compound:c0002|wikipedia.en:Atrazine Graph 2-CHLORO-4-ISOPROPYLAMINO-6-ETHYLAMINO-1,3,5-TRIAZINE|2-chloro-4-(ethylamino)-6-(isopropylamino)-1,3,5-triazine|2-chloro-4-ethylamino-6-isopropylamino-1,3,5-triazine|2-chloro-4-ethylamino-6-isopropylamino-s-triazine|2-ethylamino-4-isopropylamino-6-chloro-s-triazine|6-chloro-N-ethyl-N'-(1-methylethyl)-1,3,5-triazine-2,4-diamine|6-chloro-N-ethyl-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine|6-chloro-N-ethyl-N'-isopropyl-1,3,5-triazine-2,4-diamine|Atrazine|atrazine 6-chloro-N-ethyl-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine 2-CHLORO-4-ISOPROPYLAMINO-6-ETHYLAMINO-1,3,5-TRIAZINE|2-chloro-4-(ethylamino)-6-(isopropylamino)-1,3,5-triazine|2-chloro-4-ethylamino-6-isopropylamino-1,3,5-triazine|2-chloro-4-ethylamino-6-isopropylamino-s-triazine|2-ethylamino-4-isopropylamino-6-chloro-s-triazine|6-chloro-N-ethyl-N'-(1-methylethyl)-1,3,5-triazine-2,4-diamine|6-chloro-N-ethyl-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine|6-chloro-N-ethyl-N'-isopropyl-1,3,5-triazine-2,4-diamine|Atrazine|atrazine http://purl.obolibrary.org/obo/CHEBI_15930 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15931 biolink:ChemicalEntity 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-4-O-sulfo-D-galactopyranose A (4-deoxygluc-4-enosyluronic acid)-(1→3)-N-acetyl-D-galactosamine sulfate in which the 4-deoxygluc-4-enosyluronic acid component has β-D configuration. kegg.compound:C04864 Graph 2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 4-sulfate 2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid 2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 4-sulfate http://purl.obolibrary.org/obo/CHEBI_15931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15932 biolink:ChemicalEntity apiin A β-D-glucoside having a β-D-apiosyl residue at the 2-position and a 5,4'-dihydroxyflavon-7-yl moiety at the anomeric position. cas:26544-34-3|hmdb:HMDB0030843|kegg.compound:C04858|knapsack:C00001019|lincs.smallmolecule:LSM-18987|lipidmaps:LMPK12110337|metacyc.compound:7-O-BETA-D-APIOFURANOSYL-12-BETA-D-GLU|patent:CN1284492|patent:CN1413643|pubmed:10722209|pubmed:15813363|pubmed:17637182|pubmed:18553272|pubmed:21834233|reaxys:72966|wikipedia.en:Apiin Graph 5,7,4'-trihydroxyflavone 7-O-[beta-D-apiosyl-(1->2)-beta-D-glucoside]|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-beta-D-glucopyranoside|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 3-C-(hydroxymethyl)-beta-D-glycero-tetrofuranosyl-(1->2)-beta-D-glucopyranoside|7-((2-O-beta-D-Apiofuranosyl-beta-D-glucopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyranone|7-O-(beta-D-Apiofuranosyl-1,2-beta-D-glucosyl)-5,7,4'-trihydroxyflavone|7-[(2-O-D-Apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxy-phenyl)-4H-1-benzopyran-4-one|Apiin|Apioside|apigenin 7-O-[beta-D-apiosyl-(1->2)-beta-D-glucoside] 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-beta-D-glucopyranoside|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 3-C-(hydroxymethyl)-beta-D-glycero-tetrofuranosyl-(1->2)-beta-D-glucopyranoside 5,7,4'-trihydroxyflavone 7-O-[beta-D-apiosyl-(1->2)-beta-D-glucoside]|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-beta-D-glucopyranoside|5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 3-C-(hydroxymethyl)-beta-D-glycero-tetrofuranosyl-(1->2)-beta-D-glucopyranoside|7-((2-O-beta-D-Apiofuranosyl-beta-D-glucopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyranone|7-O-(beta-D-Apiofuranosyl-1,2-beta-D-glucosyl)-5,7,4'-trihydroxyflavone|7-[(2-O-D-Apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxy-phenyl)-4H-1-benzopyran-4-one|Apiin|Apioside|apigenin 7-O-[beta-D-apiosyl-(1->2)-beta-D-glucoside] http://purl.obolibrary.org/obo/CHEBI_15932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15933 biolink:ChemicalEntity UDP-D-apiose A UDP-sugar having D-apiose as the sugar portion. Graph uridine 5'-{3-[3-C-(hydroxymethyl)-D-erythrofuranosyl] dihydrogen diphosphate} uridine 5'-{3-[3-C-(hydroxymethyl)-D-erythrofuranosyl] dihydrogen diphosphate} uridine 5'-{3-[3-C-(hydroxymethyl)-D-erythrofuranosyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_15933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15934 biolink:ChemicalEntity 5-amino-6-(D-ribitylamino)uracil An aminouracil that is D-ribitol in which the hydroxy group at position 1 is substituted by the 6-amino group of 5,6-diaminouracil. Early intermediate in bacterial riboflavin synthesis. cas:17014-74-3|kegg.compound:C04732|metacyc.compound:AMINO-RIBOSYLAMINO-1H-3H-PYR-DIONE|pubmed:11237620|pubmed:15723519|pubmed:23072415|pubmed:24695216|pubmed:9211334|reaxys:33063 Graph 1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-D-ribitol|4-(1-D-Ribitylamino)-5-amino-2,6-dihydroxypyrimidine|5-A-RU|5-Amino-6-(1-D-ribitylamino)uracil|5-Amino-6-ribitylaminouracil|5-amino-2,6-dioxo-4-ribitylaminopyrimidine|5-amino-6-(D-ribitylamino)uracil|5-amino-6-ribitylamino-2,4-(1H,3H)pyrimidinedione|5-arpd|6-(1-D-Ribitylamino)-5-amino-2,4-dihydroxypyrimidine|6-(1-D-Ribitylamino)-5-aminouracil 1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-D-ribitol 1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-D-ribitol|4-(1-D-Ribitylamino)-5-amino-2,6-dihydroxypyrimidine|5-A-RU|5-Amino-6-(1-D-ribitylamino)uracil|5-Amino-6-ribitylaminouracil|5-amino-2,6-dioxo-4-ribitylaminopyrimidine|5-amino-6-(D-ribitylamino)uracil|5-amino-6-ribitylamino-2,4-(1H,3H)pyrimidinedione|5-arpd|6-(1-D-Ribitylamino)-5-amino-2,4-dihydroxypyrimidine|6-(1-D-Ribitylamino)-5-aminouracil http://purl.obolibrary.org/obo/CHEBI_15934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15935 biolink:ChemicalEntity N-acetyl-D-glucosaminylphosphatidylinositol kegg.compound:C01288 Graph 6-(N-Acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol|N-Acetyl-D-glucosaminylphosphatidylinositol|N-acetyl-D-glucosaminylphosphatidylinositols 6-(N-Acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol|N-Acetyl-D-glucosaminylphosphatidylinositol|N-acetyl-D-glucosaminylphosphatidylinositols http://purl.obolibrary.org/obo/CHEBI_15935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15936 biolink:ChemicalEntity aldehydo-D-xylose beilstein:1562108|cas:58-86-6|glytoucan:G01550VL|gmelin:486611|kegg.compound:C00181 Graph (+)-Xylose|(D)-Xylose|D-Xyl|D-Xylose|D-xylo-pentose|D-xylose|Wood sugar|aldehydo-D-xylose D-Xylose|D-xylo-pentose|D-xylose (+)-Xylose|(D)-Xylose|D-Xyl|D-Xylose|D-xylo-pentose|D-xylose|Wood sugar|aldehydo-D-xylose http://purl.obolibrary.org/obo/CHEBI_15936 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15937 biolink:ChemicalEntity trans-5-O-(4-coumaroyl)-D-quinic acid The 5-O-(4-coumaroyl) derivative of (−)-quinic acid. kegg.compound:C12208 Graph (1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohexanecarboxylic acid|p-Coumaroyl quinic acid|trans-5-O-(4-Coumaroyl)-D-quinate|trans-5-O-(4-coumaroyl)-D-quinate (1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohexanecarboxylic acid (1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohexanecarboxylic acid|p-Coumaroyl quinic acid|trans-5-O-(4-Coumaroyl)-D-quinate|trans-5-O-(4-coumaroyl)-D-quinate http://purl.obolibrary.org/obo/CHEBI_15937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15938 biolink:ChemicalEntity pregnan-21-ol kegg.compound:C00892 Graph 5-beta-Pregnan-21-ol|Pregnan-21-ol|pregnan-21-ol Pregnan-21-ol|pregnan-21-ol 5-beta-Pregnan-21-ol|Pregnan-21-ol|pregnan-21-ol http://purl.obolibrary.org/obo/CHEBI_15938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15939 biolink:ChemicalEntity glycyrrhizinic acid A triterpenoid saponin that is the glucosiduronide derivative of 3β-hydroxy-11-oxoolean-12-en-30-oic acid. cas:1405-86-3|drugcentral:1325|hmdb:HMDB0029843|kegg.compound:C02284|lipidmaps:LMPR0106150013|metacyc.compound:GLYCYRRHIZINATE|pubmed:11282481|pubmed:15013279|pubmed:24497916|reaxys:77922|wikipedia.en:Glycyrrhizin Graph (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl-2-O-beta-D-glucopyranuronosyl-alpha-D-glucopyranosiduronic acid|30-hydroxy-11,30-dioxoolean-12-en-3beta-yl (2-O-beta-D-glucopyranosyluronic acid)-alpha-D-glucopyranosiduronic acid|Glycyrrhizic acid|Glycyrrhizin 30-hydroxy-11,30-dioxoolean-12-en-3beta-yl (2-O-beta-D-glucopyranosyluronic acid)-alpha-D-glucopyranosiduronic acid (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl-2-O-beta-D-glucopyranuronosyl-alpha-D-glucopyranosiduronic acid|30-hydroxy-11,30-dioxoolean-12-en-3beta-yl (2-O-beta-D-glucopyranosyluronic acid)-alpha-D-glucopyranosiduronic acid|Glycyrrhizic acid|Glycyrrhizin http://purl.obolibrary.org/obo/CHEBI_15939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15940 biolink:ChemicalEntity nicotinic acid A pyridinemonocarboxylic acid that is pyridine in which the hydrogen at position 3 is replaced by a carboxy group. agr:IND607088605|cas:59-67-6|chemspider:913|drugbank:DB00627|drugcentral:2835|foodb.food:FDB001014|gmelin:3340|hmdb:HMDB0001488|kegg.compound:C00253|kegg.drug:D00049|knapsack:C00000208|lincs.smallmolecule:LSM-4676|metacyc.compound:NIACINE|pdb-ccd:NIO|pubmed:10540864|pubmed:113218|pubmed:12563315|pubmed:12789870|pubmed:135660|pubmed:14550884|pubmed:15037193|pubmed:15183629|pubmed:15205990|pubmed:15311728|pubmed:15627518|pubmed:15651982|pubmed:16018787|pubmed:16172771|pubmed:16322787|pubmed:16400392|pubmed:16449845|pubmed:16767301|pubmed:16877271|pubmed:16945375|pubmed:18037924|pubmed:182198|pubmed:186078|pubmed:18993152|pubmed:18996527|pubmed:19369827|pubmed:19592242|pubmed:19678716|pubmed:19779335|pubmed:20979384|pubmed:21632263|pubmed:22116693|pubmed:22155410|pubmed:22229411|pubmed:22366213|pubmed:22458880|pubmed:22770225|pubmed:24029555|pubmed:24568240|pubmed:24675661|pubmed:24848081|pubmed:24975217|pubmed:25040591|pubmed:25241762|pubmed:25429652|pubmed:32954525|pubmed:33273654|pubmed:33932650|pubmed:34066686|pubmed:34085526|pubmed:34117670|pubmed:4033386|pubmed:4259917|pubmed:582105|pubmed:699281|pubmed:7217784|pubmed:7581845|pubmed:8306147|pubmed:8423912|pubmed:8679452|pubmed:9107536|reaxys:109591|wikipedia.en:Niacin Graph 3-Pyridylcarboxylic acid|3-carboxylpyridine|3-carboxypyridine|3-pyridinecarboxylic acid|NICOTINIC ACID|Niacin|Niacor|Niaspan|Nicotinic acid|Nicotinsaure|Nikotinsaeure|P.P. factor|PP factor|acide nicotinique|acido nicotinico|acidum nicotinicum|anti-pellagra vitamin|beta-pyridinecarboxylic acid|m-pyridinecarboxylic acid|nicotinic acid|pellagra preventive factor|pyridine-3-carboxylic acid|pyridine-beta-carboxylic acid|pyridine-carboxylique-3|vitamin B3 NICOTINIC ACID|Nicotinic acid|nicotinic acid|pyridine-3-carboxylic acid 3-Pyridylcarboxylic acid|3-carboxylpyridine|3-carboxypyridine|3-pyridinecarboxylic acid|NICOTINIC ACID|Niacin|Niacor|Niaspan|Nicotinic acid|Nicotinsaure|Nikotinsaeure|P.P. factor|PP factor|acide nicotinique|acido nicotinico|acidum nicotinicum|anti-pellagra vitamin|beta-pyridinecarboxylic acid|m-pyridinecarboxylic acid|nicotinic acid|pellagra preventive factor|pyridine-3-carboxylic acid|pyridine-beta-carboxylic acid|pyridine-carboxylique-3|vitamin B3 http://purl.obolibrary.org/obo/CHEBI_15940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15941 biolink:ChemicalEntity 2,3-dihydroxy-2,3-dihydrobenzoic acid A cyclohexadienecarboxylic acid having the C=C bonds at the 1- and 3-positions, the carboxylic acid at the 1-position and two hydroxy substituents at the 5- and 6-positions. Graph 5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid 5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid 5,6-dihydroxycyclohexa-1,3-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_15941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15942 biolink:ChemicalEntity 2-aminobenzenesulfonate An aminobenzenesulfonate that is the conjugate base of 2-aminobenzenesulfonic acid. gmelin:329530|kegg.compound:C06333|metacyc.compound:2-AMINOBENZENESULFONATE|reaxys:3906548|umbbd.compound:c0245 Graph 2-aminobenzene-1-sulfonate|2-aminobenzenesulfonate|2-sulfanilate|aniline-2-sulfonate|aniline-o-sulfonate|o-aminobenzenesulfonate|o-aminophenylsulfonate|o-sulfanilate|orthanilate 2-aminobenzenesulfonate 2-aminobenzene-1-sulfonate|2-aminobenzenesulfonate|2-sulfanilate|aniline-2-sulfonate|aniline-o-sulfonate|o-aminobenzenesulfonate|o-aminophenylsulfonate|o-sulfanilate|orthanilate http://purl.obolibrary.org/obo/CHEBI_15942 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15943 biolink:ChemicalEntity poly(glycerol phosphate) macromolecule A homopolymer macromolecule consisting of repeating glycerol-1-phosphate units. cas:52007-79-1|kegg.compound:C02768|pubmed:21388439|pubmed:24533796 Graph (Glycerophosphate)n|(Glycerophosphate)n+1|Poly(glycerol phosphate)|Poly(grop)|Polyglycerolphosphate|alpha-[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]-omega-hydroxypoly[oxy(2-hydroxypropane-1,3-diyl)oxy(hydroxyphosphoryl)]|poly(glycerol phosphate)|poly(glycerol phosphate)s alpha-[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]-omega-hydroxypoly[oxy(2-hydroxypropane-1,3-diyl)oxy(hydroxyphosphoryl)] (Glycerophosphate)n|(Glycerophosphate)n+1|Poly(glycerol phosphate)|Poly(grop)|Polyglycerolphosphate|alpha-[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]-omega-hydroxypoly[oxy(2-hydroxypropane-1,3-diyl)oxy(hydroxyphosphoryl)]|poly(glycerol phosphate)|poly(glycerol phosphate)s http://purl.obolibrary.org/obo/CHEBI_15943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15944 biolink:ChemicalEntity 6-O-methylnorlaudanosoline The 6-O-methyl derivative of norlaudanosoline. beilstein:3625035|cas:64710-33-4|kegg.compound:C05203 Graph 4-[(7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2-diol|6-O-Methylnorlaudanosoline 4-[(7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2-diol 4-[(7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2-diol|6-O-Methylnorlaudanosoline http://purl.obolibrary.org/obo/CHEBI_15944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15945 biolink:ChemicalEntity D-galactono-1,5-lactone A galactonolactone that is the D-enantiomer of galactono-1,5-lactone. cas:15892-28-1|drugbank:DB01885|kegg.compound:C02669|kegg.compound:C15483|pdb-ccd:149|pubmed:5152120 Graph D-Galactono-1,5-lactone|D-Galactono-8-lactone|D-Galactonolactone|D-galactonic acid delta-lactone|D-galactono-1,5-lactone D-Galactono-1,5-lactone|D-galactono-1,5-lactone D-Galactono-1,5-lactone|D-Galactono-8-lactone|D-Galactonolactone|D-galactonic acid delta-lactone|D-galactono-1,5-lactone http://purl.obolibrary.org/obo/CHEBI_15945 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15946 biolink:ChemicalEntity keto-D-fructose 6-phosphate The open chain form of D-fructose 6-phosphate. cas:643-13-0|drugbank:DB04493|hmdb:HMDB0000124|kegg.compound:C00085|metacyc.compound:CPD-15709|pdb-ccd:F6R|pubmed:22833313|pubmed:24380627|reaxys:1728993 Graph D-Fructose 6-phosphate|D-Fructose 6-phosphoric acid|D-fructose 6-(dihydrogen phosphate)|Fructose-6-phosphate|Neuberg ester D-Fructose 6-phosphate|D-fructose 6-(dihydrogen phosphate) D-Fructose 6-phosphate|D-Fructose 6-phosphoric acid|D-fructose 6-(dihydrogen phosphate)|Fructose-6-phosphate|Neuberg ester http://purl.obolibrary.org/obo/CHEBI_15946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15947 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminylamine kegg.compound:C01239 Graph 2-acetamido-2-deoxy-beta-D-glucopyranosylamine|N-Acetyl-beta-D-glucosaminylamine|N-acetyl-beta-D-glucosaminylamine 2-acetamido-2-deoxy-beta-D-glucopyranosylamine 2-acetamido-2-deoxy-beta-D-glucopyranosylamine|N-Acetyl-beta-D-glucosaminylamine|N-acetyl-beta-D-glucosaminylamine http://purl.obolibrary.org/obo/CHEBI_15947 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15948 biolink:ChemicalEntity lycopene An acyclic carotene commonly obtained from tomatoes and other red fruits. cas:502-65-8|drugcentral:4617|hmdb:HMDB0003000|kegg.compound:C05432|knapsack:C00000911|lipidmaps:LMPR01070257|metacyc.compound:CPD1F-114|pdb-ccd:LYC|pubmed:10443333|pubmed:10493308|pubmed:10620348|pubmed:10720168|pubmed:10837319|pubmed:11117277|pubmed:11137891|pubmed:12239422|pubmed:12726756|pubmed:12792623|pubmed:12910307|pubmed:13129444|pubmed:15054415|pubmed:15065899|pubmed:15341191|pubmed:1550343|pubmed:15830922|pubmed:16194683|pubmed:16549453|pubmed:24397737|pubmed:7616301|pubmed:9100211|reaxys:1730097|wikipedia.en:Lycopene Graph (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene|LYCOPENE|Lycopene|all-trans-lycopene|psi,psi-carotene psi,psi-carotene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene|LYCOPENE|Lycopene|all-trans-lycopene|psi,psi-carotene http://purl.obolibrary.org/obo/CHEBI_15948 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15949 biolink:ChemicalEntity diphthamide A quaternary ammonium ion that is the derivative of L-histidine having a 4-amino-4-oxo-3-(trimethylammonio)butyl group at the 2-position of the imidazole ring. cas:75645-22-6|drugbank:DB03223|wikipedia.en:Diphthamide Graph (2S)-1-amino-4-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-N,N,N-trimethyl-1-oxobutan-2-aminium|2-(3-Carboxyamido-3-(trimethylammonio)propyl)histidine|2-[(3R)-3-carbamoyl-3-(trimethylammonio)propyl]-L-histidine|Diphthamide (2S)-1-amino-4-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-N,N,N-trimethyl-1-oxobutan-2-aminium (2S)-1-amino-4-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-N,N,N-trimethyl-1-oxobutan-2-aminium|2-(3-Carboxyamido-3-(trimethylammonio)propyl)histidine|2-[(3R)-3-carbamoyl-3-(trimethylammonio)propyl]-L-histidine|Diphthamide http://purl.obolibrary.org/obo/CHEBI_15949 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15950 biolink:ChemicalEntity (S)-coclaurine The (S)-enantiomer of coclaurine. beilstein:4298111|cas:486-39-5|kegg.compound:C06161|knapsack:C00025812 Graph (1S)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol|(S)-Coclaurine|1-(p-Hydroxybenzyl)-6-methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline|Coclaurine (1S)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (1S)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol|(S)-Coclaurine|1-(p-Hydroxybenzyl)-6-methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline|Coclaurine http://purl.obolibrary.org/obo/CHEBI_15950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15951 biolink:ChemicalEntity 3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one kegg.compound:C07350 Graph 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one|3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one|phlorisovalerophenone 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one|3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one|3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one|phlorisovalerophenone http://purl.obolibrary.org/obo/CHEBI_15951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15952 biolink:ChemicalEntity dTDP-4-amino-4,6-dideoxy-D-glucose The 4-amino-4,6-dideoxy analogue of dTDP-D-glucose. kegg.compound:C04268 Graph dTDP-4-amino-4,6-dideoxy-D-glucose|thymidine 5'-[3-(4-amino-4,6-dideoxy-D-glucopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(4-amino-4,6-dideoxy-D-glucopyranosyl) dihydrogen diphosphate] dTDP-4-amino-4,6-dideoxy-D-glucose|thymidine 5'-[3-(4-amino-4,6-dideoxy-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15953 biolink:ChemicalEntity 6-imino-5-oxocyclohexa-1,3-dienecarboxylic acid A cyclohexadienecarboxylic acid having the C=C double bonds at the 1- and 3-positions, the carboxy group at the 1-position, an oxo group at the 5-position and an imino group at the 6-position. beilstein:4740780|kegg.compound:C04584 Graph 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate|6-imino-5-oxocyclohexa-1,3-diene-1-carboxylic acid 6-imino-5-oxocyclohexa-1,3-diene-1-carboxylic acid 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate|6-imino-5-oxocyclohexa-1,3-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_15953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15954 biolink:ChemicalEntity aldehydo-D-glucose 6-phosphate The open-chain form of D-glucose 6-phosphate. beilstein:1728867|drugbank:DB03581|kegg.compound:C03251|pdb-ccd:G6Q|reaxys:1728867 Graph (2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl dihydrogen phosphate|aldehydo-D-glucose 6-(dihydrogen phosphate) aldehydo-D-glucose 6-(dihydrogen phosphate) (2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl dihydrogen phosphate|aldehydo-D-glucose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15955 biolink:ChemicalEntity discadenine A 6-isopentenylaminopurine having a 3-amino-3-carboxypropyl group attached at the 3-position. agr:IND81078502|cas:69832-12-8|kegg.compound:C01804|pubmed:566219|pubmed:6259120|pubmed:7363945 Graph (2S)-2-amino-4-{6-[(3-methylbut-2-en-1-yl)amino]-3H-purin-3-yl}butanoic acid|3-(3-Amino-3-carboxypropyl)-N6-(delta2-isopentenyl)-adenine|3-(3-amino-3-carboxypropyl)-N6-(delta2)-isopentenyladenine|Discadenine|alpha-amino-6-((3-methyl-2-butenyl)amino)-3H-purine-3-butanoic acid (2S)-2-amino-4-{6-[(3-methylbut-2-en-1-yl)amino]-3H-purin-3-yl}butanoic acid (2S)-2-amino-4-{6-[(3-methylbut-2-en-1-yl)amino]-3H-purin-3-yl}butanoic acid|3-(3-Amino-3-carboxypropyl)-N6-(delta2-isopentenyl)-adenine|3-(3-amino-3-carboxypropyl)-N6-(delta2)-isopentenyladenine|Discadenine|alpha-amino-6-((3-methyl-2-butenyl)amino)-3H-purine-3-butanoic acid http://purl.obolibrary.org/obo/CHEBI_15955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15956 biolink:ChemicalEntity biotin An organic heterobicyclic compound that consists of 2-oxohexahydro-1H-thieno[3,4-d]imidazole having a valeric acid substituent attached to the tetrahydrothiophene ring. The parent of the class of biotins. cas:58-85-5|chemspider:149962|drugbank:DB00121|drugcentral:373|foodb.food:FDB014510|gmelin:1918703|hmdb:HMDB0000030|kegg.compound:C00120|kegg.drug:D00029|knapsack:C00000756|lincs.smallmolecule:LSM-3994|metacyc.compound:BIOTIN|pdb-ccd:BTN|pmc:PMC8089577|pubmed:10064317|pubmed:10215065|pubmed:10577274|pubmed:11435506|pubmed:11481419|pubmed:11800048|pubmed:12055344|pubmed:12070309|pubmed:12603856|pubmed:12803839|pubmed:15012185|pubmed:15202718|pubmed:15272000|pubmed:15690449|pubmed:15863846|pubmed:15899401|pubmed:15992684|pubmed:16011464|pubmed:16195795|pubmed:16419467|pubmed:16676358|pubmed:16677798|pubmed:16704206|pubmed:16769720|pubmed:17297119|pubmed:1814646|pubmed:18202531|pubmed:18452485|pubmed:18509457|pubmed:19212411|pubmed:19319844|pubmed:19727438|pubmed:19928962|pubmed:20967359|pubmed:20974274|pubmed:2100006|pubmed:21248194|pubmed:21356565|pubmed:21373679|pubmed:21596550|pubmed:21871906|pubmed:25515858|pubmed:33346513|pubmed:33461365|pubmed:34077272|pubmed:8333586|pubmed:8750932|pubmed:9022537|pubmed:9038855|pubmed:9094878|pubmed:9164991|pubmed:9176832|pubmed:9371938|pubmed:9416479|reaxys:86838|wikipedia.en:Biotin Graph (+)-cis-Hexahydro-2-oxo-1H-thieno[3,4]imidazole-4-valeric acid|(3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric acid|5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid|5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid|BIOTIN|Coenzyme R|D-(+)-biotin|D-Biotin|Vitamin H|biotin|biotina|biotine|biotinum|cis-(+)-Tetrahydro-2-oxothieno[3,4]imidazoline-4-valeric acid|cis-Hexahydro-2-oxo-1H-thieno(3,4)imidazole-4-valeric acid|cis-Tetrahydro-2-oxothieno(3,4-d)imidazoline-4-valeric acid|vitamin B7 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid (+)-cis-Hexahydro-2-oxo-1H-thieno[3,4]imidazole-4-valeric acid|(3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric acid|5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid|5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid|BIOTIN|Coenzyme R|D-(+)-biotin|D-Biotin|Vitamin H|biotin|biotina|biotine|biotinum|cis-(+)-Tetrahydro-2-oxothieno[3,4]imidazoline-4-valeric acid|cis-Hexahydro-2-oxo-1H-thieno(3,4)imidazole-4-valeric acid|cis-Tetrahydro-2-oxothieno(3,4-d)imidazoline-4-valeric acid|vitamin B7 http://purl.obolibrary.org/obo/CHEBI_15956 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15957 biolink:ChemicalEntity stipitatic acid A derivative of cyclohepta-1,3,5-triene having a carboxy group at position 1, an oxo group at position 5 and hydroxy groups at positions 3 and 6. beilstein:2723909|cas:4440-39-5|kegg.compound:C01853 Graph 3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1-carboxylic acid|Stipitatate|Stipitatic acid 3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1-carboxylic acid 3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1-carboxylic acid|Stipitatate|Stipitatic acid http://purl.obolibrary.org/obo/CHEBI_15957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15958 biolink:ChemicalEntity phosphatidyl-N-methylethanolamine A phosphatidylethanolamine in which the amino group is methylated. kegg.compound:C01241|pubmed:7106822 Graph Phosphatidyl-N-methylethanolamine|phosphatidyl-N-methylethanolamines Phosphatidyl-N-methylethanolamine|phosphatidyl-N-methylethanolamines http://purl.obolibrary.org/obo/CHEBI_15958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15960 biolink:ChemicalEntity O-acetylcarnitinium kegg.compound:C02571 Graph (2R)-2-(acetyloxy)-3-carboxy-N,N,N-trimethylpropan-1-aminium|O-Acetyl-L-carnitine|O-Acetylcarnitine (2R)-2-(acetyloxy)-3-carboxy-N,N,N-trimethylpropan-1-aminium (2R)-2-(acetyloxy)-3-carboxy-N,N,N-trimethylpropan-1-aminium|O-Acetyl-L-carnitine|O-Acetylcarnitine http://purl.obolibrary.org/obo/CHEBI_15960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15961 biolink:ChemicalEntity O-phospho-L-homoserine The L-enantiomer of O-phosphohomoserine. cas:4210-66-6|kegg.compound:C01102|knapsack:C00007385 Graph (2S)-2-amino-4-(phosphonooxy)butanoic acid|Homoserine phosphate|L-Homoserine, dihydrogen phosphate (ester)|O-Phospho-L-homoserine|O-Phosphohomoserine|O-phospho-L-homoserine (2S)-2-amino-4-(phosphonooxy)butanoic acid (2S)-2-amino-4-(phosphonooxy)butanoic acid|Homoserine phosphate|L-Homoserine, dihydrogen phosphate (ester)|O-Phospho-L-homoserine|O-Phosphohomoserine|O-phospho-L-homoserine http://purl.obolibrary.org/obo/CHEBI_15961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15963 biolink:ChemicalEntity ribitol A pentitol (five-carbon sugar alcohol) having meso-configuration, being derived from ribose by reduction of the carbonyl group. It occurs naturally in the plant Adonis vernalis. cas:488-81-3|gmelin:82894|hmdb:HMDB0000508|kegg.compound:C00474|knapsack:C00001171|metacyc.compound:RIBITOL|pubmed:15234337|pubmed:16664320|pubmed:16901854|pubmed:17336832|pubmed:17979222|pubmed:23564164|pubmed:24643482|pubmed:25108762|reaxys:1720524|wikipedia.en:Ribitol Graph (2R,3s,4S)-pentane-1,2,3,4,5-pentol|Adonitol|D-Adonitol|D-Ribitol|L-ribitol|Ribitol|meso-ribitol|ribitol (2R,3s,4S)-pentane-1,2,3,4,5-pentol|meso-ribitol (2R,3s,4S)-pentane-1,2,3,4,5-pentol|Adonitol|D-Adonitol|D-Ribitol|L-ribitol|Ribitol|meso-ribitol|ribitol http://purl.obolibrary.org/obo/CHEBI_15963 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15964 biolink:ChemicalEntity cyclohexylsulfamic acid A member of the class of sulfamic acids that is sulfamic acid carrying an N-cyclohexyl substituent. cas:100-88-9|hmdb:HMDB0031340|kegg.compound:C02824|kegg.drug:D02442|pubmed:23559823|pubmed:4199201|pubmed:973466|reaxys:2208885|umbbd.compound:c0689|wikipedia.en:Cyclamic_acid Graph Cyclohexylamide sulfate|Cyclohexylsulfamate|Cyclohexylsulfamic acid|Cylamic acid|cyclohexylaminesulphonic acid|cyclohexylsulfamic acid Cyclohexylsulfamate|Cyclohexylsulfamic acid|cyclohexylsulfamic acid Cyclohexylamide sulfate|Cyclohexylsulfamate|Cyclohexylsulfamic acid|Cylamic acid|cyclohexylaminesulphonic acid|cyclohexylsulfamic acid http://purl.obolibrary.org/obo/CHEBI_15964 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15965 biolink:ChemicalEntity D-hexose phosphate Any mono-phosphorylated D-hexose having a chain of six carbon atoms in the molecule. kegg.compound:C02672 Graph D-Hexose phosphate D-Hexose phosphate http://purl.obolibrary.org/obo/CHEBI_15965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15966 biolink:ChemicalEntity D-glutamic acid An optically active form of glutamic acid having D-configuration. cas:6893-26-1|drugbank:DB02517|gmelin:201189|hmdb:HMDB0003339|kegg.compound:C00217|knapsack:C00019577|metacyc.compound:D-GLT|pdb-ccd:DGL|reaxys:1723800 Graph (2R)-2-aminopentanedioic acid|(R)-2-aminopentanedioic acid|D-2-Aminoglutaric acid|D-Glutamic acid|D-Glutaminic acid|D-Glutaminsaeure|D-glutamic acid|DGL|glutamic acid D-form (2R)-2-aminopentanedioic acid|D-Glutamic acid|D-glutamic acid (2R)-2-aminopentanedioic acid|(R)-2-aminopentanedioic acid|D-2-Aminoglutaric acid|D-Glutamic acid|D-Glutaminic acid|D-Glutaminsaeure|D-glutamic acid|DGL|glutamic acid D-form http://purl.obolibrary.org/obo/CHEBI_15966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15967 biolink:ChemicalEntity thioredoxin dithiol cas:52500-60-4|kegg.compound:C00342 Graph Reduced thioredoxin|Thioredoxin Reduced thioredoxin|Thioredoxin http://purl.obolibrary.org/obo/CHEBI_15967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15968 biolink:ChemicalEntity 3-guanidinopropanoic acid A guanidine compound bearing an N-(2-carboxyethyl) substituent. It is a creatine analogue that has been found to decreases plasma glucose levels cas:353-09-3|hmdb:HMDB0013222|kegg.compound:C03065|pubmed:19358571|pubmed:23326362|pubmed:7491263|pubmed:7900770|reaxys:1705262|wikipedia.en:Guanidinopropionic_acid Graph 3-Guanidinopropanoate|3-carbamimidamidopropanoic acid|N-[amino(imino)methyl]-beta-alanine|beta-GPA|beta-guanidinopropionic acid 3-carbamimidamidopropanoic acid 3-Guanidinopropanoate|3-carbamimidamidopropanoic acid|N-[amino(imino)methyl]-beta-alanine|beta-GPA|beta-guanidinopropionic acid http://purl.obolibrary.org/obo/CHEBI_15968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15970 biolink:ChemicalEntity O-carbamoyl-L-serine A non-proteinogenic L-α-amino acid that is the O-carbamoyl derivative of L-serine. cas:2105-23-9|kegg.compound:C03015 Graph (2S)-2-amino-3-(carbamoyloxy)propanoic acid|O-Carbamoyl-L-serine|O-carbamoyl-L-serine (2S)-2-amino-3-(carbamoyloxy)propanoic acid|O-Carbamoyl-L-serine|O-carbamoyl-L-serine (2S)-2-amino-3-(carbamoyloxy)propanoic acid|O-Carbamoyl-L-serine|O-carbamoyl-L-serine http://purl.obolibrary.org/obo/CHEBI_15970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15971 biolink:ChemicalEntity L-histidine The L-enantiomer of the amino acid histidine. cas:71-00-1|drugbank:DB00117|ecmdb:ECMDB00177|gmelin:83042|hmdb:HMDB0000177|kegg.compound:C00135|kegg.drug:D00032|knapsack:C00001363|metacyc.compound:HIS|pdb-ccd:HIS|pubmed:15206581|pubmed:21608102|pubmed:21719207|pubmed:22324399|pubmed:22415677|pubmed:22517640|reaxys:84088|wikipedia.en:L-histidine|ymdb:YMDB00369 Graph (2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|(S)-4-(2-Amino-2-carboxyethyl)imidazole|(S)-alpha-Amino-1H-imidazole-4-propionic acid|(S)-alpha-amino-1H-Imidazole-4-propanoic acid|H|HISTIDINE|His|L-(-)-histidine|L-Histidin|L-Histidine|L-histidine (2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|L-Histidine|L-histidine (2S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|(S)-4-(2-Amino-2-carboxyethyl)imidazole|(S)-alpha-Amino-1H-imidazole-4-propionic acid|(S)-alpha-amino-1H-Imidazole-4-propanoic acid|H|HISTIDINE|His|L-(-)-histidine|L-Histidin|L-Histidine|L-histidine http://purl.obolibrary.org/obo/CHEBI_15971 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15972 biolink:ChemicalEntity dTDP-4-amino-4,6-dideoxy-D-galactose The 4-amino-4,6-dideoxy analogue of dTDP-D-galactose. Graph thymidine 5'-[3-(4-amino-4,6-dideoxy-D-galactopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(4-amino-4,6-dideoxy-D-galactopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(4-amino-4,6-dideoxy-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_15972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15975 biolink:ChemicalEntity 1D-5-O-methyl-myo-inositol A member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2S,3r,4R,5S,6r-stereoisomer). cas:523-92-2|kegg.compound:C03365|knapsack:C00001172|pubmed:12880325|reaxys:2043787 Graph (1R,2S,3r,4R,5S,6r)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-5-O-Methyl-myo-inositol|1D-5-O-methyl-myo-inositol|5-O-Methyl-myo-inositol|Sequoyitol 1D-5-O-Methyl-myo-inositol|1D-5-O-methyl-myo-inositol (1R,2S,3r,4R,5S,6r)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-5-O-Methyl-myo-inositol|1D-5-O-methyl-myo-inositol|5-O-Methyl-myo-inositol|Sequoyitol http://purl.obolibrary.org/obo/CHEBI_15975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15976 biolink:ChemicalEntity 3-indoleglycolaldehyde kegg.compound:C03230 Graph 3-Indoleglycolaldehyde|3-indoleglycolaldehyde|3-indolylglycolaldehyde|hydroxy(1H-indol-3-yl)acetaldehyde hydroxy(1H-indol-3-yl)acetaldehyde 3-Indoleglycolaldehyde|3-indoleglycolaldehyde|3-indolylglycolaldehyde|hydroxy(1H-indol-3-yl)acetaldehyde http://purl.obolibrary.org/obo/CHEBI_15976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15977 biolink:ChemicalEntity cyclohex-2-enone A cyclohexenone having its C=C double bond at the 2-position. agr:IND500890908|cas:930-68-7|gmelin:2792|kegg.compound:C02395|metacyc.compound:CPD-282|pdb-ccd:A2Q|pubmed:10435317|pubmed:11380545|pubmed:11923299|pubmed:12240358|pubmed:15816743|pubmed:17705547|pubmed:18384020|pubmed:24563324|pubmed:24954722|pubmed:27037735|pubmed:28260378|pubmed:28422498|pubmed:29048164|pubmed:29611891|pubmed:30290292|pubmed:31590101|pubmed:32345013|pubmed:33595902|pubmed:8828923|reaxys:1280477 Graph 1-cyclohexen-3-one|2-Cyclohexen-1-one|2-cyclohexen-1-one|2-cyclohexenone|3-oxocyclohexene|Cyclohex-2-enone|cyclohex-2-en-1-one|cyclohex-2-enone|cyclohexen-3-one cyclohex-2-en-1-one 1-cyclohexen-3-one|2-Cyclohexen-1-one|2-cyclohexen-1-one|2-cyclohexenone|3-oxocyclohexene|Cyclohex-2-enone|cyclohex-2-en-1-one|cyclohex-2-enone|cyclohexen-3-one http://purl.obolibrary.org/obo/CHEBI_15977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15978 biolink:ChemicalEntity sn-glycerol 3-phosphate An sn-glycerol 3-phosphate having unsubstituted hydroxy groups. cas:17989-41-2|kegg.compound:C00093|knapsack:C00007288|metacyc.compound:GLYCEROL-3P|pdb-ccd:G3P|pdb-ccd:GP9|pubmed:16745347|pubmed:1694860|pubmed:19049970|reaxys:1723975 Graph (2R)-2,3-dihydroxypropyl dihydrogen phosphate|(R)-glycerol 1-phosphate|D-(glycerol 1-phosphate)|D-Glycerol 1-phosphate|Glycerol-3-phosphate|Glycerophosphoric acid|L-(glycerol 3-phosphate)|Phosphorsaeure-mono-((R)-2,3-dihydroxy-propylester)|SN-GLYCEROL-3-PHOSPHATE|phosphoric acid mono-((R)-2,3-dihydroxy-propyl) ester|sn-Glycerol 3-phosphate|sn-Gro-1-P|sn-glycerol 3-(dihydrogen phosphate) (2R)-2,3-dihydroxypropyl dihydrogen phosphate|sn-Glycerol 3-phosphate|sn-glycerol 3-(dihydrogen phosphate) (2R)-2,3-dihydroxypropyl dihydrogen phosphate|(R)-glycerol 1-phosphate|D-(glycerol 1-phosphate)|D-Glycerol 1-phosphate|Glycerol-3-phosphate|Glycerophosphoric acid|L-(glycerol 3-phosphate)|Phosphorsaeure-mono-((R)-2,3-dihydroxy-propylester)|SN-GLYCEROL-3-PHOSPHATE|phosphoric acid mono-((R)-2,3-dihydroxy-propyl) ester|sn-Glycerol 3-phosphate|sn-Gro-1-P|sn-glycerol 3-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_15978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15979 biolink:ChemicalEntity 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline A benzyltetrahydroisoquinoline having the benzyl group at the 1-position and an N-methyl substituent. beilstein:178433|beilstein:84966|kegg.compound:C05314 Graph 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline|N-Methyl-(R,S)-tetrahydrobenzylisoquinoline|N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline|N-methyl-1-benzyl-1,2,3,4-tetrahydroisoquinoline 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline|N-Methyl-(R,S)-tetrahydrobenzylisoquinoline|N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline|N-methyl-1-benzyl-1,2,3,4-tetrahydroisoquinoline http://purl.obolibrary.org/obo/CHEBI_15979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15980 biolink:ChemicalEntity (R)-pantoate drugbank:DB01930|kegg.compound:C00522|pdb-ccd:PAF Graph (2R)-2,4-dihydroxy-3,3-dimethylbutanoate|(R)-Pantoate|(R)-pantoate|PANTOATE (2R)-2,4-dihydroxy-3,3-dimethylbutanoate (2R)-2,4-dihydroxy-3,3-dimethylbutanoate|(R)-Pantoate|(R)-pantoate|PANTOATE http://purl.obolibrary.org/obo/CHEBI_15980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15981 biolink:ChemicalEntity heparan sulfate alpha-D-glucosaminide 3-sulfate A heparan sulfate having an 3-O-sulfo-α-D-glucosaminyl residue at the non-reducing end. The heparan sulfate part consists of a variably sulfated repeating disaccharide unit. kegg.compound:C11553 Graph [Heparan sulfate]-glucosamine 3-sulfate [Heparan sulfate]-glucosamine 3-sulfate http://purl.obolibrary.org/obo/CHEBI_15981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15982 biolink:ChemicalEntity cob(I)alamin A cobalamin in which the central cobalt atom has an oxidation state of +1. cas:18534-66-2|gmelin:887721|kegg.compound:C00853 Graph Cob(I)alamin|Vitamin B12s|cob(I)alamin|vitamin B-12s Cob(I)alamin|cob(I)alamin Cob(I)alamin|Vitamin B12s|cob(I)alamin|vitamin B-12s http://purl.obolibrary.org/obo/CHEBI_15982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15983 biolink:ChemicalEntity ferrocytochrome Any cytochrome containing a ferroheme. kegg.compound:C00924 Graph Ferrocytochrome Ferrocytochrome http://purl.obolibrary.org/obo/CHEBI_15983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15984 biolink:ChemicalEntity N-(4-nitrophenyl)-3-oxovalidamine kegg.compound:C03995 Graph (2R,3R,5S,6S)-2,6-dihydroxy-3-(hydroxymethyl)-5-[(4-nitrophenyl)amino]cyclohexanone|4-Nitrophenyl-3-ketovalidamine|4-nitrophenyl-3-ketovalidamine|N-(4-Nitrophenyl)-3-ketovalidamine|p-Nitrophenyl-3-ketovalidamine (2R,3R,5S,6S)-2,6-dihydroxy-3-(hydroxymethyl)-5-[(4-nitrophenyl)amino]cyclohexanone (2R,3R,5S,6S)-2,6-dihydroxy-3-(hydroxymethyl)-5-[(4-nitrophenyl)amino]cyclohexanone|4-Nitrophenyl-3-ketovalidamine|4-nitrophenyl-3-ketovalidamine|N-(4-Nitrophenyl)-3-ketovalidamine|p-Nitrophenyl-3-ketovalidamine http://purl.obolibrary.org/obo/CHEBI_15984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15986 biolink:ChemicalEntity polynucleotide A nucleobase-containing molecular entity with a polymeric structure comprised of a linear sequence of 13 or more nucleotide residues. kegg.compound:C00419 Graph Polynucleotide|polynucleotides Polynucleotide|polynucleotides http://purl.obolibrary.org/obo/CHEBI_15986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15987 biolink:ChemicalEntity trithionate(2-) cas:15579-17-6|gmelin:142337|kegg.compound:C01861 Graph (O3S.S.SO3)2-|2,2,4,4-tetraoxido-1,5-dioxy-2,3,4-trisulfy-[5]catenate(2-)|Trithionat|Trithionate|[O3SSSO3](2-)|[S3O6](2-)|trithionate 2,2,4,4-tetraoxido-1,5-dioxy-2,3,4-trisulfy-[5]catenate(2-)|Trithionate|trithionate (O3S.S.SO3)2-|2,2,4,4-tetraoxido-1,5-dioxy-2,3,4-trisulfy-[5]catenate(2-)|Trithionat|Trithionate|[O3SSSO3](2-)|[S3O6](2-)|trithionate http://purl.obolibrary.org/obo/CHEBI_15987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15989 biolink:ChemicalEntity L-methionine S-oxide residue kegg.compound:C03895 Graph L-methionine S-oxide residue|Protein L-methionine S-oxide L-methionine S-oxide residue|Protein L-methionine S-oxide http://purl.obolibrary.org/obo/CHEBI_15989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15992 biolink:ChemicalEntity 1-hydroxy-2-naphthoate A hydroxy monocarboxylic acid anion that is the conjugate base of 1-hydroxy-2-naphthoic acid. gmelin:332420|kegg.compound:C03203|reaxys:3906464|umbbd.compound:c0438 Graph 1-hydroxy-2-naphthoate|1-hydroxy-2-naphthoate(1-) 1-hydroxy-2-naphthoate 1-hydroxy-2-naphthoate|1-hydroxy-2-naphthoate(1-) http://purl.obolibrary.org/obo/CHEBI_15992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15993 biolink:ChemicalEntity N-acyl-D-glucosamine 6-phosphate An N-acyl-D-glucosamine phosphate having the phosphate group placed at the 6-position. kegg.compound:C04136 Graph N-Acyl-D-glucosamine 6-phosphate|N-acyl-D-glucosamine 6-phosphates N-Acyl-D-glucosamine 6-phosphate|N-acyl-D-glucosamine 6-phosphates http://purl.obolibrary.org/obo/CHEBI_15993 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15996 biolink:ChemicalEntity GTP beilstein:1201437|beilstein:74004|cas:86-01-1|drugbank:DB04137|kegg.compound:C00044|knapsack:C00007223|pdb-ccd:GTP|pubmed:24904988 Graph 5'-GTP|GTP|GUANOSINE-5'-TRIPHOSPHATE|Guanosine 5'-triphosphate|H4gtp|guanosine 5'-(tetrahydrogen triphosphate)|guanosine 5'-triphosphoric acid|guanosine triphosphate guanosine 5'-(tetrahydrogen triphosphate) 5'-GTP|GTP|GUANOSINE-5'-TRIPHOSPHATE|Guanosine 5'-triphosphate|H4gtp|guanosine 5'-(tetrahydrogen triphosphate)|guanosine 5'-triphosphoric acid|guanosine triphosphate http://purl.obolibrary.org/obo/CHEBI_15996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15997 biolink:ChemicalEntity 2-methylpropanamine An alkylamine having isobutyl as the alkyl group. It has been isolated from Sambucus nigra (Elderberry). cas:78-81-9|gmelin:81862|hmdb:HMDB0034198|kegg.compound:C02787|metacyc.compound:CPD-630|pdb-ccd:IBN|pubmed:2620174|reaxys:385626|wikipedia.en:Isobutylamine Graph 1-Amino-2-methylpropane|2-Methyl-1-Aminopropane|2-Methyl-1-propanamine|2-Methylpropanamine|2-Methylpropylamine|2-methyl-1-propanamine|2-methylpropanamine|3-Methyl-2-propylamine|I-Butylamine|IBA|Isobutylamine|Monoisobutylamine|Valamine|iso-Butylamine|iso-C4H9NH2 2-Methylpropanamine|2-methylpropanamine 1-Amino-2-methylpropane|2-Methyl-1-Aminopropane|2-Methyl-1-propanamine|2-Methylpropanamine|2-Methylpropylamine|2-methyl-1-propanamine|2-methylpropanamine|3-Methyl-2-propylamine|I-Butylamine|IBA|Isobutylamine|Monoisobutylamine|Valamine|iso-Butylamine|iso-C4H9NH2 http://purl.obolibrary.org/obo/CHEBI_15997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15998 biolink:ChemicalEntity (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl trihydrogen diphosphate A 7,8-dihydropterin having a diphosphomethyl substituent at the 6-position. beilstein:8397629|cas:3545-84-4|kegg.compound:C04807|pubmed:10426953|wikipedia.en:2-Amino-4-hydroxy-6-pyrophosphoryl-methylpteridine Graph (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl trihydrogen diphosphate|2-Amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)pteridine|2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine diphosphate|2-amino-4-hydroxy-6-pyrophosphoryl-methylpteridine|7,8-Dihydropterin pyrophosphate|Pteridine diphosphate (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl trihydrogen diphosphate (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl trihydrogen diphosphate|2-Amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)pteridine|2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine diphosphate|2-amino-4-hydroxy-6-pyrophosphoryl-methylpteridine|7,8-Dihydropterin pyrophosphate|Pteridine diphosphate http://purl.obolibrary.org/obo/CHEBI_15998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:15999 biolink:ChemicalEntity 4-hydroxyphenylpyruvic acid A 2-oxo monocarboxylic acid that is pyruvic acid in which one of the methyl hydrogens is substituted by a 4-hydroxyphenyl group. cas:156-39-8|drugbank:DB07718|hmdb:HMDB0000707|kegg.compound:C01179|knapsack:C00007512|metacyc.compound:P-HYDROXY-PHENYLPYRUVATE|pdb-ccd:ENO|pubmed:11073718|pubmed:9106023|reaxys:2691632|wikipedia.en:4-Hydroxyphenylpyruvic_acid Graph (4-hydroxyphenyl)pyruvic acid|(p-hydroxyphenyl)pyruvic acid|3-(4-HYDROXY-PHENYL)PYRUVIC ACID|3-(4-hydroxyphenyl)-2-oxopropanoic acid|3-(4-hydroxyphenyl)pyruvic acid|3-(p-hydroxyphenyl)-2-oxopropanoic acid|4-hydroxy alpha-oxobenzenepropanoic acid|4-hydroxyphenylpyruvic acid|p-Hydroxyphenylpyruvic acid 3-(4-hydroxyphenyl)-2-oxopropanoic acid (4-hydroxyphenyl)pyruvic acid|(p-hydroxyphenyl)pyruvic acid|3-(4-HYDROXY-PHENYL)PYRUVIC ACID|3-(4-hydroxyphenyl)-2-oxopropanoic acid|3-(4-hydroxyphenyl)pyruvic acid|3-(p-hydroxyphenyl)-2-oxopropanoic acid|4-hydroxy alpha-oxobenzenepropanoic acid|4-hydroxyphenylpyruvic acid|p-Hydroxyphenylpyruvic acid http://purl.obolibrary.org/obo/CHEBI_15999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:160 biolink:ChemicalEntity D-erythro-isocitric acid The D-erythro-stereoisomer of isocitric acid. cas:30810-51-6|kegg.compound:C04617|reaxys:1727946 Graph (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-D-erythro-pentaric acid|D-erythro-Isocitric acid (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-D-erythro-pentaric acid (1S,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid|3-carboxy-2,3-dideoxy-D-erythro-pentaric acid|D-erythro-Isocitric acid http://purl.obolibrary.org/obo/CHEBI_160 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16000 biolink:ChemicalEntity ethanolamine A member of the class of ethanolamines that is ethane with an amino substituent at C-1 and a hydroxy substituent at C-2, making it both a primary amine and a primary alcohol. cas:141-43-5|drugbank:DB03994|gmelin:1650|hmdb:HMDB0000149|kegg.compound:C00189|kegg.drug:D05074|knapsack:C00007279|pdb-ccd:ETA|pubmed:10930630|pubmed:12834252|pubmed:15149650|pubmed:24023812|pubmed:3654008|pubmed:6196640|pubmed:6708049|reaxys:505944|umbbd.compound:c0594|wikipedia.en:Ethanolamine Graph 1-amino-2-hydroxyethane|2-Amino-ethanol|2-Hydroxyethylamine|2-amino-1-ethanol|2-aminoethan-1-ol|2-aminoethanol|2-aminoethyl alcohol|Aethanolamin|Aminoethanol|ETA|Ethanolamine|Hea|MEA|MONOETHANOLAMINE|beta-aminoethanol|beta-aminoethyl alcohol|beta-ethanolamine|beta-hydroxyethylamine|colamine|glycinol|monoethanolamine 2-aminoethanol 1-amino-2-hydroxyethane|2-Amino-ethanol|2-Hydroxyethylamine|2-amino-1-ethanol|2-aminoethan-1-ol|2-aminoethanol|2-aminoethyl alcohol|Aethanolamin|Aminoethanol|ETA|Ethanolamine|Hea|MEA|MONOETHANOLAMINE|beta-aminoethanol|beta-aminoethyl alcohol|beta-ethanolamine|beta-hydroxyethylamine|colamine|glycinol|monoethanolamine http://purl.obolibrary.org/obo/CHEBI_16000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16001 biolink:ChemicalEntity 3-phospho-D-glyceroyl dihydrogen phosphate The (R)-enantiomer of 3-phosphoglyceroyl dihydrogen phosphate. cas:38168-82-0|kegg.compound:C00236|knapsack:C00019552|pdb-ccd:X15 Graph (2R)-2-hydroxy-1-oxopropane-1,3-diyl bis(dihydrogen phosphate)|(R)-2-Hydroxy-3-(phosphonooxy)-1-monoanhydride with phosphoric propanoic acid|1,3-Bisphospho-D-glycerate|3-Phospho-D-glyceroyl phosphate (2R)-2-hydroxy-1-oxopropane-1,3-diyl bis(dihydrogen phosphate) (2R)-2-hydroxy-1-oxopropane-1,3-diyl bis(dihydrogen phosphate)|(R)-2-Hydroxy-3-(phosphonooxy)-1-monoanhydride with phosphoric propanoic acid|1,3-Bisphospho-D-glycerate|3-Phospho-D-glyceroyl phosphate http://purl.obolibrary.org/obo/CHEBI_16001 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16002 biolink:ChemicalEntity D-glucaric acid The D-enantiomer of glucaric acid. cas:87-73-0|gmelin:604332|hmdb:HMDB0029881|kegg.compound:C00818|metacyc.compound:D-GLUCARATE|pubmed:18384797|pubmed:21269605|pubmed:24333274|reaxys:1728113|wikipedia.en:Saccharic_acid Graph (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid|D-(+)-saccharic acid|D-Glucaric acid|D-Glucosaccharic acid|D-Saccharic acid|D-glucaric acid|Glucaric acid|L-Gularic acid|saccharic acid (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid|D-Glucaric acid|D-glucaric acid (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid|D-(+)-saccharic acid|D-Glucaric acid|D-Glucosaccharic acid|D-Saccharic acid|D-glucaric acid|Glucaric acid|L-Gularic acid|saccharic acid http://purl.obolibrary.org/obo/CHEBI_16002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16004 biolink:ChemicalEntity (R)-lactate An optically active form of lactate having (R)-configuration. gmelin:362716|kegg.compound:C00256|metacyc.compound:D-LACTATE|reaxys:4655978 Graph (2R)-2-hydroxypropanoate|(R)-lactate|D-2-hydroxypropanoate|D-2-hydroxypropionate|D-lactate (2R)-2-hydroxypropanoate (2R)-2-hydroxypropanoate|(R)-lactate|D-2-hydroxypropanoate|D-2-hydroxypropionate|D-lactate http://purl.obolibrary.org/obo/CHEBI_16004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16005 biolink:ChemicalEntity methylarsonate(2-) gmelin:324080|kegg.compound:C07294|umbbd.compound:c0752 Graph MeAsO3(2-)|[As(CH3)O3](2-)|methylarsonate methylarsonate MeAsO3(2-)|[As(CH3)O3](2-)|methylarsonate http://purl.obolibrary.org/obo/CHEBI_16005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16007 biolink:ChemicalEntity methanethiol cas:74-93-1|kegg.compound:C00409|knapsack:C00001258|pdb-ccd:MEE|umbbd.compound:c0238 Graph Methanethiol|Methylmercaptan|methanethiol Methanethiol|Methylmercaptan|methanethiol http://purl.obolibrary.org/obo/CHEBI_16007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16008 biolink:ChemicalEntity salicylaldehyde A hydroxybenzaldehyde carrying a hydroxy substituent at position 2. cas:90-02-8|gmelin:3273|hmdb:HMDB0034170|kegg.compound:C06202|metacyc.compound:SALICYLALDEHYDE|pdb-ccd:NK|pubmed:18247142|pubmed:23379671|pubmed:23715243|reaxys:471388|umbbd.compound:c0337|wikipedia.en:Salicylaldehyde Graph 2-Hydroxybenzaldehyde|2-hydroxybenzaldehyde|Salicylaldehyd|Salicylaldehyde|Salizylaldehyd|o-Hydroxybenzaldehyde|o-formylphenol|salicylal|salicylaldehyde 2-hydroxybenzaldehyde 2-Hydroxybenzaldehyde|2-hydroxybenzaldehyde|Salicylaldehyd|Salicylaldehyde|Salizylaldehyd|o-Hydroxybenzaldehyde|o-formylphenol|salicylal|salicylaldehyde http://purl.obolibrary.org/obo/CHEBI_16008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16009 biolink:ChemicalEntity 9-riburonosyladenine A purine nucleoside having adenine as the nucleobase and a carboxy group at C-5'. beilstein:627742|cas:3415-09-6 Graph 1-(6-amino-9H-purin-9-yl)-1-deoxy-beta-D-ribofuranuronic acid|9-Riburonosyladenine|9-beta-D-ribofuranuronosyl-9H-purin-6-amine|9-beta-D-ribofuranuronosyladenine|Ado-5'-COOH|adenosine 5'-carboxylic acid|adenosine-5'-carboxylic acid 9-beta-D-ribofuranuronosyladenine 1-(6-amino-9H-purin-9-yl)-1-deoxy-beta-D-ribofuranuronic acid|9-Riburonosyladenine|9-beta-D-ribofuranuronosyl-9H-purin-6-amine|9-beta-D-ribofuranuronosyladenine|Ado-5'-COOH|adenosine 5'-carboxylic acid|adenosine-5'-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16010 biolink:ChemicalEntity 5-oxoproline An oxoproline having the oxo group placed at the 5-position. It is an intermediate metabolite in the glutathione cycle. cas:149-87-1|pubmed:17439666|pubmed:22770225|pubmed:23217740|reaxys:82131|wikipedia.en:Pyroglutamic_acid Graph 2-pyrrolidone-5-carboxylic acid|5-OXOPROLINE|5-Oxoproline|5-Pyrrolidone-2-carboxylic acid|5-oxo-DL-proline|5-oxoproline|5-oxopyrrolidine-2-carboxylic acid|Glp|Pyroglutamate|Pyroglutamic acid 5-OXOPROLINE|5-Oxoproline|5-oxoproline|5-oxopyrrolidine-2-carboxylic acid 2-pyrrolidone-5-carboxylic acid|5-OXOPROLINE|5-Oxoproline|5-Pyrrolidone-2-carboxylic acid|5-oxo-DL-proline|5-oxoproline|5-oxopyrrolidine-2-carboxylic acid|Glp|Pyroglutamate|Pyroglutamic acid http://purl.obolibrary.org/obo/CHEBI_16010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16011 biolink:ChemicalEntity 2-ethylhexan-1-ol A primary alcohol that is hexan-1-ol substituted by an ethyl group at position 2. cas:104-76-7|hmdb:HMDB0031231|kegg.compound:C02498|pubmed:22520499|pubmed:24529788|pubmed:24716585|reaxys:1719280|wikipedia.en:2-Ethylhexanol Graph 2-Ethyl-1-hexanol|2-Ethylhexan-1-ol|2-ethyl-1-hexanol|2-ethylhexan-1-ol 2-Ethylhexan-1-ol|2-ethylhexan-1-ol 2-Ethyl-1-hexanol|2-Ethylhexan-1-ol|2-ethyl-1-hexanol|2-ethylhexan-1-ol http://purl.obolibrary.org/obo/CHEBI_16011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:160129 biolink:ChemicalEntity 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline A 1,2,3,4-tetrahydroisoquinoline hacing chloro substituents at the 7- and 8-positions. beilstein:1567923|cas:61563-24-4|drugbank:DB08550|pdb-ccd:SKA Graph 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline 7,8-dichloro-1,2,3,4-tetrahydroisoquinoline http://purl.obolibrary.org/obo/CHEBI_160129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16013 biolink:ChemicalEntity 5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene beilstein:1326783|kegg.compound:C04606 Graph 1-(2,2'-bithien-5-yl)but-1-yne-3,4-diyl diacetate|5-(3,4-Diacetoxybut-1-ynyl)-2,2'-bithiophene|5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene 1-(2,2'-bithien-5-yl)but-1-yne-3,4-diyl diacetate 1-(2,2'-bithien-5-yl)but-1-yne-3,4-diyl diacetate|5-(3,4-Diacetoxybut-1-ynyl)-2,2'-bithiophene|5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene http://purl.obolibrary.org/obo/CHEBI_16013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16015 biolink:ChemicalEntity L-glutamic acid An optically active form of glutamic acid having L-configuration. bpdb:2297|cas:56-86-0|drugbank:DB00142|drugcentral:1310|gmelin:3502|hmdb:HMDB0000148|kegg.compound:C00025|kegg.drug:D00007|knapsack:C00001358|lincs.smallmolecule:LSM-36375|metacyc.compound:GLT|pdb-ccd:GLU_LFOH|pubmed:15739367|pubmed:15930465|pubmed:16719819|pubmed:16892196|pubmed:19581495|pubmed:22219301|pubmed:22735334|reaxys:1723801|wikipedia.en:L-Glutamic_Acid Graph (2S)-2-aminopentanedioic acid|(S)-2-aminopentanedioic acid|(S)-glutamic acid|E|GLUTAMIC ACID|Glu|Glutamate|L-Glu|L-Glutamic acid|L-Glutaminic acid|L-Glutaminsaeure|L-glutamic acid|acide glutamique|acido glutamico|acidum glutamicum|glutamic acid (2S)-2-aminopentanedioic acid|GLUTAMIC ACID|L-Glutamic acid|L-glutamic acid (2S)-2-aminopentanedioic acid|(S)-2-aminopentanedioic acid|(S)-glutamic acid|E|GLUTAMIC ACID|Glu|Glutamate|L-Glu|L-Glutamic acid|L-Glutaminic acid|L-Glutaminsaeure|L-glutamic acid|acide glutamique|acido glutamico|acidum glutamicum|glutamic acid http://purl.obolibrary.org/obo/CHEBI_16015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16016 biolink:ChemicalEntity dihydroxyacetone A ketotriose consisting of acetone bearing hydroxy substituents at positions 1 and 3. The simplest member of the class of ketoses and the parent of the class of glycerones. cas:96-26-4|drugbank:DB01775|hmdb:HMDB0001882|kegg.compound:C00184|kegg.drug:D07841|metacyc.compound:DIHYDROXYACETONE|pdb-ccd:2HA|pubmed:20936361|pubmed:21549029|pubmed:21598406|pubmed:23543734|pubmed:23554234|pubmed:23748086|pubmed:24209782|reaxys:1740268|wikipedia.en:Dihydroxyacetone Graph 1,3-Dihydroxy-2-propanone|1,3-Dihydroxyacetone|1,3-Dihydroxydimethyl ketone|1,3-Dihydroxypropan-2-one|1,3-Dihydroxypropanone|1,3-dihydroxypropan-2-one|1,3-propanediol-2-one|Bis(hydroxymethyl) ketone|DHA|DIHYDROXYACETONE|Dihydroxyacetone|Glycerone|alpha,alpha'-dihydroxyacetone|dihydroxyacetone 1,3-Dihydroxypropan-2-one|1,3-dihydroxypropan-2-one 1,3-Dihydroxy-2-propanone|1,3-Dihydroxyacetone|1,3-Dihydroxydimethyl ketone|1,3-Dihydroxypropan-2-one|1,3-Dihydroxypropanone|1,3-dihydroxypropan-2-one|1,3-propanediol-2-one|Bis(hydroxymethyl) ketone|DHA|DIHYDROXYACETONE|Dihydroxyacetone|Glycerone|alpha,alpha'-dihydroxyacetone|dihydroxyacetone http://purl.obolibrary.org/obo/CHEBI_16016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16019 biolink:ChemicalEntity prenol cas:556-82-1|kegg.compound:C01390|kegg.compound:C17628 Graph 3-Methyl-2-buten-1-ol|3-methyl-2-buten-1-ol|3-methylbut-2-en-1-ol|Prenol|prenol 3-methylbut-2-en-1-ol 3-Methyl-2-buten-1-ol|3-methyl-2-buten-1-ol|3-methylbut-2-en-1-ol|Prenol|prenol http://purl.obolibrary.org/obo/CHEBI_16019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16020 biolink:ChemicalEntity 1-methyladenosine A methyladenosine carrying a methyl substituent at position 1. cas:15763-06-1|hmdb:HMDB0003331|kegg.compound:C02494|metacyc.compound:1-METHYLADENOSINE|pubmed:24177150|pubmed:24367489|pubmed:8434538|reaxys:42832 Graph 1-Methyladenosine|1-methyladenosine|m1a 1-Methyladenosine|1-methyladenosine 1-Methyladenosine|1-methyladenosine|m1a http://purl.obolibrary.org/obo/CHEBI_16020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16021 biolink:ChemicalEntity oleandomycin 2'-O-phosphate The 2'-O-phospho derivative of oleandomycin. kegg.compound:C03796 Graph (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-2-O-phosphono-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside|Oleandomycin 2'-O-phosphate (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-2-O-phosphono-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-2-O-phosphono-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside|Oleandomycin 2'-O-phosphate http://purl.obolibrary.org/obo/CHEBI_16021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16022 biolink:ChemicalEntity CDP-ribitol A nucleotide-alditol having cytosine as the nucleobase and ribitol as the alditol portion. cas:3506-17-0|kegg.compound:C00789|metacyc.compound:CPD-1111 Graph CDP 5-ester with D-ribitol|CDP-L-ribitol|CDPribitol|Cdp ribitol|Cytidine 5'-(trihydrogen diphosphate), P'-5-ester with D-ribitol|Cytidine diphosphate ribitol|cytidine 5'-{3-[(2R,3S,4S)-2,3,4,5-tetrahydroxypentyl] dihydrogen diphosphate} cytidine 5'-{3-[(2R,3S,4S)-2,3,4,5-tetrahydroxypentyl] dihydrogen diphosphate} CDP 5-ester with D-ribitol|CDP-L-ribitol|CDPribitol|Cdp ribitol|Cytidine 5'-(trihydrogen diphosphate), P'-5-ester with D-ribitol|Cytidine diphosphate ribitol|cytidine 5'-{3-[(2R,3S,4S)-2,3,4,5-tetrahydroxypentyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_16022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16023 biolink:ChemicalEntity D-erythrulose beilstein:1721313|cas:496-55-9|kegg.compound:C02022 Graph (3R)-1,3,4-trihydroxybutan-2-one|D-Erythrulose|D-erythrulose|D-glycero-Tetrulose|D-glycero-tetrulose (3R)-1,3,4-trihydroxybutan-2-one|D-Erythrulose|D-erythrulose|D-glycero-Tetrulose|D-glycero-tetrulose (3R)-1,3,4-trihydroxybutan-2-one|D-Erythrulose|D-erythrulose|D-glycero-Tetrulose|D-glycero-tetrulose http://purl.obolibrary.org/obo/CHEBI_16023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16024 biolink:ChemicalEntity D-mannose A mannose with D-configuration. Graph D-manno-hexose|D-mannose D-manno-hexose|D-mannose D-manno-hexose|D-mannose http://purl.obolibrary.org/obo/CHEBI_16024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:160246 biolink:ChemicalEntity aminophenazone A pyrazolone that is 1,2-dihydro-3H-pyrazol-3-one substituted by a dimethylamino group at position 4, methyl groups at positions 1 and 5 and a phenyl group at position 2. It exhibits analgesic, anti-inflammatory, and antipyretic properties. cas:58-15-1|drugbank:DB01424|drugcentral:171|gmelin:103164|hmdb:HMDB0015493|kegg.compound:C07539|kegg.drug:D00556|lincs.smallmolecule:LSM-20000|pubmed:23603897|pubmed:23727364|pubmed:24428683|reaxys:222626|wikipedia.en:Aminophenazone Graph (Dimethylamino)phenazone|1,5-Dimethyl-4-dimethylamino-2-phenyl-3-pyrazolone|1-Phenyl-2,3-dimethyl-4-(dimethylamino)-5-pyrazolone|1-Phenyl-2,3-dimethyl-4-dimethylaminopyrazol-5-one|2,3-Dimethyl-4-dimethylamino-1-phenyl-5-pyrazolone|3-Keto-1,5-dimethyl-4-dimethylamino-2-phenyl-2,3-dihydropyrazole|4-(Dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one|4-(Dimethylamino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one|4-(Dimethylamino)antipyrine|4-(dimethylamino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one|4-Dimethylamino-1-phenyl-2,3-dimethylpyrazolone|4-Dimethylamino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one|4-Dimethylamino-2,3-dimethyl-1-phenyl-5-pyrazolone|4-Dimethylaminoantipyrine|4-Dimethylaminophenazone|Aminofenazone|Aminophenazon|Aminopyrine|Dimethylaminoantipyrine|Dimethylaminoazophene|Dimethylaminophenazon|Dimethylaminophenazone|Dimethylaminophenyldimethylpyrazolone|Dipyrine|aminofenazona|aminophenazone|aminophenazonum 4-(dimethylamino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one (Dimethylamino)phenazone|1,5-Dimethyl-4-dimethylamino-2-phenyl-3-pyrazolone|1-Phenyl-2,3-dimethyl-4-(dimethylamino)-5-pyrazolone|1-Phenyl-2,3-dimethyl-4-dimethylaminopyrazol-5-one|2,3-Dimethyl-4-dimethylamino-1-phenyl-5-pyrazolone|3-Keto-1,5-dimethyl-4-dimethylamino-2-phenyl-2,3-dihydropyrazole|4-(Dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one|4-(Dimethylamino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one|4-(Dimethylamino)antipyrine|4-(dimethylamino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one|4-Dimethylamino-1-phenyl-2,3-dimethylpyrazolone|4-Dimethylamino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one|4-Dimethylamino-2,3-dimethyl-1-phenyl-5-pyrazolone|4-Dimethylaminoantipyrine|4-Dimethylaminophenazone|Aminofenazone|Aminophenazon|Aminopyrine|Dimethylaminoantipyrine|Dimethylaminoazophene|Dimethylaminophenazon|Dimethylaminophenazone|Dimethylaminophenyldimethylpyrazolone|Dipyrine|aminofenazona|aminophenazone|aminophenazonum http://purl.obolibrary.org/obo/CHEBI_160246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16026 biolink:ChemicalEntity LL-2,6-diaminopimelic acid A 2,6-diaminopimelic acid in which both chiral centres have S configuration. It is a component of bacterial cell wall. cas:14289-34-0|hmdb:HMDB0001370|kegg.compound:C00666|knapsack:C00007596|lipidmaps:LMFA01170102|reaxys:1726901 Graph (2S,6S)-2,6-diaminoheptanedioic acid|(S,S)-2,6-diaminopimelic acid|(S-(R*,R*))-2,6-diaminoheptanedioic acid|L,L-2,6-diaminopimelic acid|LL-2,6-Diaminoheptanedioate|LL-2,6-Diaminopimelate|LL-2,6-Diaminopimelic acid (2S,6S)-2,6-diaminoheptanedioic acid (2S,6S)-2,6-diaminoheptanedioic acid|(S,S)-2,6-diaminopimelic acid|(S-(R*,R*))-2,6-diaminoheptanedioic acid|L,L-2,6-diaminopimelic acid|LL-2,6-Diaminoheptanedioate|LL-2,6-Diaminopimelate|LL-2,6-Diaminopimelic acid http://purl.obolibrary.org/obo/CHEBI_16026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16027 biolink:ChemicalEntity adenosine 5'-monophosphate A purine ribonucleoside 5'-monophosphate having adenine as the nucleobase. cas:61-19-8|drugbank:DB00131|drugcentral:92|gmelin:38561|hmdb:HMDB0000045|kegg.compound:C00020|kegg.drug:D02769|knapsack:C00019347|lincs.smallmolecule:LSM-5914|metacyc.compound:AMP|pdb-ccd:AMP|pubmed:11307758|pubmed:12020809|pubmed:12181610|pubmed:15148540|pubmed:15946677|pubmed:16091942|pubmed:16250233|pubmed:16295522|pubmed:17439666|pubmed:22215671|pubmed:22624049|pubmed:2559771|reaxys:54612|wikipedia.en:Adenylic_acid Graph 5'-AMP|5'-Adenosine monophosphate|5'-Adenylic acid|5'-O-phosphonoadenosine|5'-adenylic acid|ADENOSINE MONOPHOSPHATE|AMP|Adenosine 5'-monophosphate|Adenosine 5'-phosphate|Adenosine-5'-monophosphoric acid|Adenylate|Adenylic acid|Ado5'P|PAdo|adenosine 5'-(dihydrogen phosphate)|adenosine phosphate|adenosine-5'P|adenosini phosphas|fosfato de adenosina|pA|phosphate d'adenosine 5'-Adenylic acid|5'-adenylic acid 5'-AMP|5'-Adenosine monophosphate|5'-Adenylic acid|5'-O-phosphonoadenosine|5'-adenylic acid|ADENOSINE MONOPHOSPHATE|AMP|Adenosine 5'-monophosphate|Adenosine 5'-phosphate|Adenosine-5'-monophosphoric acid|Adenylate|Adenylic acid|Ado5'P|PAdo|adenosine 5'-(dihydrogen phosphate)|adenosine phosphate|adenosine-5'P|adenosini phosphas|fosfato de adenosina|pA|phosphate d'adenosine http://purl.obolibrary.org/obo/CHEBI_16027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16028 biolink:ChemicalEntity L-2,4-diaminobutyrate An L-α-amino-acid anion that is the conjugate base of L-2,4-diaminobutyric acid, arising from deprotonation of the carboxy group. drugbank:DB03817 Graph (2S)-2,4-diaminobutanoate|L-2,4-diaminobutyrate anion|L-2,4-diaminobutyrate(1-) (2S)-2,4-diaminobutanoate (2S)-2,4-diaminobutanoate|L-2,4-diaminobutyrate anion|L-2,4-diaminobutyrate(1-) http://purl.obolibrary.org/obo/CHEBI_16028 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16029 biolink:ChemicalEntity N(alpha),N(alpha)-dimethyl-L-histidine The Nα,Nα-dimethyl derivative of L-histidine. cas:24940-57-6|kegg.compound:C04259|metacyc.compound:NALPHANALPHA-DIMETHYL-L-HISTIDINE|pubmed:5438052|reaxys:3607906 Graph (2S)-2-(dimethylamino)-3-(1H-imidazol-4-yl)propanoic acid|N,N-dimethyl-L-histidine|Nalpha,Nalpha-Dimethyl-L-histidine (2S)-2-(dimethylamino)-3-(1H-imidazol-4-yl)propanoic acid|N,N-dimethyl-L-histidine (2S)-2-(dimethylamino)-3-(1H-imidazol-4-yl)propanoic acid|N,N-dimethyl-L-histidine|Nalpha,Nalpha-Dimethyl-L-histidine http://purl.obolibrary.org/obo/CHEBI_16029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16030 biolink:ChemicalEntity acyldolichol Dolichol esterified at the terminal hydroxy group. kegg.compound:C01884 Graph Acyldolichol|acyldolichol|acyldolichols Acyldolichol|acyldolichol|acyldolichols http://purl.obolibrary.org/obo/CHEBI_16030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16031 biolink:ChemicalEntity indole-3-acetamide A member of the class of indoles that is acetamide substituted by a 1H-indol-3-yl group at position 2. It is an intermediate in the production of plant hormone indole acetic acid (IAA). cas:879-37-8|hmdb:HMDB0029739|kegg.compound:C02693|knapsack:C00000108|metacyc.compound:CPD-237|pdb-ccd:TSR|pubmed:22079545|pubmed:22210218|pubmed:22447967|pubmed:23306880|pubmed:23521653|pubmed:24350783|reaxys:143368 Graph 1H-indole-3-acetamide|2-(1H-indol-3-yl)acetamide|3-indoleacetamide|Indole-3-acetamide|indole-3-acetamide|indoleacetamide 2-(1H-indol-3-yl)acetamide 1H-indole-3-acetamide|2-(1H-indol-3-yl)acetamide|3-indoleacetamide|Indole-3-acetamide|indole-3-acetamide|indoleacetamide http://purl.obolibrary.org/obo/CHEBI_16031 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16034 biolink:ChemicalEntity phosphoguanidinoacetic acid A guanidinoacetate having a phospho group attached to the primary amino part of the guanidine moiety. kegg.compound:C03166 Graph (N'-phosphonocarbamimidamido)acetic acid|(N'-phosphonoguanidino)acetic acid|Guanidinoacetate phosphate|N-[imino(phosphonoamino)methyl]glycine|Phosphoguanidinoacetate|phosphoguanidoacetate N-[imino(phosphonoamino)methyl]glycine (N'-phosphonocarbamimidamido)acetic acid|(N'-phosphonoguanidino)acetic acid|Guanidinoacetate phosphate|N-[imino(phosphonoamino)methyl]glycine|Phosphoguanidinoacetate|phosphoguanidoacetate http://purl.obolibrary.org/obo/CHEBI_16034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16035 biolink:ChemicalEntity 2'-hydroxy-2,3-dihydrodaidzein A hydroxyisoflavanone that is 2,3-dihydrodaidzein with an additonal hydroxy substituent at position 2'. kegg.compound:C03567|knapsack:C00009535|metacyc.compound:2-HYDROXY-23-DIHYDRODAIDZEIN|pubmed:2306102|reaxys:5586737 Graph 2',4',7-trihydroxyisoflavanone|2'-Hydroxy-2,3-dihydrodaidzein|2'-Hydroxydihydrodaidzein|2'-hydroxy-2,3-dihydrodaidzein|3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-4H-chromen-4-one 3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-4H-chromen-4-one 2',4',7-trihydroxyisoflavanone|2'-Hydroxy-2,3-dihydrodaidzein|2'-Hydroxydihydrodaidzein|2'-hydroxy-2,3-dihydrodaidzein|3-(2,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-4H-chromen-4-one http://purl.obolibrary.org/obo/CHEBI_16035 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16036 biolink:ChemicalEntity ethyl (S)-3-hydroxyhexanoate The (S)-enantiomer of ethyl 3-hydroxyhexanoate. kegg.compound:C03865|reaxys:5242430 Graph Ethyl (S)-3-hydroxyhexanoate|ethyl (3S)-3-hydroxyhexanoate|ethyl (S)-3-hydroxyhexanoate ethyl (3S)-3-hydroxyhexanoate Ethyl (S)-3-hydroxyhexanoate|ethyl (3S)-3-hydroxyhexanoate|ethyl (S)-3-hydroxyhexanoate http://purl.obolibrary.org/obo/CHEBI_16036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16037 biolink:ChemicalEntity 2-nitropropane A secondary nitroalkane that is propane in which a hydrogen at position 2 has been replaced by a nitro group. Mainly used as a solvent (b.p. 120°C). cas:79-46-9|kegg.compound:C02116|metacyc.compound:CPD-244|pdb-ccd:NIS|pubmed:1934149|pubmed:21860502|pubmed:22319232|pubmed:25892624|reaxys:1740684|umbbd.compound:c0555|wikipedia.en:2-Nitropropane Graph 2-Nitropropane|2-nitropropane|dimethylnitromethane|i-C3H7NO2|isonitropropane|sec-nitropropane 2-Nitropropane|2-nitropropane 2-Nitropropane|2-nitropropane|dimethylnitromethane|i-C3H7NO2|isonitropropane|sec-nitropropane http://purl.obolibrary.org/obo/CHEBI_16037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16038 biolink:ChemicalEntity phosphatidylethanolamine A class of glycerophospholipids in which a phosphatidyl group is esterified to the hydroxy group of ethanolamine. drugbank:DB04327|hmdb:HMDB0060501|kegg.compound:C00350|lipidmaps:LMGP02010000|pubmed:10540156|pubmed:11042504|pubmed:11159918|pubmed:11829744|pubmed:12139474|pubmed:15653902|pubmed:16037249|pubmed:16303767|pubmed:16620109|pubmed:18034796|pubmed:18259190|pubmed:18398168|pubmed:18462396|pubmed:18570887|pubmed:18957134|pubmed:19393163|pubmed:23354482|pubmed:23369752|pubmed:23543734|pubmed:3196084|pubmed:7980848|wikipedia.en:Phosphatidylethanolamine Graph (3-Phosphatidyl)-ethanolamine|(3-Phosphatidyl)ethanolamine|1,2-diacyl-sn-glycero-3-phosphoethanolamine|1-Acyl-2-acyl-sn-glycero-3-phosphoethanolamine|Cephalin|O-(1-beta-Acyl-2-acyl-sn-glycero-3-phospho)ethanolamine|PE|Phosphatidylethanolamine|PtdEtn|phosphatidyl(amino)ethanols|phosphatidylethanolamines phosphatidyl(amino)ethanols|phosphatidylethanolamines (3-Phosphatidyl)-ethanolamine|(3-Phosphatidyl)ethanolamine|1,2-diacyl-sn-glycero-3-phosphoethanolamine|1-Acyl-2-acyl-sn-glycero-3-phosphoethanolamine|Cephalin|O-(1-beta-Acyl-2-acyl-sn-glycero-3-phospho)ethanolamine|PE|Phosphatidylethanolamine|PtdEtn|phosphatidyl(amino)ethanols|phosphatidylethanolamines http://purl.obolibrary.org/obo/CHEBI_16038 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16039 biolink:ChemicalEntity ITP The inosine phosphate that has a triphosphate group at the 5'-position. It is an intermediate in the metabolism of purine. cas:132-06-9|ecmdb:ECMDB00189|hmdb:HMDB0000189|kegg.compound:C00081|metacyc.compound:ITP|pdb-ccd:ITT|pubmed:170291|pubmed:20601097|pubmed:24227841|reaxys:600524|ymdb:YMDB00559 Graph 2'-inosine-5'-triphosphate|ITP|Inosine 5'-triphosphate|Inosine triphosphate|Inosine tripolyphosphate|O(5')-(tetrahydroxytriphosphoryl)inosine|inosine 5'-(tetrahydrogen triphosphate) inosine 5'-(tetrahydrogen triphosphate) 2'-inosine-5'-triphosphate|ITP|Inosine 5'-triphosphate|Inosine triphosphate|Inosine tripolyphosphate|O(5')-(tetrahydroxytriphosphoryl)inosine|inosine 5'-(tetrahydrogen triphosphate) http://purl.obolibrary.org/obo/CHEBI_16039 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1604 biolink:ChemicalEntity 3-methylguanine A methylguanine carrying the methyl substituent at position 3. cas:2958-98-7|hmdb:HMDB0001566|kegg.compound:C02230|pubmed:9069642 Graph 3-Methylguanine 3-Methylguanine http://purl.obolibrary.org/obo/CHEBI_1604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16040 biolink:ChemicalEntity cytosine An aminopyrimidine that is pyrimidin-2-one having the amino group located at position 4. cas:71-30-7|gmelin:82472|hmdb:HMDB0000630|kegg.compound:C00380|knapsack:C00001498|metacyc.compound:CYTOSINE|pdb-ccd:CYT|pubmed:14253484|pubmed:22770225|pubmed:7877593|reaxys:2637|wikipedia.en:Cytosine Graph 4-amino-2(1H)-pyrimidinone|4-amino-2-hydroxypyrimidine|4-aminopyrimidin-2(1H)-one|C|Cyt|Cytosin|Cytosine|Zytosin|cytosine 4-aminopyrimidin-2(1H)-one 4-amino-2(1H)-pyrimidinone|4-amino-2-hydroxypyrimidine|4-aminopyrimidin-2(1H)-one|C|Cyt|Cytosin|Cytosine|Zytosin|cytosine http://purl.obolibrary.org/obo/CHEBI_16040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16042 biolink:ChemicalEntity halide anion A monoatomic monoanion resulting from the addition of an electron to any halogen atom. kegg.compound:C00462 Graph HX|Halide|a halide anion|halide anions|halide ions|halide(1-)|halides|halogen anion halide ions HX|Halide|a halide anion|halide anions|halide ions|halide(1-)|halides|halogen anion http://purl.obolibrary.org/obo/CHEBI_16042 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16044 biolink:ChemicalEntity L-methionine residue kegg.compound:C03023|pdb-ccd:MET_LL|resid:AA0013 Graph -Met-|L-methionine|L-methionine residue|L-methionyl|M|Met|Protein L-methionine L-methionine -Met-|L-methionine|L-methionine residue|L-methionyl|M|Met|Protein L-methionine http://purl.obolibrary.org/obo/CHEBI_16044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16047 biolink:ChemicalEntity Lys-tRNA(Lys) kegg.compound:C01931 Graph L-Lysyl-tRNA|L-Lysyl-tRNA(Lys)|Lys-tRNA(Lys) L-Lysyl-tRNA|L-Lysyl-tRNA(Lys)|Lys-tRNA(Lys) http://purl.obolibrary.org/obo/CHEBI_16047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16048 biolink:ChemicalEntity FMNH2 The reduced 1,5-dihydro form of flavin mononucleotide. cas:5666-16-0|hmdb:HMDB0001142|kegg.compound:C01847|metacyc.compound:FMNH2|pubmed:22770225|reaxys:1234695 Graph 1,5-dihydroriboflavin 5'-(dihydrogen phosphate)|1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol|FMNH|FMNH2|Reduced FMN|flavin mononucleotide (reduced) 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol 1,5-dihydroriboflavin 5'-(dihydrogen phosphate)|1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol|FMNH|FMNH2|Reduced FMN|flavin mononucleotide (reduced) http://purl.obolibrary.org/obo/CHEBI_16048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16049 biolink:ChemicalEntity CDP-abequose A CDP-sugar having abequose as the sugar component. Graph cytidine 5'-[3-(3,6-dideoxy-D-xylo-hexopyranosyl) dihydrogen diphosphate] cytidine 5'-[3-(3,6-dideoxy-D-xylo-hexopyranosyl) dihydrogen diphosphate] cytidine 5'-[3-(3,6-dideoxy-D-xylo-hexopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16049 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16050 biolink:ChemicalEntity N-acetylisatin An indoledione consisting of isatin carrying an N-acetyl substituent. cas:574-17-4|kegg.compound:C02172|pubmed:10086325|pubmed:17378546|pubmed:1763945|reaxys:144609 Graph 1-Acetyl-indole-2,3-dione|1-Acetylisatin|1-acetyl-1H-indole-2,3-dione|Acetylisatin|N-Acetylisatin|N-acetylisatin 1-acetyl-1H-indole-2,3-dione 1-Acetyl-indole-2,3-dione|1-Acetylisatin|1-acetyl-1H-indole-2,3-dione|Acetylisatin|N-Acetylisatin|N-acetylisatin http://purl.obolibrary.org/obo/CHEBI_16050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16051 biolink:ChemicalEntity poly(ribitol phosphate) A polymeric compound composed of repeating ribose-1-phosphate units. cas:51584-96-4|kegg.compound:C00653|kegg.glycan:G10558 Graph (Ribitol phosphate)n|(Ribitol phosphate)n+1|Poly(ribitol phosphate)|Poly-1,5-ribitol phosphate|Polyribitol phosphate|Polyribose-ribitol phosphate|Polyribosylribitolphosphate|poly{[(1S,2S,3R)-1,2,3-trihydroxybutane-1,4-diyl]oxy(hydroxyphosphoryl)oxy} poly{[(1S,2S,3R)-1,2,3-trihydroxybutane-1,4-diyl]oxy(hydroxyphosphoryl)oxy} (Ribitol phosphate)n|(Ribitol phosphate)n+1|Poly(ribitol phosphate)|Poly-1,5-ribitol phosphate|Polyribitol phosphate|Polyribose-ribitol phosphate|Polyribosylribitolphosphate|poly{[(1S,2S,3R)-1,2,3-trihydroxybutane-1,4-diyl]oxy(hydroxyphosphoryl)oxy} http://purl.obolibrary.org/obo/CHEBI_16051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16052 biolink:ChemicalEntity propene An alkene that is propane with a double bond at position 1. cas:115-07-1|gmelin:852|kegg.compound:C11505|metacyc.compound:PROPENE|pubmed:24242248|pubmed:24504669|reaxys:1696878|umbbd.compound:c0067|wikipedia.en:Propene Graph 1-propene|1-propylene|CH2=CH-CH3|Propene|R-1270|methylethene|methylethylene|prop-1-ene|propene|propylene prop-1-ene 1-propene|1-propylene|CH2=CH-CH3|Propene|R-1270|methylethene|methylethylene|prop-1-ene|propene|propylene http://purl.obolibrary.org/obo/CHEBI_16052 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16053 biolink:ChemicalEntity 1beta,3beta,4alpha-p-menthane-3,8-diol beilstein:2498244|beilstein:5240317|cas:91739-72-9|knapsack:C00000148 Graph (-)-3,8-p-Menthanediol|(1R,2R,5R)-2-(1-hydroxy-1-methylethyl)-5-methylcyclohexanol|(1R,2R,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol|(1R,3R,4R)-2-hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol|(1R,3R,4R)-p-menthane-3,8-diol|1,4-menthane-3,8-diol (1R,2R,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol (-)-3,8-p-Menthanediol|(1R,2R,5R)-2-(1-hydroxy-1-methylethyl)-5-methylcyclohexanol|(1R,2R,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol|(1R,3R,4R)-2-hydroxy-alpha,alpha,4-trimethylcyclohexanemethanol|(1R,3R,4R)-p-menthane-3,8-diol|1,4-menthane-3,8-diol http://purl.obolibrary.org/obo/CHEBI_16053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16054 biolink:ChemicalEntity 2-benzylsuccinic acid A dicarboxylic acid consisting of succinic acid carrying a 2-benzyl substituent. cas:884-33-3|kegg.compound:C09816|pubmed:12058935|pubmed:1610173|pubmed:4735879|reaxys:1966188|umbbd.compound:c0340 Graph (phenylmethyl)butanedioic acid|2-benzylbutanedioic acid|Benzylsuccinate|D,L-Benzylsuccinic Acid|alpha-benzylsuccinic acid|benzylsuccinic acid|beta-carboxybenzenebutanoic acid 2-benzylbutanedioic acid (phenylmethyl)butanedioic acid|2-benzylbutanedioic acid|Benzylsuccinate|D,L-Benzylsuccinic Acid|alpha-benzylsuccinic acid|benzylsuccinic acid|beta-carboxybenzenebutanoic acid http://purl.obolibrary.org/obo/CHEBI_16054 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16057 biolink:ChemicalEntity prenyl diphosphate A prenol phosphate that is a phosphoantigen comprising the O-pyrophosphate of prenol. beilstein:1713791|cas:358-72-5|drugbank:DB01785|kegg.compound:C00235|kegg.compound:C17627|knapsack:C00007294|lipidmaps:LMPR01010001|pdb-ccd:DMA|pubmed:10608778|pubmed:11355861|pubmed:22300296|pubmed:23262281|pubmed:27356974|reaxys:1713791 Graph 2-Isopentenyl diphosphate|3,3-dimethylallyl pyrophosphate|3-methylbut-2-en-1-yl trihydrogen diphosphate|3-methylbut-2-enyl phosphono hydrogen phosphate|DIMETHYLALLYL DIPHOSPHATE|DMAPP|Dimethylallyl diphosphate|Dimethylallyl pyrophosphate|Monoprenyl diphosphate|Prenol pyrophosphate|Prenyl diphosphate|delta-Prenyl diphosphate|delta2-Isopentenyl diphosphate 3-methylbut-2-en-1-yl trihydrogen diphosphate 2-Isopentenyl diphosphate|3,3-dimethylallyl pyrophosphate|3-methylbut-2-en-1-yl trihydrogen diphosphate|3-methylbut-2-enyl phosphono hydrogen phosphate|DIMETHYLALLYL DIPHOSPHATE|DMAPP|Dimethylallyl diphosphate|Dimethylallyl pyrophosphate|Monoprenyl diphosphate|Prenol pyrophosphate|Prenyl diphosphate|delta-Prenyl diphosphate|delta2-Isopentenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_16057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16058 biolink:ChemicalEntity 2D-5-O-methyl-2,3,5/4,6-pentahydroxycyclohexanone kegg.compound:C01295 Graph (2R,3R,4R,5S,6R)-2,3,4,6-tetrahydroxy-5-methoxycyclohexanone|2D-5-O-methyl-2,3,5/4,6-pentahydroxycyclohexanone|5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone|D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone (2R,3R,4R,5S,6R)-2,3,4,6-tetrahydroxy-5-methoxycyclohexanone (2R,3R,4R,5S,6R)-2,3,4,6-tetrahydroxy-5-methoxycyclohexanone|2D-5-O-methyl-2,3,5/4,6-pentahydroxycyclohexanone|5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone|D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone http://purl.obolibrary.org/obo/CHEBI_16058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16060 biolink:ChemicalEntity 10-deoxysarpagine An indole alkaloid that is sarpagan bearing a hydroxy group at position 17. cas:604-99-9|kegg.compound:C11635|knapsack:C00025193|pubmed:12927851|pubmed:17238077|wikipedia.en:Tombozine Graph 10-Deoxysarpagine|10-deoxysarpagine|Sarpagan-17-ol|normacusine B|sarpagan-17-ol|tombozin|tombozine|vellosiminol Sarpagan-17-ol|sarpagan-17-ol 10-Deoxysarpagine|10-deoxysarpagine|Sarpagan-17-ol|normacusine B|sarpagan-17-ol|tombozin|tombozine|vellosiminol http://purl.obolibrary.org/obo/CHEBI_16060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16062 biolink:ChemicalEntity N-acyl-D-mannosamine kegg.compound:C00625 Graph N-Acyl-D-mannosamine|an N-acyl-D-mannosamine N-Acyl-D-mannosamine|an N-acyl-D-mannosamine http://purl.obolibrary.org/obo/CHEBI_16062 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16063 biolink:ChemicalEntity limonin 17-beta-D-glucoside beilstein:4899426|cas:123564-61-4|kegg.compound:C06740 Graph (3'S,4aS,6aR,8aR,9R,10S,12aR,12bR)-10-[(R)-furan-3-yl(beta-D-glucopyranosyloxy)methyl]-6,6,8a,10-tetramethyl-3,8-dioxodecahydro-3H,6H-spiro[naphtho[1',2':3,4]furo[3,2-c]pyran-9,2'-oxirane]-3'-carboxylic acid|Glucosyl-limonin|Limonin 17-beta-D-glucopyranoside|Limonin 17-beta-D-glucoside|beta-D-glucosyl-limonin (3'S,4aS,6aR,8aR,9R,10S,12aR,12bR)-10-[(R)-furan-3-yl(beta-D-glucopyranosyloxy)methyl]-6,6,8a,10-tetramethyl-3,8-dioxodecahydro-3H,6H-spiro[naphtho[1',2':3,4]furo[3,2-c]pyran-9,2'-oxirane]-3'-carboxylic acid (3'S,4aS,6aR,8aR,9R,10S,12aR,12bR)-10-[(R)-furan-3-yl(beta-D-glucopyranosyloxy)methyl]-6,6,8a,10-tetramethyl-3,8-dioxodecahydro-3H,6H-spiro[naphtho[1',2':3,4]furo[3,2-c]pyran-9,2'-oxirane]-3'-carboxylic acid|Glucosyl-limonin|Limonin 17-beta-D-glucopyranoside|Limonin 17-beta-D-glucoside|beta-D-glucosyl-limonin http://purl.obolibrary.org/obo/CHEBI_16063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16064 biolink:ChemicalEntity keto-3-deoxy-D-manno-octulosonate kegg.compound:C01187 Graph 2-Dehydro-3-deoxy-D-octonate|3-deoxy-D-manno-octulosonate|3-deoxyoctulosonate|keto-3-deoxy-D-manno-oct-2-ulosonate keto-3-deoxy-D-manno-oct-2-ulosonate 2-Dehydro-3-deoxy-D-octonate|3-deoxy-D-manno-octulosonate|3-deoxyoctulosonate|keto-3-deoxy-D-manno-oct-2-ulosonate http://purl.obolibrary.org/obo/CHEBI_16064 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16065 biolink:ChemicalEntity scopolin A member of the class of coumarins that is scopoletin attached to a β-D-glucopyranosyl residue at position 7 via a glycosidic linkage. cas:531-44-2|kegg.compound:C01527|knapsack:C00002500|metacyc.compound:SCOPOLIN|pubmed:22032697|reaxys:50851|wikipedia.en:Scopolin Graph 6-methoxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside|7-(beta-D-glucopyranosoyloxy)-6-methoxy-2H-1-benzopyran-2-one|Scopolin|scopolin 6-methoxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside 6-methoxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside|7-(beta-D-glucopyranosoyloxy)-6-methoxy-2H-1-benzopyran-2-one|Scopolin|scopolin http://purl.obolibrary.org/obo/CHEBI_16065 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16066 biolink:ChemicalEntity 11-cis-retinal A retinal having 2E,4Z,6E,8E-double bond geometry. cas:564-87-4|hmdb:HMDB0002152|kegg.compound:C02110|lipidmaps:LMPR01090003|metacyc.compound:CPD-881|pubmed:10655150|pubmed:11161734|pubmed:11390257|pubmed:16026160|pubmed:17003450|pubmed:18370404|pubmed:18563917|pubmed:18606814|pubmed:19339306|pubmed:19830653|pubmed:2440575|reaxys:1914181 Graph (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|11-cis-Retinal|11-cis-Retinene|11-cis-Vitamin A aldehyde|11-cis-retinal|11-cis-retinene|11-cis-vitamin A aldehyde 11-cis-Retinal|11-cis-retinal (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|11-cis-Retinal|11-cis-Retinene|11-cis-Vitamin A aldehyde|11-cis-retinal|11-cis-retinene|11-cis-vitamin A aldehyde http://purl.obolibrary.org/obo/CHEBI_16066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16067 biolink:ChemicalEntity 1D-myo-inositol 1,4,5,6-tetrakisphosphate A myo-inositol tetrakisphosphate having the four phosphate groups at the 1-, 4-, 5- and 6-positions. beilstein:3116166|kegg.compound:C11555 Graph 1D-myo-Inositol 1,4,5,6-tetrakisphosphate|1D-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate)|D-myo-Inositol 1,4,5,6-tetrakisphosphate|Inositol 1,4,5,6-tetrakisphosphate 1D-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate) 1D-myo-Inositol 1,4,5,6-tetrakisphosphate|1D-myo-inositol 1,4,5,6-tetrakis(dihydrogen phosphate)|D-myo-Inositol 1,4,5,6-tetrakisphosphate|Inositol 1,4,5,6-tetrakisphosphate http://purl.obolibrary.org/obo/CHEBI_16067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16068 biolink:ChemicalEntity 2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoic acid The 2-(3,4-dihydroxybenzoyl) derivative of 2,4,6-trihydroxybenzoic acid. A metabolite of quercetin, an abundant flavonoid found in edible vegetables, grains and fruits which is used as an ingredient in supplements, beverages, or foods. cas:30048-34-1|hmdb:HMDB0059651|kegg.compound:C04524|pubmed:12105970|reaxys:3005017 Graph 2,4DiOH-6(2,4DiOHBenAcid)BenzAcid|2-(3,4-Dihydroxybenzoyloxy)-4,6-dihydroxybenzoate|2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoic acid|2-Protocatechuoyl phloroglucinolcarboxylate|2PCPGCA 2-(3,4-Dihydroxybenzoyloxy)-4,6-dihydroxybenzoate|2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoic acid 2,4DiOH-6(2,4DiOHBenAcid)BenzAcid|2-(3,4-Dihydroxybenzoyloxy)-4,6-dihydroxybenzoate|2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoic acid|2-Protocatechuoyl phloroglucinolcarboxylate|2PCPGCA http://purl.obolibrary.org/obo/CHEBI_16068 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16069 biolink:ChemicalEntity 1H-imidazole An imidazole tautomer which has the migrating hydrogen at position 1. cas:288-32-4|gmelin:1417|hmdb:HMDB0001525|kegg.compound:C01589|patent:US3255200|pdb-ccd:IMD|pubmed:9730817|reaxys:103853 Graph 1,3-Diazole|1,3-diaza-2,4-cyclopentadiene|1,3-diazole|1H-imidazole|Glyoxaline|Him|IMD|Imidazol|Imidazole|N,N'-1,2-ethenediylmethanimidamide|N,N'-vinyleneformamidine|imidazole|iminazole|miazole|pyrro[b]monazole 1H-imidazole|Imidazole 1,3-Diazole|1,3-diaza-2,4-cyclopentadiene|1,3-diazole|1H-imidazole|Glyoxaline|Him|IMD|Imidazol|Imidazole|N,N'-1,2-ethenediylmethanimidamide|N,N'-vinyleneformamidine|imidazole|iminazole|miazole|pyrro[b]monazole http://purl.obolibrary.org/obo/CHEBI_16069 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16070 biolink:ChemicalEntity 1,5-anhydro-D-glucitol An anhydro sugar of D-glucitol. cas:154-58-5|hmdb:HMDB0002712|kegg.compound:C07326|pdb-ccd:ASO|pubmed:15277408|pubmed:18492944|pubmed:19796288|reaxys:80736|wikipedia.en:1,5-Anhydroglucitol Graph (2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol|1,5-ANHYDROSORBITOL|1,5-Anhydro-D-glucitol|1,5-Anhydro-D-sorbitol|1,5-Anhydroglucitol|1,5-anhydro-D-glucitol|1,5-anhydro-D-sorbitol|1,5-anhydroglucitol (2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol (2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol|1,5-ANHYDROSORBITOL|1,5-Anhydro-D-glucitol|1,5-Anhydro-D-sorbitol|1,5-Anhydroglucitol|1,5-anhydro-D-glucitol|1,5-anhydro-D-sorbitol|1,5-anhydroglucitol http://purl.obolibrary.org/obo/CHEBI_16070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16072 biolink:ChemicalEntity maleimide A cyclic dicarboximide in which the two carboacyl groups on nitrogen together with the nitogen itself form a 1H-pyrrole-2,5-dione structure. cas:541-59-3|kegg.compound:C07272|metacyc.compound:MALEIMIDE|pubmed:11961142|reaxys:106910|wikipedia.en:Maleimide Graph 1H-pyrrole-2,5-dione|2,5-Pyrroledione|Maleic imide|Maleimide|maleimide 1H-pyrrole-2,5-dione 1H-pyrrole-2,5-dione|2,5-Pyrroledione|Maleic imide|Maleimide|maleimide http://purl.obolibrary.org/obo/CHEBI_16072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16073 biolink:ChemicalEntity N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate A polyprenyl phospho oligosaccharide where N-acetyl-β-D-mannosaminyl-(1→4)-N-acetyl-D-glucosaminyl comprises the oligosaccharide component and the polyprenyl chain consists of eleven prenyl units. kegg.glycan:G00177 Graph 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-mannopyranosyl]-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-mannopyranosyl]-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-mannopyranosyl]-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_16073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16076 biolink:ChemicalEntity 11alpha-hydroxyprogesterone A 11α-hydroxy steroid that is pregn-4-ene-3,20-dione substituted by a hydroxy group at position 11. cas:80-75-1|hmdb:HMDB0000920|kegg.compound:C03747|lipidmaps:LMST02030184|pubmed:10373218|pubmed:1245704|pubmed:13068348|pubmed:13740999|pubmed:702293|pubmed:925270|reaxys:2224223 Graph (11alpha)-11-hydroxypregn-4-ene-3,20-dione|11-alpha-hydroxyprogesterone|11alpha-Hydroxyprogesterone|11alpha-hydroxypregn-4-ene-3,20-dione|4-pregnen-11alpha-ol-3,20-dione 11alpha-hydroxypregn-4-ene-3,20-dione (11alpha)-11-hydroxypregn-4-ene-3,20-dione|11-alpha-hydroxyprogesterone|11alpha-Hydroxyprogesterone|11alpha-hydroxypregn-4-ene-3,20-dione|4-pregnen-11alpha-ol-3,20-dione http://purl.obolibrary.org/obo/CHEBI_16076 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16077 biolink:ChemicalEntity D-glucopyranose 1-phosphate A D-glucose monophosphate in which the phosphate group is located at position 1. beilstein:1348659|hmdb:HMDB0001586|metacyc.compound:D-glucose-1-phosphates|pubmed:17439666|pubmed:21115809|pubmed:23863124|reaxys:1348659|wikipedia.en:Glucose-1-phosphate Graph 1-O-phosphono-D-glucopyranose|Cori ester|D-Glucose 1-phosphate|D-glucopyranose 1-(dihydrogen phosphate)|Glc-1-P D-glucopyranose 1-(dihydrogen phosphate) 1-O-phosphono-D-glucopyranose|Cori ester|D-Glucose 1-phosphate|D-glucopyranose 1-(dihydrogen phosphate)|Glc-1-P http://purl.obolibrary.org/obo/CHEBI_16077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16079 biolink:ChemicalEntity benzyl 2-methyl-3-oxobutanoate A benzyl ester obtained by the formal condensation of the carboxy group of 2-methylacetoacetic acid with the hydroxy group of benzyl alcohol. kegg.compound:C04000|reaxys:2417095 Graph Benzyl 2-methyl-3-oxobutanoate|benzyl 2-methyl-3-oxobutanoate Benzyl 2-methyl-3-oxobutanoate|benzyl 2-methyl-3-oxobutanoate Benzyl 2-methyl-3-oxobutanoate|benzyl 2-methyl-3-oxobutanoate http://purl.obolibrary.org/obo/CHEBI_16079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16080 biolink:ChemicalEntity gamma-amino-beta-hydroxybutyric acid A γ-amino acid comprising 4-aminobutyric acid having a 2-hydroxy substituent. beilstein:1721708|beilstein:1752568|cas:352-21-6|drugcentral:1263|kegg.compound:C03678|kegg.drug:D00174 Graph 3-hydroxy-GABA|4-Amino-3-hydroxybutanoic acid|4-amino-3-hydroxybutanoic acid|4-amino-3-hydroxybutyric acid|GABOB|gamma-Amino-beta-hydroxybutyric acid 4-Amino-3-hydroxybutanoic acid|4-amino-3-hydroxybutanoic acid 3-hydroxy-GABA|4-Amino-3-hydroxybutanoic acid|4-amino-3-hydroxybutanoic acid|4-amino-3-hydroxybutyric acid|GABOB|gamma-Amino-beta-hydroxybutyric acid http://purl.obolibrary.org/obo/CHEBI_16080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16081 biolink:ChemicalEntity dTDP-L-dihydrostreptose A dTDP-sugar having dihydrostreptose as the sugar component. kegg.compound:C03442 Graph dTDP-L-dihydrostreptose|thymidine 5'-{3-[5-deoxy-3-C-(hydroxymethyl)-L-lyxofuranosyl] dihydrogen diphosphate} thymidine 5'-{3-[5-deoxy-3-C-(hydroxymethyl)-L-lyxofuranosyl] dihydrogen diphosphate} dTDP-L-dihydrostreptose|thymidine 5'-{3-[5-deoxy-3-C-(hydroxymethyl)-L-lyxofuranosyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_16081 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16082 biolink:ChemicalEntity UDP-alpha-D-xylose A UDP-sugar having α-xylose as the sugar component. It is an important metabolite in the nucleotide sugar metabolism in animals, plants, fungi, and bacteria. cas:3616-06-6|hmdb:HMDB0001018|kegg.compound:C00190|kegg.glycan:G10613|pdb-ccd:UDX|pubmed:12481102|pubmed:20847005|pubmed:22008417|pubmed:23053089|pubmed:24561591|reaxys:101812 Graph UDP-D-xylose|UDP-alpha-D-xylose|UDP-xylose|UDPxylose|URIDINE-5'-DIPHOSPHATE-XYLOPYRANOSE|Udp xylose|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-xylopyranosyl ester|Uridine diphosphate xylose|uridine 5'-[3-(alpha-D-xylopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(alpha-D-xylopyranosyl) dihydrogen diphosphate] UDP-D-xylose|UDP-alpha-D-xylose|UDP-xylose|UDPxylose|URIDINE-5'-DIPHOSPHATE-XYLOPYRANOSE|Udp xylose|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-xylopyranosyl ester|Uridine diphosphate xylose|uridine 5'-[3-(alpha-D-xylopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16083 biolink:ChemicalEntity (S)-3-(indol-3-yl)-2-oxobutyric acid The (S)-enantiomer of 3-(indol-3-yl)-2-oxobutyric acid. beilstein:477499 Graph (3S)-3-(1H-indol-3-yl)-2-oxobutanoic acid|(S)-beta-Methylindolepyruvate|(S)-beta-methylindolepyruvic acid (3S)-3-(1H-indol-3-yl)-2-oxobutanoic acid (3S)-3-(1H-indol-3-yl)-2-oxobutanoic acid|(S)-beta-Methylindolepyruvate|(S)-beta-methylindolepyruvic acid http://purl.obolibrary.org/obo/CHEBI_16083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16084 biolink:ChemicalEntity beta-D-fructofuranose 6-phosphate A D-fructofuranose 6-phosphate with a β-configuration at the anomeric position. beilstein:2334545|kegg.compound:C05345|knapsack:C00019548|pdb-ccd:F6P|wikipedia.en:Fructose_6-phosphate Graph 6-O-phosphono-beta-D-fructofuranose|FRUCTOSE-6-PHOSPHATE|beta-D-Fructose 6-phosphate|beta-D-fructofuranose 6-(dihydrogen phosphate) beta-D-fructofuranose 6-(dihydrogen phosphate) 6-O-phosphono-beta-D-fructofuranose|FRUCTOSE-6-PHOSPHATE|beta-D-Fructose 6-phosphate|beta-D-fructofuranose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16085 biolink:ChemicalEntity UDP-alpha-D-galacturonic acid cas:50722-58-2|kegg.compound:C00617|kegg.glycan:G11110|knapsack:C00007237 Graph UDP-D-galacturonate|UDPgalacturonate|uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate)|uridine 5'-[3-(alpha-D-galactopyranuronosyl) dihydrogen diphosphate] uridine 5'-[3-(alpha-D-galactopyranuronosyl) dihydrogen diphosphate] UDP-D-galacturonate|UDPgalacturonate|uridine 5'-(alpha-D-galactopyranosyluronic acid pyrophosphate)|uridine 5'-[3-(alpha-D-galactopyranuronosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16086 biolink:ChemicalEntity mycothione The disulfide resulting from oxidative coupling of the thiol groups of two molecules of mycothiol. beilstein:6953243|kegg.compound:C11502|kegg.glycan:G11175 Graph (2R,2'R)-3,3'-disulfanediylbis{2-(acetylamino)-N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}tetrahydro-2H-pyran-3-yl]propanamide}|MSSM|Mycothione|mycothione (2R,2'R)-3,3'-disulfanediylbis{2-(acetylamino)-N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}tetrahydro-2H-pyran-3-yl]propanamide} (2R,2'R)-3,3'-disulfanediylbis{2-(acetylamino)-N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}tetrahydro-2H-pyran-3-yl]propanamide}|MSSM|Mycothione|mycothione http://purl.obolibrary.org/obo/CHEBI_16086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16087 biolink:ChemicalEntity isocitrate(3-) Propan-1-ol with a hydrogen at each of the 3 carbon positions substituted with a carboxylate group. gmelin:329802|hmdb:HMDB0000193|kegg.compound:C00311|metacyc.compound:Isocitrate|reaxys:3971277 Graph 1-hydroxypropane-1,2,3-tricarboxylate|1-hydroxytricarballylate|3-carboxylato-2,3-dideoxypentarate 1-hydroxypropane-1,2,3-tricarboxylate|3-carboxylato-2,3-dideoxypentarate 1-hydroxypropane-1,2,3-tricarboxylate|1-hydroxytricarballylate|3-carboxylato-2,3-dideoxypentarate http://purl.obolibrary.org/obo/CHEBI_16087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16089 biolink:ChemicalEntity 6-deoxyerythronolide B cas:15797-36-1|drugbank:DB04070|kegg.compound:C03240|lipidmaps:LMPK04000002|pdb-ccd:DEB Graph (3R,4S,5R,6S,7S,9R,11R,12S,13R,14R)-14-ethyl-4,6,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione|3,5,11-Trihydroxyerythranolid-9-one|6,12-Dideoxy-erythronolide A|6-DEOXYERYTHRONOLIDE B|6-Deoxyerythronolide B|6-deoxyerythronolide B (3R,4S,5R,6S,7S,9R,11R,12S,13R,14R)-14-ethyl-4,6,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione (3R,4S,5R,6S,7S,9R,11R,12S,13R,14R)-14-ethyl-4,6,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione|3,5,11-Trihydroxyerythranolid-9-one|6,12-Dideoxy-erythronolide A|6-DEOXYERYTHRONOLIDE B|6-Deoxyerythronolide B|6-deoxyerythronolide B http://purl.obolibrary.org/obo/CHEBI_16089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16091 biolink:ChemicalEntity dolichol Any one of a group of prenol derivatives made up of varying numbers of cis-linked isoprene units, terminating in an α-saturated isoprenoid group containing an alcohol functional group, with the three isoprene units at the distal end trans-linked. kegg.compound:C00381|pubmed:12702274|pubmed:14739709|pubmed:20637498|pubmed:21570481|pubmed:22717794|pubmed:23059969|pubmed:8486680 Graph 2,3-dihydropolyprenol|Dolichol|alpha-(4-hydroxy-2-methylbutyl)-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|di-trans,poly-cis-dolichol|dolichols alpha-(4-hydroxy-2-methylbutyl)-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] 2,3-dihydropolyprenol|Dolichol|alpha-(4-hydroxy-2-methylbutyl)-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|di-trans,poly-cis-dolichol|dolichols http://purl.obolibrary.org/obo/CHEBI_16091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16092 biolink:ChemicalEntity isoquinoline An ortho-fused heteroarene that is a benzopyridine in which the N atom not directly attached to the benzene ring. cas:119-65-3|drugbank:DB04329|gmelin:3676|hmdb:HMDB0034244|kegg.compound:C06323|metacyc.compound:ISOQUINOLINE|pdb-ccd:ISQ|reaxys:107549|wikipedia.en:Isoquinoline Graph 2-Benzazine|2-benzazine|Benzo[c]pyridine|ISOQUINOLINE|Isochinolin|Isoquinoline|isoquinoline ISOQUINOLINE|Isoquinoline|isoquinoline 2-Benzazine|2-benzazine|Benzo[c]pyridine|ISOQUINOLINE|Isochinolin|Isoquinoline|isoquinoline http://purl.obolibrary.org/obo/CHEBI_16092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16093 biolink:ChemicalEntity 2-methylene-3-methylsuccinic acid A dicarboxylic acid that is succinic acid substituted by a methylene group at position 2 and a methyl group at position 3. kegg.compound:C02295|pubmed:12670228|reaxys:1766046 Graph 2-Methylene-3-methylsuccinate|2-methyl-3-methylidenebutanedoic acid|Methylitaconate|methylitaconic acid 2-methyl-3-methylidenebutanedoic acid 2-Methylene-3-methylsuccinate|2-methyl-3-methylidenebutanedoic acid|Methylitaconate|methylitaconic acid http://purl.obolibrary.org/obo/CHEBI_16093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16094 biolink:ChemicalEntity thiosulfate(2-) A divalent inorganic anion obtained by removal of both protons from thiosulfuric acid. cas:14383-50-7|gmelin:2031|pdb-ccd:THJ|umbbd.compound:c0570|wikipedia.en:Thiosulfate Graph Hyposulfite|S2O3|S2O3(2-)|TETRATHIONATE|Thiosulfate|[SO3S](2-)|sulfurothioate|thiosulfate|thiosulfate (S2O3(2-))|thiosulfate dianion|thiosulfate ion|thiosulfate ion(2-)|thiosulphate|trioxido-1kappa(3)O-disulfate(S--S)(2-)|trioxidosulfidosulfate(2-) Thiosulfate|sulfurothioate|thiosulfate|trioxidosulfidosulfate(2-) Hyposulfite|S2O3|S2O3(2-)|TETRATHIONATE|Thiosulfate|[SO3S](2-)|sulfurothioate|thiosulfate|thiosulfate (S2O3(2-))|thiosulfate dianion|thiosulfate ion|thiosulfate ion(2-)|thiosulphate|trioxido-1kappa(3)O-disulfate(S--S)(2-)|trioxidosulfidosulfate(2-) http://purl.obolibrary.org/obo/CHEBI_16094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16095 biolink:ChemicalEntity sepiapterin cas:17094-01-8|kegg.compound:C00835 Graph 1-(2-amino-7,8-dihydro-4-hydroxypteridine-6-yl)-2-hydroxypropan-1-one|2-amino-6-(2-hydroxypropanoyl)-7,8-dihydropteridin-4(3H)-one|2-amino-6-lactoyl-7,8-dihydropteridin-4(3H)-one|Sepiapterin 2-amino-6-lactoyl-7,8-dihydropteridin-4(3H)-one 1-(2-amino-7,8-dihydro-4-hydroxypteridine-6-yl)-2-hydroxypropan-1-one|2-amino-6-(2-hydroxypropanoyl)-7,8-dihydropteridin-4(3H)-one|2-amino-6-lactoyl-7,8-dihydropteridin-4(3H)-one|Sepiapterin http://purl.obolibrary.org/obo/CHEBI_16095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16096 biolink:ChemicalEntity palmatine beilstein:1555498|cas:3486-67-7|kegg.compound:C05315|knapsack:C00001898|knapsack:C00027159|lincs.smallmolecule:LSM-6625 Graph 2,3,9,10-tetramethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium|5,6-Dihydro-2,3,9,10-tetramethoxydibenzo[a,g]quinolizinium|7,8,13,13a-tetrahydro-2,3,9,10-tetramethoxyberbinium|O,O-dimethyldemethyleneberberine|Palmatine|berbericinine|palmatine 2,3,9,10-tetramethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium 2,3,9,10-tetramethoxy-5,6-dihydroisoquino[3,2-a]isoquinolinium|5,6-Dihydro-2,3,9,10-tetramethoxydibenzo[a,g]quinolizinium|7,8,13,13a-tetrahydro-2,3,9,10-tetramethoxyberbinium|O,O-dimethyldemethyleneberberine|Palmatine|berbericinine|palmatine http://purl.obolibrary.org/obo/CHEBI_16096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16098 biolink:ChemicalEntity 4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde kegg.compound:C04796|kegg.compound:C17758 Graph (2E,4Z)-4-(L-alanin-3-yl)-2-hydroxy-6-oxohexa-2,4-dienoic acid|(2E,4Z,6S)-6-amino-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioic acid|4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (2E,4Z,6S)-6-amino-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioic acid (2E,4Z)-4-(L-alanin-3-yl)-2-hydroxy-6-oxohexa-2,4-dienoic acid|(2E,4Z,6S)-6-amino-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioic acid|4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde http://purl.obolibrary.org/obo/CHEBI_16098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16099 biolink:ChemicalEntity 4'-O-beta-D-glucosyl-cis-p-coumaric acid beilstein:7170003|kegg.compound:C06739 Graph (2Z)-3-[4-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|(2Z)-3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid (2Z)-3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid (2Z)-3-[4-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|(2Z)-3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_16099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16100 biolink:ChemicalEntity 1,6-dihydroxy-2-methylcyclohexa-2,4-dienecarboxylic acid A cyclohexadienecarboxylic acid that is cyclohexa-2,4-diene-1-carboxylic acid substituted by hydroxy group at positions 1 and 6 and a methyl group at position 2. kegg.compound:C06731|umbbd.compound:c0252 Graph 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate|1,6-dihydroxy-2-methylcyclohexa-2,4-diene-1-carboxylic acid 1,6-dihydroxy-2-methylcyclohexa-2,4-diene-1-carboxylic acid 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate|1,6-dihydroxy-2-methylcyclohexa-2,4-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16101 biolink:ChemicalEntity ethylbenzene An alkylbenzene carrying an ethyl substituent. It is a constituent of coal tar and petroleum. cas:100-41-4|drugbank:DB01722|gmelin:2990|hmdb:HMDB0059905|kegg.compound:C07111|metacyc.compound:ETHYLBENZENE|reaxys:1901871|umbbd.compound:c0116|wikipedia.en:Ethylbenzene Graph Aethylbenzol|Ethylbenzene|Ethylbenzol|Ethylenzene|PHENYLETHANE|Phenylethane|alpha-methyltoluene|ethylbenzene Ethylbenzene|ethylbenzene Aethylbenzol|Ethylbenzene|Ethylbenzol|Ethylenzene|PHENYLETHANE|Phenylethane|alpha-methyltoluene|ethylbenzene http://purl.obolibrary.org/obo/CHEBI_16101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16104 biolink:ChemicalEntity 3-(2-hydroxyphenyl)propanoic acid A monocarboxylic acid that is propionic acid in which one of the hydrogens at position 3 is substituted by a 2-hydroxyphenyl group. cas:495-78-3|kegg.compound:C01198|knapsack:C00002756|metacyc.compound:MELILOTATE|pubmed:14243380|pubmed:14269315|pubmed:4192639|pubmed:7483862|pubmed:7839702|reaxys:1681601|umbbd.compound:c0398 Graph 2-hydroxybenzenepropanoic acid|3-(2-Hydroxyphenyl)propionic acid|3-(2-hydroxyphenyl)propanoic acid|3-(2-hydroxyphenyl)propionic acid|3-(o-hydroxyphenyl) propionic acid|melilotic acid|o-Hydroxyphenylpropionic acid 3-(2-hydroxyphenyl)propanoic acid 2-hydroxybenzenepropanoic acid|3-(2-Hydroxyphenyl)propionic acid|3-(2-hydroxyphenyl)propanoic acid|3-(2-hydroxyphenyl)propionic acid|3-(o-hydroxyphenyl) propionic acid|melilotic acid|o-Hydroxyphenylpropionic acid http://purl.obolibrary.org/obo/CHEBI_16104 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16106 biolink:ChemicalEntity 2,4-dichloro-5-oxo-2,5-dihydro-2-furylacetic acid An organochlorine compound that is 2,5-dihydro-2-furylacetic acid substituted by chloro groups at positions 2 and 4 and an oxo group at position 5. kegg.compound:C04625 Graph (2,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate|3,5-Dichloro-2,5-dihydro-2-oxofuran-5-acetate|3,5-dichloro-2,5-dihydro-2-oxofuran-5-acetate (2,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid (2,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate|3,5-Dichloro-2,5-dihydro-2-oxofuran-5-acetate|3,5-dichloro-2,5-dihydro-2-oxofuran-5-acetate http://purl.obolibrary.org/obo/CHEBI_16106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16108 biolink:ChemicalEntity dihydroxyacetone phosphate A member of the class of glycerone phosphates that consists of glycerone bearing a single phospho substituent. cas:57-04-5|chemspider:648|drugbank:DB04326|foodb.food:FDB001618|hmdb:HMDB0001473|kegg.compound:C00111|knapsack:C00007560|metacyc.compound:DIHYDROXY-ACETONE-PHOSPHATE|pdb-ccd:13P|pubmed:10098675|pubmed:1332571|pubmed:15882454|pubmed:20092811|pubmed:23857558|pubmed:26602120|pubmed:29112947|pubmed:29593097|pubmed:3119940|pubmed:31762135|pubmed:32719541|pubmed:8931639|reaxys:1708891|wikipedia.en:Dihydroxyacetone_phosphate Graph 1,3-Dihydroxy-2-propanone monodihydrogen phosphate|1,3-Dihydroxy-2-propanone phosphate|1,3-Dihydroxyacetone 1-phosphate|1-hydroxy-3-(phosphonooxy)-2-Propanone|1-hydroxy-3-(phosphonooxy)acetone|2-Propanone, 1-hydroxy-3-(phosphonooxy)-|3-hydroxy-2-oxopropyl dihydrogen phosphate|3-hydroxy-2-oxopropyl phosphate|DHAP|Dihydroxyacetone monophosphate|Dihydroxyacetone phosphate|Glycerone phosphate|dihydroxyacetone 3-phosphate|glycerone monophosphate 3-hydroxy-2-oxopropyl dihydrogen phosphate 1,3-Dihydroxy-2-propanone monodihydrogen phosphate|1,3-Dihydroxy-2-propanone phosphate|1,3-Dihydroxyacetone 1-phosphate|1-hydroxy-3-(phosphonooxy)-2-Propanone|1-hydroxy-3-(phosphonooxy)acetone|2-Propanone, 1-hydroxy-3-(phosphonooxy)-|3-hydroxy-2-oxopropyl dihydrogen phosphate|3-hydroxy-2-oxopropyl phosphate|DHAP|Dihydroxyacetone monophosphate|Dihydroxyacetone phosphate|Glycerone phosphate|dihydroxyacetone 3-phosphate|glycerone monophosphate http://purl.obolibrary.org/obo/CHEBI_16108 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16109 biolink:ChemicalEntity propane-1,3-diol The simplest member of the class of propane-1,3-diols, consisting of propane in which one hydrogen from each methyl group is substituted by a hydroxy group. A colourless, viscous, water-miscible liquid with a high (210°C) boiling point, it is used in the synthesis of certain polymers and as a solvent and antifreeze. cas:504-63-2|drugbank:DB02774|kegg.compound:C02457|metacyc.compound:CPD-347|pdb-ccd:PDO|pubmed:10531640|pubmed:16020043|pubmed:17439666|reaxys:969155|wikipedia.en:1,3-Propanediol Graph (HOCH2)2CH2|1,3-PROPANDIOL|1,3-Propanediol|1,3-dihydroxypropane|1,3-propylene glycol|1,3-propylenediol|2-(hydroxymethyl)ethanol|2-deoxyglycerol|CH2(CH2OH)2|HO(CH2)3OH|HOCH2CH2CH2OH|Propane-1,3-diol|Trimethylene glycol|beta-propylene glycol|omega-propanediol|propane-1,3-diol Propane-1,3-diol|propane-1,3-diol (HOCH2)2CH2|1,3-PROPANDIOL|1,3-Propanediol|1,3-dihydroxypropane|1,3-propylene glycol|1,3-propylenediol|2-(hydroxymethyl)ethanol|2-deoxyglycerol|CH2(CH2OH)2|HO(CH2)3OH|HOCH2CH2CH2OH|Propane-1,3-diol|Trimethylene glycol|beta-propylene glycol|omega-propanediol|propane-1,3-diol http://purl.obolibrary.org/obo/CHEBI_16109 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16110 biolink:ChemicalEntity 1,2-diacyl-sn-glycero-3-phosphocholine(1+) A phosphatidylcholine that is a glycerol phosphatide (phosphoglyceride, glycerophospholipid) in which the hydroxy group of choline is esterified with the phosphate group of phosphatidic acid. cas:8002-43-5|kegg.compound:C00157|pdb-ccd:PC1|pubmed:16341241|pubmed:3196084|pubmed:7192727 Graph (3-sn-phosphatidyl)choline|1,2-Diacyl-sn-glycero-3-phosphocholine|1,2-diacyl-sn-glycero-3-phosphocholine|1,2-diacyl-sn-glycero-3-phosphocholines|Choline phosphatide|L-alpha-phosphatidylcholine|Lecithin|PC|Phosphatidyl-N-trimethylethanolamine|Phosphatidylcholine|lecithins 1,2-Diacyl-sn-glycero-3-phosphocholine|1,2-diacyl-sn-glycero-3-phosphocholine (3-sn-phosphatidyl)choline|1,2-Diacyl-sn-glycero-3-phosphocholine|1,2-diacyl-sn-glycero-3-phosphocholine|1,2-diacyl-sn-glycero-3-phosphocholines|Choline phosphatide|L-alpha-phosphatidylcholine|Lecithin|PC|Phosphatidyl-N-trimethylethanolamine|Phosphatidylcholine|lecithins http://purl.obolibrary.org/obo/CHEBI_16110 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16111 biolink:ChemicalEntity nonane-4,6-dione A nonanone carrying oxo substituents at positions 4 and 6 respectively. cas:14090-88-1|kegg.compound:C02445|metacyc.compound:NONANE-46-DIONE|reaxys:1757685 Graph Nonane-4,6-dione|nonane-4,6-dione Nonane-4,6-dione|nonane-4,6-dione Nonane-4,6-dione|nonane-4,6-dione http://purl.obolibrary.org/obo/CHEBI_16111 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16112 biolink:ChemicalEntity chlorogenic acid A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 3-hydroxy group of quinic acid. It is an intermediate metabolite in the biosynthesis of lignin. cas:327-97-9|hmdb:HMDB0003164|kegg.compound:C00852|knapsack:C00002724|metacyc.compound:CAFFEOYLQUINATE|pubmed:16507475|pubmed:22770225|reaxys:2017157|wikipedia.en:Chlorogenic_acid Graph 3-(3,4-Dihydroxycinnamoyl)quinic acid|3-Caffeoylquinic acid|3-O-Caffeoylquinic acid|5-O-(3,4-Dihydroxycinnamoyl)-L-quinic acid|Caffeoyl quinic acid|Chlorogenate|Chlorogenic acid|[1S-(1alpha,3beta,4alpha,5alpha)]3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|edit(1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid|trans-5-O-Caffeoyl-D-quinate edit(1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid 3-(3,4-Dihydroxycinnamoyl)quinic acid|3-Caffeoylquinic acid|3-O-Caffeoylquinic acid|5-O-(3,4-Dihydroxycinnamoyl)-L-quinic acid|Caffeoyl quinic acid|Chlorogenate|Chlorogenic acid|[1S-(1alpha,3beta,4alpha,5alpha)]3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|edit(1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid|trans-5-O-Caffeoyl-D-quinate http://purl.obolibrary.org/obo/CHEBI_16112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16113 biolink:ChemicalEntity cholesterol A cholestanoid consisting of cholestane having a double bond at the 5,6-position as well as a 3β-hydroxy group. cas:57-88-5|drugbank:DB04540|gmelin:550297|hmdb:HMDB0000067|kegg.compound:C00187|kegg.drug:D00040|knapsack:C00003648|lipidmaps:LMST01010001|metacyc.compound:CHOLESTEROL|pdb-ccd:CLR|pubmed:10901445|pubmed:11412894|pubmed:16341241|pubmed:24287311|pubmed:25308664|pubmed:25451949|pubmed:25522988|pubmed:25658343|pubmed:25977713|pubmed:4696527|pubmed:8838010|reaxys:2060565|wikipedia.en:Cholesterol Graph (3beta,14beta,17alpha)-cholest-5-en-3-ol|CHOLESTEROL|Cholest-5-en-3beta-ol|Cholesterin|Cholesterol|cholest-5-en-3beta-ol|cholesterol Cholest-5-en-3beta-ol|cholest-5-en-3beta-ol (3beta,14beta,17alpha)-cholest-5-en-3-ol|CHOLESTEROL|Cholest-5-en-3beta-ol|Cholesterin|Cholesterol|cholest-5-en-3beta-ol|cholesterol http://purl.obolibrary.org/obo/CHEBI_16113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16114 biolink:ChemicalEntity medicarpin A member of the class of pterocarpans that is 3-hydroxyptercarpan with a methoxy substituent at position 9. beilstein:1322055 Graph 9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol|medicarpin 9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol 9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol|medicarpin http://purl.obolibrary.org/obo/CHEBI_16114 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16116 biolink:ChemicalEntity 3-hydroxy-4-methylanthranilic acid An aminobenzoic acid that is anthranilic acid substituted by a hydroxy group at position 3 and a methyl group at position 4. cas:552-14-7|kegg.compound:C03986|pubmed:23423168|pubmed:458423|pubmed:6202316|reaxys:2363060 Graph 2-amino-3-hydroxy-4-methylbenzoic acid|3,4-Cresotic acid, 2-amino-|4-Methyl-3-hydroxyanthranilic acid 2-amino-3-hydroxy-4-methylbenzoic acid 2-amino-3-hydroxy-4-methylbenzoic acid|3,4-Cresotic acid, 2-amino-|4-Methyl-3-hydroxyanthranilic acid http://purl.obolibrary.org/obo/CHEBI_16116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16118 biolink:ChemicalEntity berberine beilstein:3570374|cas:2086-83-1|chemspider:2263|drugbank:DB04115|foodb.food:FDB023165|hmdb:HMDB0003409|kegg.compound:C00757|knapsack:C00001819|lincs.smallmolecule:LSM-6553|metacyc.compound:BERBERINE|pdb-ccd:BER|pesticides:berberine|pubmed:11860742|pubmed:12232209|pubmed:12428952|pubmed:12433089|pubmed:12468268|pubmed:15040083|pubmed:15531889|pubmed:15739507|pubmed:15768991|pubmed:16379555|pubmed:16448624|pubmed:16505103|pubmed:17089049|pubmed:17295371|pubmed:17531424|pubmed:18537696|pubmed:19014947|pubmed:19336898|pubmed:19640223|pubmed:19652370|pubmed:19704371|pubmed:20471843|pubmed:20847417|pubmed:21401114|pubmed:21420512|pubmed:21500372|pubmed:21661731|pubmed:23231038|pubmed:26167392|pubmed:8730735|wikipedia.en:Berberine Graph 5,6-dihydro-9,10-dimethoxy-1,3-benzodioxolo[5,6-a]benzo[g]quinolizinium|7,8,13,13a-tetradehydro-9,10-dimethoxy-2,3-[methylenebis(oxy)]berbinium|9,10-dimethoxy-2,3-(methylenedioxy)-7,8,13,13a-tetradehydroberbinium|9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ium|BERBERINE|Berberin|Berberine|Umbellatine|berberine 9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ium 5,6-dihydro-9,10-dimethoxy-1,3-benzodioxolo[5,6-a]benzo[g]quinolizinium|7,8,13,13a-tetradehydro-9,10-dimethoxy-2,3-[methylenebis(oxy)]berbinium|9,10-dimethoxy-2,3-(methylenedioxy)-7,8,13,13a-tetradehydroberbinium|9,10-dimethoxy-5,6-dihydro[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ium|BERBERINE|Berberin|Berberine|Umbellatine|berberine http://purl.obolibrary.org/obo/CHEBI_16118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16119 biolink:ChemicalEntity shikimic acid A cyclohexenecarboxylic acid that is cyclohex-1-ene-1-carboxylic acid substituted by hydroxy groups at positions 3, 4 and 5 (the 3R,4S,5R stereoisomer). It is an intermediate metabolite in plants and microorganisms. cas:138-59-0|hmdb:HMDB0003070|kegg.compound:C00493|knapsack:C00001203|pdb-ccd:SKM|pubmed:24190737|pubmed:24628944|pubmed:24783849|pubmed:24836188|pubmed:24894540|pubmed:24981409|reaxys:2210055|wikipedia.en:Shikimic_acid Graph (3R,4S,5R)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid|3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid|3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid|L-shikimic acid|Shikimate|Shikimic acid|[3R-(3alpha,4alpha,5beta)]-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid (3R,4S,5R)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid (3R,4S,5R)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid|3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid|3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid|L-shikimic acid|Shikimate|Shikimic acid|[3R-(3alpha,4alpha,5beta)]-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16120 biolink:ChemicalEntity 5-oxopentanoate A 5-oxo monocarboxylic acid anion that is the conjugate base of 5-oxopentanoic acid, arising from deprotonation of the carboxy group. kegg.compound:C03273 Graph 5-oxopentanoate|5-oxovalerate 5-oxopentanoate 5-oxopentanoate|5-oxovalerate http://purl.obolibrary.org/obo/CHEBI_16120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16122 biolink:ChemicalEntity 3-(4-hydroxy-3,5-diiodophenyl)lactic acid A 2-hydroxy monocarboxylic acid that is lactic acid substituted by a 4-hydroxy-3,5-diiodophenyl group at position 3. kegg.compound:C04367|reaxys:3209481 Graph 2-hydroxy-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid|3-(3,5-Diiodo-4-hydroxyphenyl)lactate 2-hydroxy-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid 2-hydroxy-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid|3-(3,5-Diiodo-4-hydroxyphenyl)lactate http://purl.obolibrary.org/obo/CHEBI_16122 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16123 biolink:ChemicalEntity 6-oxocineole beilstein:81893|cas:70222-88-7|kegg.compound:C00848 Graph (-)-1,3,3-Trimethyl-2-oxabicyclo(2.2.1)octan-6-one|(1R,4S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-one|(1R,4S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-one|(R)-1,3,3-Trimethyl-2-oxabicyclo(2.2.2)octan-6-one|6-Oxocineole|6-oxocineole (1R,4S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-one|(1R,4S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-one (-)-1,3,3-Trimethyl-2-oxabicyclo(2.2.1)octan-6-one|(1R,4S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octan-6-one|(1R,4S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-one|(R)-1,3,3-Trimethyl-2-oxabicyclo(2.2.2)octan-6-one|6-Oxocineole|6-oxocineole http://purl.obolibrary.org/obo/CHEBI_16123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16125 biolink:ChemicalEntity hexadecan-1-ol A long-chain primary fatty alcohol that is hexadecane substituted by a hydroxy group at position 1. cas:36653-82-4|drugbank:DB09494|drugcentral:4750|foodb.food:FDB003051|hmdb:HMDB0003424|kegg.compound:C00823|kegg.drug:D00099|knapsack:C00052572|lipidmaps:LMFA05000061|metacyc.compound:CPD-348|pdb-ccd:PL3|pubmed:10884288|pubmed:12676987|pubmed:14988513|pubmed:16839564|pubmed:16952239|pubmed:18045091|pubmed:20429444|pubmed:24029555|pubmed:25466225|pubmed:26830023|pubmed:31901073|pubmed:4562642|pubmed:8733635|reaxys:1748475|wikipedia.en:Cetyl_Alcohol Graph 1-Hexadecanol|1-cetanol|1-hexadecyl alcohol|16-Hexadecanol|Cetyl alcohol|Cetylalkohol|FEMA 2554|HEXADECAN-1-OL|Hexadecanol|Palmityl alcohol|cetanol|hexadecan-1-ol|n-1-hexadecanol|n-hexadecyl alcohol HEXADECAN-1-OL|hexadecan-1-ol 1-Hexadecanol|1-cetanol|1-hexadecyl alcohol|16-Hexadecanol|Cetyl alcohol|Cetylalkohol|FEMA 2554|HEXADECAN-1-OL|Hexadecanol|Palmityl alcohol|cetanol|hexadecan-1-ol|n-1-hexadecanol|n-hexadecyl alcohol http://purl.obolibrary.org/obo/CHEBI_16125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16128 biolink:ChemicalEntity dTDP-4-dehydro-6-deoxy-alpha-D-glucose A dTDP-sugar having 4-dehydro-6-deoxy-α-D-glucose as the sugar component. It is an intermediate in dTDP-rhamnose biosynthesis. foodb.food:FDB022601|hmdb:HMDB0001399|kegg.compound:C11907|pdb-ccd:T46|pubmed:24616215 Graph dTDP-4-dehydro-6-deoxy-D-galactose|dTDP-4-dehydro-6-deoxy-D-glucose|dTDP-4-dehydro-6-deoxy-alpha-D-galactose|dTDP-4-dehydro-6-deoxy-alpha-D-glucose|dTDP-4-oxo-6-deoxy-alpha-D-glucose|dTDP-6-deoxy-alpha-D-xylo-4-hexulose|dTDP-6-deoxy-alpha-D-xylo-hex-4-ulose|thymidine 5'-[3-(6-deoxy-alpha-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-alpha-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] dTDP-4-dehydro-6-deoxy-D-galactose|dTDP-4-dehydro-6-deoxy-D-glucose|dTDP-4-dehydro-6-deoxy-alpha-D-galactose|dTDP-4-dehydro-6-deoxy-alpha-D-glucose|dTDP-4-oxo-6-deoxy-alpha-D-glucose|dTDP-6-deoxy-alpha-D-xylo-4-hexulose|dTDP-6-deoxy-alpha-D-xylo-hex-4-ulose|thymidine 5'-[3-(6-deoxy-alpha-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16130 biolink:ChemicalEntity DDT A chlorophenylethane that is 1,1,1-trichloro-2,2-diphenylethane substituted by additional chloro substituents at positions 4 of the phenyl substituents. It is a commonly used organochlorine insecticide. cas:50-29-3|drugcentral:4396|gmelin:509864|hmdb:HMDB0032127|kegg.compound:C04623|kegg.drug:D07367|lincs.smallmolecule:LSM-19015|metacyc.compound:CPD-43|ppdb:3140|pubmed:17949680|pubmed:24328540|reaxys:1882657|umbbd.compound:c0384|wikipedia.en:DDT Graph 1,1'-(2,2,2-trichloroethylidene)bis[4-chlorobenzene]|1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane|1,1,1-Trichloro-2,2-bis-(4'-chlorophenyl)ethane|1,1,1-trichloro-2,2-bis(4-chlorophenyl)ethane|1,1-bis(4-chlorophenyl)-2,2,2-trichloroethane|1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene|4,4'-DDT|Clofenotane|DDT|Dichlorodiphenyltrichloroethane|alpha,alpha-bis(p-chlorophenyl)-beta,beta,beta-trichlorethane|clofenotane|dichlorodiphenyltrichloroethane|p,p'-DDT|p,p'-dichlorodiphenyltrichloroethane 1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene 1,1'-(2,2,2-trichloroethylidene)bis[4-chlorobenzene]|1,1,1-Trichloro-2,2-bis(4-chlorophenyl)ethane|1,1,1-Trichloro-2,2-bis-(4'-chlorophenyl)ethane|1,1,1-trichloro-2,2-bis(4-chlorophenyl)ethane|1,1-bis(4-chlorophenyl)-2,2,2-trichloroethane|1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene|4,4'-DDT|Clofenotane|DDT|Dichlorodiphenyltrichloroethane|alpha,alpha-bis(p-chlorophenyl)-beta,beta,beta-trichlorethane|clofenotane|dichlorodiphenyltrichloroethane|p,p'-DDT|p,p'-dichlorodiphenyltrichloroethane http://purl.obolibrary.org/obo/CHEBI_16130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16132 biolink:ChemicalEntity 2-deoxy-D-ribose 5-phosphate The 5-O-phosphono derivative of 2-deoxy-D-ribose. hmdb:HMDB0001031|kegg.compound:C00673|metacyc.compound:DEOXY-RIBOSE-5P|pdb-ccd:DRZ|pubmed:22770225 Graph 2-Deoxy-D-ribose 5-phosphate|2-deoxy-5-O-phosphono-D-erythro-pentose|2-deoxy-D-erythro-pentose 5-(dihydrogen phosphate)|2-deoxy-D-ribose 5-phosphate 2-deoxy-D-erythro-pentose 5-(dihydrogen phosphate) 2-Deoxy-D-ribose 5-phosphate|2-deoxy-5-O-phosphono-D-erythro-pentose|2-deoxy-D-erythro-pentose 5-(dihydrogen phosphate)|2-deoxy-D-ribose 5-phosphate http://purl.obolibrary.org/obo/CHEBI_16132 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16133 biolink:ChemicalEntity cyclopentanol The simplest member of the class of cyclopentanols bearing a single hydroxy substituent. The parent of the class of cyclopentanols. cas:96-41-3|kegg.compound:C02020|metacyc.compound:CYCLOPENTANOL|pubmed:22145629|pubmed:24273356|reaxys:1900556|wikipedia.en:Cyclopentanol Graph Cyclopentanol|Cyclopentyl alcohol|Hydroxycyclopentane|cyclopentanol Cyclopentanol|cyclopentanol Cyclopentanol|Cyclopentyl alcohol|Hydroxycyclopentane|cyclopentanol http://purl.obolibrary.org/obo/CHEBI_16133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16134 biolink:ChemicalEntity ammonia An azane that consists of a single nitrogen atom covelently bonded to three hydrogen atoms. cas:7664-41-7|drugcentral:4625|gmelin:79|hmdb:HMDB0000051|kegg.compound:C00014|kegg.drug:D02916|knapsack:C00007267|metacyc.compound:AMMONIA|molbase:930|pdb-ccd:NH3|pubmed:110589|pubmed:11139349|pubmed:11540049|pubmed:11746427|pubmed:11783653|pubmed:13753780|pubmed:14663195|pubmed:15092448|pubmed:15094021|pubmed:15554424|pubmed:15969015|pubmed:16008360|pubmed:16050680|pubmed:16348008|pubmed:16349403|pubmed:16614889|pubmed:16664306|pubmed:16842901|pubmed:17025297|pubmed:17439666|pubmed:17569513|pubmed:17737668|pubmed:18670398|pubmed:22002069|pubmed:22081570|pubmed:22088435|pubmed:22100291|pubmed:22130175|pubmed:22150211|pubmed:22240068|pubmed:22290316|pubmed:22342082|pubmed:22385337|pubmed:22443779|pubmed:22560242|reaxys:3587154|wikipedia.en:Ammonia Graph AMMONIA|Ammonia|Ammoniak|NH3|R-717|[NH3]|ammonia|ammoniac|amoniaco|azane|spirit of hartshorn AMMONIA|Ammonia|ammonia|azane AMMONIA|Ammonia|Ammoniak|NH3|R-717|[NH3]|ammonia|ammoniac|amoniaco|azane|spirit of hartshorn http://purl.obolibrary.org/obo/CHEBI_16134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16135 biolink:ChemicalEntity isobutyric acid A branched fatty acid comprising propanoic acid carrying a methyl branch at C-2. bpdb:3128|cas:79-31-2|drugbank:DB02531|gmelin:49630|hmdb:HMDB0001873|kegg.compound:C02632|knapsack:C00029462|lipidmaps:LMFA01020071|metacyc.compound:ISOBUTYRATE|pdb-ccd:ALQ|ppdb:3128|pubmed:10757489|pubmed:17580301|pubmed:17877388|reaxys:635770|umbbd.compound:c0383|wikipedia.en:Isobutyric_acid Graph 2,2-dimethylacetic acid|2-METHYL-PROPIONIC ACID|2-Methylpropanoate|2-Methylpropanoic acid|2-Methylpropionsaeure|2-methylpropanoic acid|Dimethylacetic acid|ISOBUTYRIC ACID|Isobutanoate|Isobuttersaeure|Isobutyrate|Isobutyric acid|alpha-isobutyric acid|alpha-methylpropanoic acid|alpha-methylpropionic acid|iso-C3H7COOH|iso-butyric acid|isobutanoic acid|isopropylformic acid 2-Methylpropanoate|2-Methylpropanoic acid|2-methylpropanoic acid 2,2-dimethylacetic acid|2-METHYL-PROPIONIC ACID|2-Methylpropanoate|2-Methylpropanoic acid|2-Methylpropionsaeure|2-methylpropanoic acid|Dimethylacetic acid|ISOBUTYRIC ACID|Isobutanoate|Isobuttersaeure|Isobutyrate|Isobutyric acid|alpha-isobutyric acid|alpha-methylpropanoic acid|alpha-methylpropionic acid|iso-C3H7COOH|iso-butyric acid|isobutanoic acid|isopropylformic acid http://purl.obolibrary.org/obo/CHEBI_16135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16136 biolink:ChemicalEntity hydrogen sulfide A sulfur hydride consisting of a single sulfur atom bonded to two hydrogen atoms. A highly poisonous, flammable gas with a characteristic odour of rotten eggs, it is often produced by bacterial decomposition of organic matter in the absence of oxygen. beilstein:3535004|cas:7783-06-4|drugcentral:4260|gmelin:303|kegg.compound:C00283|knapsack:C00007266|molbase:1709|pdb-ccd:H2S|pubmed:11788560|pubmed:14654297|pubmed:15003943|pubmed:15607739|pubmed:16446402|pubmed:18098324|pubmed:18524810|pubmed:18948540|pubmed:19695225|pubmed:22004989|pubmed:22378060|pubmed:22448627|pubmed:22473176|pubmed:22486842|pubmed:22520971|pubmed:22787557|umbbd.compound:c0239|wikipedia.en:Hydrogen_sulfide Graph H2S|HYDROSULFURIC ACID|Hydrogen sulfide|Hydrogen-sulfide|Schwefelwasserstoff|Sulfide|[SH2]|acide sulfhydrique|dihydridosulfur|dihydrogen monosulfide|dihydrogen sulfide|dihydrogen(sulfide)|hydrogen monosulfide|hydrogen sulfide|hydrogen sulphide|hydrogene sulfure|sulfane|sulfure d'hydrogene Hydrogen sulfide|dihydridosulfur|dihydrogen(sulfide)|hydrogen sulfide|sulfane H2S|HYDROSULFURIC ACID|Hydrogen sulfide|Hydrogen-sulfide|Schwefelwasserstoff|Sulfide|[SH2]|acide sulfhydrique|dihydridosulfur|dihydrogen monosulfide|dihydrogen sulfide|dihydrogen(sulfide)|hydrogen monosulfide|hydrogen sulfide|hydrogen sulphide|hydrogene sulfure|sulfane|sulfure d'hydrogene http://purl.obolibrary.org/obo/CHEBI_16136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16137 biolink:ChemicalEntity chondroitin D-glucuronate A mucopolysaccharide composed of repeating β-D-glucopyranuronosyl-(1→3)-β-D-N-acetylgalactosaminyl units. kegg.compound:C00401|kegg.glycan:G11334 Graph Chondroitin|Chondroitin-D-glucuronate Chondroitin|Chondroitin-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_16137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16138 biolink:ChemicalEntity 2-deoxy-D-gluconic acid A derivative of D-gluconic acid lacking the 2-hydroxy group. kegg.compound:C02782 Graph 2-Deoxy-D-gluconate|2-deoxy-D-gluconic acid 2-Deoxy-D-gluconate|2-deoxy-D-gluconic acid 2-Deoxy-D-gluconate|2-deoxy-D-gluconic acid http://purl.obolibrary.org/obo/CHEBI_16138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16141 biolink:ChemicalEntity undecaprenyl dihydrogen phosphate The all-trans-isomer of undecaprenyl phosphate. cas:25126-51-6|kegg.compound:C00348|knapsack:C00019557 Graph (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl dihydrogen phosphate|Undecaprenyl phosphate (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl dihydrogen phosphate (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl dihydrogen phosphate|Undecaprenyl phosphate http://purl.obolibrary.org/obo/CHEBI_16141 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16142 biolink:ChemicalEntity 3-dehydro-L-gulonic acid A derivative of L-gulonic acid having a keto group at the 3-position. kegg.compound:C00618 Graph 3-Dehydro-L-gulonate|3-dehydro-L-gulonate|L-xylo-hex-3-ulosonic acid L-xylo-hex-3-ulosonic acid 3-Dehydro-L-gulonate|3-dehydro-L-gulonate|L-xylo-hex-3-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_16142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16143 biolink:ChemicalEntity 1-guanidino-1-deoxy-scyllo-inositol 4-phosphate A scyllo-inositol phosphate having the phosphate at the 4-position and a guanidino group in place of the hydroxyl at position 1. kegg.compound:C01294 Graph (2R,3S,5R,6S)-4-carbamimidamido-2,3,5,6-tetrahydroxycyclohexyl dihydrogen phosphate|1-Guanidino-1-deoxy-scyllo-inositol 4-phosphate|1-guanidino-1-deoxy-scyllo-inositol 4-phosphate|N-Amidino-scyllo-inosamine 4-phosphate (2R,3S,5R,6S)-4-carbamimidamido-2,3,5,6-tetrahydroxycyclohexyl dihydrogen phosphate (2R,3S,5R,6S)-4-carbamimidamido-2,3,5,6-tetrahydroxycyclohexyl dihydrogen phosphate|1-Guanidino-1-deoxy-scyllo-inositol 4-phosphate|1-guanidino-1-deoxy-scyllo-inositol 4-phosphate|N-Amidino-scyllo-inosamine 4-phosphate http://purl.obolibrary.org/obo/CHEBI_16143 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16144 biolink:ChemicalEntity selenophosphate A trivalent inorganic anion obtained by removal of all three protons from selenophosphoric acid. Graph Selenophosphate|[PO3Se](3-)|selenophosphate|trioxidoselenidophosphate(3-) Selenophosphate|[PO3Se](3-)|selenophosphate|trioxidoselenidophosphate(3-) http://purl.obolibrary.org/obo/CHEBI_16144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16145 biolink:ChemicalEntity 3,5/4-trihydroxycyclohexane-1,2-dione kegg.compound:C04287 Graph 3,5/4-Trihydroxycyclohexa-1,2-dione|3,5/4-trihydroxycyclohexane-1,2-dione|rel-(3S,4R,5S)-3,4,5-trihydroxycyclohexane-1,2-dione 3,5/4-trihydroxycyclohexane-1,2-dione 3,5/4-Trihydroxycyclohexa-1,2-dione|3,5/4-trihydroxycyclohexane-1,2-dione|rel-(3S,4R,5S)-3,4,5-trihydroxycyclohexane-1,2-dione http://purl.obolibrary.org/obo/CHEBI_16145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16146 biolink:ChemicalEntity maleamate A monocarboxylic acid anion that is the conjugate base of maleamic acid. metacyc.compound:MALEAMATE Graph (2Z)-4-amino-4-oxobut-2-enoate|maleamate (2Z)-4-amino-4-oxobut-2-enoate (2Z)-4-amino-4-oxobut-2-enoate|maleamate http://purl.obolibrary.org/obo/CHEBI_16146 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16148 biolink:ChemicalEntity heptadecane A straight-chain alkane with 17 carbon atoms. It is a component of essential oils from plants like Opuntia littoralis and Annona squamosa. cas:629-78-7|hmdb:HMDB0059830|kegg.compound:C01816|knapsack:C00030472|lipidmaps:LMFA11000003|metacyc.compound:HEPTADECANE-CPD|pubmed:19296389|pubmed:24354326|reaxys:1738898|wikipedia.en:Heptadecane Graph CH3-[CH2]15-CH3|Heptadecane|Heptadekan|heptadecane|n-heptadecane Heptadecane|heptadecane CH3-[CH2]15-CH3|Heptadecane|Heptadekan|heptadecane|n-heptadecane http://purl.obolibrary.org/obo/CHEBI_16148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16150 biolink:ChemicalEntity benzoate The simplest member of the class of benzoates that is the conjugate base of benzoic acid, comprising a benzoic acid core with a proton missing to give a charge of -1. cas:766-76-7|gmelin:2945|hmdb:HMDB0001870|kegg.compound:C00180|metacyc.compound:BENZOATE|reaxys:1862486|umbbd.compound:c0121 Graph Benzenecarboxylate|Benzeneformate|Benzenemethanoate|Phenylcarboxylate|Phenylformate|benzoate|benzoate anion|benzoic acid, ion(1-) benzoate Benzenecarboxylate|Benzeneformate|Benzenemethanoate|Phenylcarboxylate|Phenylformate|benzoate|benzoate anion|benzoic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_16150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16151 biolink:ChemicalEntity 3,4-dihydrocoumarin A chromanone that is the 3,4-dihydro derivative of coumarin. cas:119-84-6|gmelin:874678|hmdb:HMDB0036626|kegg.compound:C02274|metacyc.compound:DIHYDROCOUMARIN|pubmed:12616288|pubmed:16362078|pubmed:16769080|reaxys:4584|umbbd.compound:c0397 Graph 1,2-benzodihydropyrone|2-chromanone|2-hydroxydihydrocinnamic acid lactone|3,4-Dihydrocoumarin|3,4-dihydro-2H-1-benzopyran-2-one|3,4-dihydro-2H-chromen-2-one|3,4-dihydrocoumarin|Dihydrocoumarin|benzodihydropyrone|chroman-2-one|hydrocoumarin|melilotic acid lactone|melilotic lactone|melilotin|melilotol|o-hydroxydihydrocinnamic acid lactone|o-hydroxyhydrocinnamic acid delta-lactone|oxochroman 3,4-dihydro-2H-1-benzopyran-2-one 1,2-benzodihydropyrone|2-chromanone|2-hydroxydihydrocinnamic acid lactone|3,4-Dihydrocoumarin|3,4-dihydro-2H-1-benzopyran-2-one|3,4-dihydro-2H-chromen-2-one|3,4-dihydrocoumarin|Dihydrocoumarin|benzodihydropyrone|chroman-2-one|hydrocoumarin|melilotic acid lactone|melilotic lactone|melilotin|melilotol|o-hydroxydihydrocinnamic acid lactone|o-hydroxyhydrocinnamic acid delta-lactone|oxochroman http://purl.obolibrary.org/obo/CHEBI_16151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16152 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate kegg.compound:C11554 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,4-bisphosphate|PtsIns(3,4)P2|PtsIns-3,4-P2 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4-bis(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,4-bisphosphate|PtsIns(3,4)P2|PtsIns-3,4-P2 http://purl.obolibrary.org/obo/CHEBI_16152 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16153 biolink:ChemicalEntity N-acetyllactosamine A β-D-galactopyranosyl-(1→4)-N-acetyl-D-glucosamine having β-configuration at the reducing end anomeric centre. cas:32181-59-2|glygen:G00055MO|glytoucan:G00055MO|kegg.compound:C00611|kegg.glycan:G00246|pubmed:11181561|pubmed:11429474|pubmed:14631106|pubmed:14672941|pubmed:16966407|pubmed:18280060|pubmed:18849325|pubmed:19443021|pubmed:19486884|pubmed:21496117|pubmed:2457603|pubmed:25568069|pubmed:26802542|pubmed:31537530|pubmed:7706263|pubmed:8737251|reaxys:1440779 Graph 2-(acetylamino)-2-deoxy-4-O-beta-D-galactopyranosyl-beta-D-glucopyranose|Galb1-4GlcNAcb|Galbeta1-4GlcNAcbeta|LacNAc|N-Acetyllactosamine|N-acetyllactosamine|beta-D-Galactosyl-1,4-N-acetyl-D-glucosamine|beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranose|beta-D-glucopyranose, 2-(acetylamino)-2-deoxy-4-O-beta-D-galactopyranosyl- beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranose 2-(acetylamino)-2-deoxy-4-O-beta-D-galactopyranosyl-beta-D-glucopyranose|Galb1-4GlcNAcb|Galbeta1-4GlcNAcbeta|LacNAc|N-Acetyllactosamine|N-acetyllactosamine|beta-D-Galactosyl-1,4-N-acetyl-D-glucosamine|beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranose|beta-D-glucopyranose, 2-(acetylamino)-2-deoxy-4-O-beta-D-galactopyranosyl- http://purl.obolibrary.org/obo/CHEBI_16153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16154 biolink:ChemicalEntity L-gulonic acid A gulonic acid formed by oxidising the aldehyde group of L-gulose to a carboxylic acid group. cas:526-97-6|hmdb:HMDB0003290|kegg.compound:C00800|pubmed:23970495 Graph Gulonic acid|L-Gulonic acid|L-gulonic acid L-Gulonic acid|L-gulonic acid Gulonic acid|L-Gulonic acid|L-gulonic acid http://purl.obolibrary.org/obo/CHEBI_16154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16155 biolink:ChemicalEntity myo-inositol 1,3,4,6-tetrakisphosphate A myo-inositol tetrakisphosphate having the phosphate groups placed at the 1-, 3-, 4- and 6-positions. beilstein:6992533|cas:110298-84-5|kegg.compound:C04477|pdb-ccd:I4P Graph 1D-myo-Inositol 1,3,4,6-tetrakisphosphate|D-myo-Inositol 1,3,4,6-tetrakisphosphate|Inositol 1,3,4,6-tetrakisphosphate|Inositol-1,3,4,6-tetrakisphosphate|Inositol-1,3,4,6-tetraphosphate|Ins-1,3,4,6-P4|myo-Inositol-1,3,4,6-tetrakisphosphate|myo-inositol 1,3,4,6-tetrakis(dihydrogen phosphate) myo-inositol 1,3,4,6-tetrakis(dihydrogen phosphate) 1D-myo-Inositol 1,3,4,6-tetrakisphosphate|D-myo-Inositol 1,3,4,6-tetrakisphosphate|Inositol 1,3,4,6-tetrakisphosphate|Inositol-1,3,4,6-tetrakisphosphate|Inositol-1,3,4,6-tetraphosphate|Ins-1,3,4,6-P4|myo-Inositol-1,3,4,6-tetrakisphosphate|myo-inositol 1,3,4,6-tetrakis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16157 biolink:ChemicalEntity D-arabinonate Conjugate base of D-arabinonic acid. beilstein:3589753|kegg.compound:C00878 Graph D-Arabinonate|D-arabinonate D-Arabinonate|D-arabinonate D-Arabinonate|D-arabinonate http://purl.obolibrary.org/obo/CHEBI_16157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16158 biolink:ChemicalEntity steroid sulfate A sulfuric ester obtained by the formal condensation of a hydroxy group of any steroid with sulfuric acid. kegg.compound:C02590 Graph Phenolic steroid O-sulfate|Steroid O-sulfate|steroid O-sulfates|steroid sulfates Phenolic steroid O-sulfate|Steroid O-sulfate|steroid O-sulfates|steroid sulfates http://purl.obolibrary.org/obo/CHEBI_16158 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16159 biolink:ChemicalEntity sulochrin A benzophenone that is the methyl ester of 2-(2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoic acid. cas:519-57-3|kegg.compound:C00495|knapsack:C00000572|pubmed:10450959|pubmed:12195960|pubmed:15129726|pubmed:19038408|pubmed:19452466|pubmed:5838081|pubmed:5948239|pubmed:9592574|pubmed:9831326|reaxys:2170800 Graph Sulochrin|methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoate methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoate Sulochrin|methyl 2-(2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoate http://purl.obolibrary.org/obo/CHEBI_16159 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16160 biolink:ChemicalEntity O-succinyl-L-homoserine The O-succinyl derivative of L-homoserine. cas:1492-23-5|kegg.compound:C01118|knapsack:C00019621|metacyc.compound:O-SUCCINYL-L-HOMOSERINE|pubmed:14607989|pubmed:22855027|pubmed:2405903|pubmed:24291053|reaxys:1973467 Graph (2S)-2-amino-4-(3-carboxypropanoyloxy)butanoic acid|O-Succinyl-L-homoserine|O-Succinylhomoserine|O-succinyl-L-homoserine|O4-Succinyl-L-homoserine (2S)-2-amino-4-(3-carboxypropanoyloxy)butanoic acid (2S)-2-amino-4-(3-carboxypropanoyloxy)butanoic acid|O-Succinyl-L-homoserine|O-Succinylhomoserine|O-succinyl-L-homoserine|O4-Succinyl-L-homoserine http://purl.obolibrary.org/obo/CHEBI_16160 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16161 biolink:ChemicalEntity CoA-disulfide An organic disulfide obtained via oxidative dimerisation of coenzyme A. cas:31664-36-5|kegg.compound:C02015|pubmed:410791|pubmed:7007371|pubmed:8324473|pubmed:9488707|reaxys:4872608 Graph (CoA)2|CoA disulfide|Coenzyme A disulfide (CoA)2|CoA disulfide|Coenzyme A disulfide http://purl.obolibrary.org/obo/CHEBI_16161 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16162 biolink:ChemicalEntity o-orsellinate A dihydroxybenzoate that is the conjugate base of o-orsellinic acid. metacyc.compound:CPD-47|reaxys:14405027 Graph 2,4-dihydroxy-6-methylbenzoate|orsellinate 2,4-dihydroxy-6-methylbenzoate 2,4-dihydroxy-6-methylbenzoate|orsellinate http://purl.obolibrary.org/obo/CHEBI_16162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16163 biolink:ChemicalEntity S-carboxymethyl-L-cysteine An L-cysteine thioether that is L-cysteine in which the hydrogen of the thiol group has been replaced by a carboxymethyl group. cas:638-23-3|drugcentral:4160|gmelin:1043764|hmdb:HMDB0029415|kegg.compound:C03727|kegg.drug:D00175|metacyc.compound:CPD-44|pdb-ccd:CCS|pubmed:19126298|pubmed:22497630|pubmed:23728642|reaxys:1725012|wikipedia.en:Carbocisteine Graph (2R)-2-amino-3-[(carboxymethyl)sulfanyl]propanoic acid|(L)-2-Amino-3-(carboxymethylthio)propionic acid|(R)-S-(carboxymethyl)cysteine|L-3-((carboxymethyl)thio)alanine|L-Carbocisteine|Mucodyne|S-(carboxymethyl)-(R)-cysteine|S-(carboxymethyl)-L-cysteine|S-Carboxymethyl-L-cysteine|S-carboxymethylcysteine|carbocisteina|carbocisteine|carbocisteinum|carbocysteine (2R)-2-amino-3-[(carboxymethyl)sulfanyl]propanoic acid|S-(carboxymethyl)-L-cysteine (2R)-2-amino-3-[(carboxymethyl)sulfanyl]propanoic acid|(L)-2-Amino-3-(carboxymethylthio)propionic acid|(R)-S-(carboxymethyl)cysteine|L-3-((carboxymethyl)thio)alanine|L-Carbocisteine|Mucodyne|S-(carboxymethyl)-(R)-cysteine|S-(carboxymethyl)-L-cysteine|S-Carboxymethyl-L-cysteine|S-carboxymethylcysteine|carbocisteina|carbocisteine|carbocisteinum|carbocysteine http://purl.obolibrary.org/obo/CHEBI_16163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16164 biolink:ChemicalEntity pyrogallol A benzenetriol carrying hydroxy groups at positions 1, 2 and 3. cas:87-66-1|hmdb:HMDB0013674|kegg.compound:C01108|knapsack:C00002670|metacyc.compound:PYROGALLOL|pubmed:10427737|pubmed:18506365|pubmed:18760383|pubmed:19948158|pubmed:24415452|pubmed:24458986|reaxys:907431|umbbd.compound:c0025|wikipedia.en:Pyrogallol Graph 1,2,3-Benzenetriol|1,2,3-Trihydroxybenzene|1,2,3-trihydroxybenzene|Pyrogallic acid|Pyrogallol|benzene-1,2,3-triol benzene-1,2,3-triol 1,2,3-Benzenetriol|1,2,3-Trihydroxybenzene|1,2,3-trihydroxybenzene|Pyrogallic acid|Pyrogallol|benzene-1,2,3-triol http://purl.obolibrary.org/obo/CHEBI_16164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16168 biolink:ChemicalEntity 6-hydroxynicotinic acid A monohydroxypyridine that is the 6-hydroxy derivative of nicotinic acid. cas:5006-66-6|chemspider:65756|foodb.food:FDB023041|hmdb:HMDB0002658|kegg.compound:C01020|knapsack:C00007415|patent:EP0152948|patent:EP0152949|pdb-ccd:OA7|pubmed:13463004|pubmed:14389240|pubmed:15759292|pubmed:18338586|pubmed:21389975|pubmed:22770225|pubmed:30810301|pubmed:31697703|pubmed:3926801|pubmed:5079068|pubmed:5128334|pubmed:5128335|pubmed:5498533|pubmed:5767303|reaxys:115991 Graph 6-Hydroxynicotinate|6-Hydroxynicotinic acid|6-hydroxypyridine-3-carboxylic acid 6-hydroxypyridine-3-carboxylic acid 6-Hydroxynicotinate|6-Hydroxynicotinic acid|6-hydroxypyridine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:161680 biolink:ChemicalEntity aztreonam A synthetic monocyclic β-lactam antibiotic (monobactam), used primarily to treat infections caused by Gram-negative bacteria. It inhibits mucopeptide synthesis in the bacterial cell wall, thereby blocking peptidoglycan crosslinking. beilstein:3577211|cas:78110-38-0|drugbank:DB00355|drugcentral:279|kegg.compound:C06840|kegg.drug:D00240|patent:NL8100571|pdb-ccd:AZR|pubmed:1384868|pubmed:15123864|pubmed:24119095|pubmed:24176390|pubmed:24369293|pubmed:25049240|pubmed:25091537|pubmed:25295210|pubmed:28543395|pubmed:29017833|reaxys:3577211|wikipedia.en:Aztreonam Graph (2S,3S)-3-{(2Z)-2-(2-ammonio-1,3-thiazol-4-yl)-2-[(2-carboxypropan-2-yloxy)imino]acetamido}-2-methyl-4-oxoazetidine-1-sulfonate|(Z,)-2-((((2-Amino-4-thiazolyl)(((2S,3S,)-2-methyl-4-oxo-1-sulfo-3-azetidinyl)carbamoyl)methylene)amino)oxy)-2-methylpropionic acid|AZT|Azactam|Primbactam|aztreonam|aztreonamum (2S,3S)-3-{(2Z)-2-(2-ammonio-1,3-thiazol-4-yl)-2-[(2-carboxypropan-2-yloxy)imino]acetamido}-2-methyl-4-oxoazetidine-1-sulfonate (2S,3S)-3-{(2Z)-2-(2-ammonio-1,3-thiazol-4-yl)-2-[(2-carboxypropan-2-yloxy)imino]acetamido}-2-methyl-4-oxoazetidine-1-sulfonate|(Z,)-2-((((2-Amino-4-thiazolyl)(((2S,3S,)-2-methyl-4-oxo-1-sulfo-3-azetidinyl)carbamoyl)methylene)amino)oxy)-2-methylpropionic acid|AZT|Azactam|Primbactam|aztreonam|aztreonamum http://purl.obolibrary.org/obo/CHEBI_161680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16169 biolink:ChemicalEntity homogentisate A dihydroxy monocarboxylic acid anion that is the conjugate base of (2,6-dihydroxyphenyl)acetic (homogentisic) acid, arising from deprotonation of the carboxy group. kegg.compound:C00544|reaxys:3668593|umbbd.compound:c0108 Graph (2,5-dihydroxyphenyl)acetate|homogentisate (2,5-dihydroxyphenyl)acetate (2,5-dihydroxyphenyl)acetate|homogentisate http://purl.obolibrary.org/obo/CHEBI_16169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16170 biolink:ChemicalEntity mercury(0) Elemental mercury of oxidation state zero. cas:7439-97-6|kegg.compound:C01319|umbbd.compound:c0387|wikipedia.en:Mercury_(element) Graph Elemental mercury|Hg|Hg(0)|Hgn|Mercury|mercury|mercury(0)|metallic mercury Mercury|mercury Elemental mercury|Hg|Hg(0)|Hgn|Mercury|mercury|mercury(0)|metallic mercury http://purl.obolibrary.org/obo/CHEBI_16170 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16171 biolink:ChemicalEntity NMN zwitterion beilstein:3570187|cas:1094-61-7|kegg.compound:C00455|knapsack:C00019694|pdb-ccd:NMN Graph 3-(aminocarbonyl)-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium|3-(aminocarbonyl)-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium, inner salt|3-carbamoyl-1-[5-O-(hydroxyphosphinato)-beta-D-ribofuranosyl]pyridinium|NMN|Nicotinamide D-ribonucleotide|Nicotinamide mononucleotide|Nicotinamide nucleotide|Nicotinamide ribonucleotide|beta-Nicotinamide D-ribonucleotide|beta-Nicotinamide mononucleotide|beta-Nicotinamide ribonucleotide 3-carbamoyl-1-[5-O-(hydroxyphosphinato)-beta-D-ribofuranosyl]pyridinium 3-(aminocarbonyl)-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium|3-(aminocarbonyl)-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium, inner salt|3-carbamoyl-1-[5-O-(hydroxyphosphinato)-beta-D-ribofuranosyl]pyridinium|NMN|Nicotinamide D-ribonucleotide|Nicotinamide mononucleotide|Nicotinamide nucleotide|Nicotinamide ribonucleotide|beta-Nicotinamide D-ribonucleotide|beta-Nicotinamide mononucleotide|beta-Nicotinamide ribonucleotide http://purl.obolibrary.org/obo/CHEBI_16171 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16172 biolink:ChemicalEntity neryl diphosphate A polyprenol diphosphate having neryl as the polyprenyl component. cas:16751-02-3|kegg.compound:C02569|lipidmaps:LMPR0102010002 Graph (2Z)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate|Neryl diphosphate|Neryl pyrophosphate (2Z)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate (2Z)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate|Neryl diphosphate|Neryl pyrophosphate http://purl.obolibrary.org/obo/CHEBI_16172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16173 biolink:ChemicalEntity aldehydo-N-acyl-D-mannosamine 6-phosphate kegg.compound:C00686 Graph N-Acyl-D-mannosamine 6-phosphate|N-acyl-D-mannosamine 6-phosphates N-Acyl-D-mannosamine 6-phosphate|N-acyl-D-mannosamine 6-phosphates http://purl.obolibrary.org/obo/CHEBI_16173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16174 biolink:ChemicalEntity dADP A purine 2'-deoxyribonucleoside 5'-diphosphate having adenine as the nucleobase. hmdb:HMDB0001508|kegg.compound:C00206|pdb-ccd:DAT|pubmed:11947151|pubmed:1545776|pubmed:23721485|pubmed:5316336|pubmed:5316337|pubmed:5316338|pubmed:6980023|wikipedia.en:Deoxyadenosine_diphosphate Graph 2'-DEOXYADENOSINE-5'-DIPHOSPHATE|2'-Deoxyadenosine 5'-diphosphate|2'-deoxyadenosine 5'-(trihydrogen diphosphate)|2'-deoxyadenosine 5'-diphosphate|dADP|deoxyadenosine diphosphate 2'-Deoxyadenosine 5'-diphosphate|2'-deoxyadenosine 5'-(trihydrogen diphosphate)|2'-deoxyadenosine 5'-diphosphate 2'-DEOXYADENOSINE-5'-DIPHOSPHATE|2'-Deoxyadenosine 5'-diphosphate|2'-deoxyadenosine 5'-(trihydrogen diphosphate)|2'-deoxyadenosine 5'-diphosphate|dADP|deoxyadenosine diphosphate http://purl.obolibrary.org/obo/CHEBI_16174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16175 biolink:ChemicalEntity cholest-4-en-3-one A cholestanoid that is cholest-4-ene substituted by an oxo group at position 3. cas:601-57-0|foodb.food:FDB022319|hmdb:HMDB0000921|kegg.compound:C00599|knapsack:C00036093|lipidmaps:LMST01010015|metacyc.compound:CPD-323|pdb-ccd:K2B|pubmed:10566877|pubmed:11958788|pubmed:12036855|pubmed:12777473|pubmed:12943786|pubmed:14597406|pubmed:17496168|pubmed:20671299|pubmed:24465993|pubmed:24565079|pubmed:24927729|pubmed:29201491|pubmed:29413944|pubmed:29573289|pubmed:31477154|pubmed:6892636 Graph 4-Cholesten-3-one|4-cholesten-3-one|Cholest-4-en-3-one|Cholestenone|cholest-4-en-3-one Cholest-4-en-3-one|cholest-4-en-3-one 4-Cholesten-3-one|4-cholesten-3-one|Cholest-4-en-3-one|Cholestenone|cholest-4-en-3-one http://purl.obolibrary.org/obo/CHEBI_16175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16176 biolink:ChemicalEntity D-ornithine The D-enantiomer of ornithine. It is an intermediate metabolite produced in the urea cycle. cas:348-66-3|gmelin:431663|hmdb:HMDB0003374|kegg.compound:C00515|metacyc.compound:CPD-217|pdb-ccd:ORD|pubmed:21525873|pubmed:24326351|pubmed:24562332|reaxys:1722297 Graph (2R)-2,5-diaminopentanoic acid|(R)-ornithine|D-Ornithine|D-ornithine (2R)-2,5-diaminopentanoic acid|D-Ornithine|D-ornithine (2R)-2,5-diaminopentanoic acid|(R)-ornithine|D-Ornithine|D-ornithine http://purl.obolibrary.org/obo/CHEBI_16176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16177 biolink:ChemicalEntity vicianose cas:14116-69-9|glytoucan:G42865BX|kegg.compound:C01625|kegg.glycan:G00688|knapsack:C00001155 Graph 6-O-alpha-L-arabinopyranosyl-D-glucopyranose|O-alpha-L-Arabinopyranosyl-(1-6)-D-glucopyranose|O-alpha-L-Arabinopyranosyl-(1-6)-beta-D-glucopyranose|Vicianose|alpha-L-arabinopyranosyl-(1->-6)-beta-D-glucopyranose|vicianose alpha-L-arabinopyranosyl-(1->-6)-beta-D-glucopyranose 6-O-alpha-L-arabinopyranosyl-D-glucopyranose|O-alpha-L-Arabinopyranosyl-(1-6)-D-glucopyranose|O-alpha-L-Arabinopyranosyl-(1-6)-beta-D-glucopyranose|Vicianose|alpha-L-arabinopyranosyl-(1->-6)-beta-D-glucopyranose|vicianose http://purl.obolibrary.org/obo/CHEBI_16177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16179 biolink:ChemicalEntity retinyl ester A carboxylic ester obtained by formal condensation of the hydroxy group of retinol with the carboxy group of any carboxylic acid. Graph Retinyl ester|retinyl ester|retinyl esters Retinyl ester|retinyl ester|retinyl esters http://purl.obolibrary.org/obo/CHEBI_16179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16180 biolink:ChemicalEntity N-acylglycine An N-acyl-amino acid in which amino acid specified is glycine. kegg.compound:C02055|metacyc.compound:CPD-426 Graph N-Acylglycine N-Acylglycine http://purl.obolibrary.org/obo/CHEBI_16180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16181 biolink:ChemicalEntity 1-amino-1-deoxy-scyllo-inositol kegg.compound:C01214 Graph (1,3,5/2,4,6)-6-aminocyclohexane-1,2,3,4,5-pentol|(1R,2S,3r,4R,5S,6s)-6-aminocyclohexane-1,2,3,4,5-pentol|1-Amino-1-deoxy-scyllo-inositol|1-amino-1-deoxy-scyllo-inositol|scyllo-Inosamine 1-Amino-1-deoxy-scyllo-inositol|1-amino-1-deoxy-scyllo-inositol (1,3,5/2,4,6)-6-aminocyclohexane-1,2,3,4,5-pentol|(1R,2S,3r,4R,5S,6s)-6-aminocyclohexane-1,2,3,4,5-pentol|1-Amino-1-deoxy-scyllo-inositol|1-amino-1-deoxy-scyllo-inositol|scyllo-Inosamine http://purl.obolibrary.org/obo/CHEBI_16181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16182 biolink:ChemicalEntity 2-methylbutanal A methylbutanal in which the methyl substituent is at position 2. cas:96-17-3|hmdb:HMDB0031526|kegg.compound:C02223|pubmed:15667998|pubmed:23461409|pubmed:24281757|pubmed:24295708|pubmed:25148982|pubmed:25315151|reaxys:1633540 Graph 2-Methylbutanal|2-Methylbutyraldehyde|2-methylbutanal|2-methylbutyraldehyde 2-Methylbutanal|2-methylbutanal 2-Methylbutanal|2-Methylbutyraldehyde|2-methylbutanal|2-methylbutyraldehyde http://purl.obolibrary.org/obo/CHEBI_16182 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16183 biolink:ChemicalEntity methane A one-carbon compound in which the carbon is attached by single bonds to four hydrogen atoms. It is a colourless, odourless, non-toxic but flammable gas (b.p. −161°C). cas:74-82-8|gmelin:59|hmdb:HMDB0002714|kegg.compound:C01438|metacyc.compound:CH4|patent:FR994032|patent:US2583090|pubmed:17791569|pubmed:23104415|pubmed:23353606|pubmed:23376302|pubmed:23397538|pubmed:23718889|pubmed:23739479|pubmed:23742231|pubmed:23756351|pubmed:24132456|pubmed:24161402|pubmed:24259373|reaxys:1718732|umbbd.compound:c0095|wikipedia.en:Methane Graph CH4|Methan|Methane|marsh gas|metano|methane|methyl hydride|tetrahydridocarbon Methane|methane|tetrahydridocarbon CH4|Methan|Methane|marsh gas|metano|methane|methyl hydride|tetrahydridocarbon http://purl.obolibrary.org/obo/CHEBI_16183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16184 biolink:ChemicalEntity 7-O-acetylsalutaridinol beilstein:6826994|kegg.compound:C05322 Graph 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7alpha-yl acetate|7-O-Acetylsalutaridinol|7-O-acetylsalutaridinol|Salutaridinol acetate 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7alpha-yl acetate 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7alpha-yl acetate|7-O-Acetylsalutaridinol|7-O-acetylsalutaridinol|Salutaridinol acetate http://purl.obolibrary.org/obo/CHEBI_16184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16185 biolink:ChemicalEntity N(5)-acyl-L-ornithine ester kegg.compound:C03625 Graph N5-Acyl-L-ornithine ester N5-Acyl-L-ornithine ester http://purl.obolibrary.org/obo/CHEBI_16185 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:16187 biolink:ChemicalEntity 1-piperideine-2-carboxylate A piperidinecarboxylate that is the conjugate base of 1-piperideine-2-carboxylic acid. metacyc.compound:DELTA1-PIPERIDEINE-2-CARBOXYLATE|pubmed:11686926|pubmed:15561717|pubmed:16192274|pubmed:1680851|pubmed:17259313|pubmed:2118517|pubmed:2871015|pubmed:33924554|pubmed:6801013|pubmed:7181096 Graph 1,2-didehydropipecolate|1,2-didehydropiperidine-2-carboxylate|3,4,5,6-tetrahydropyridine-2-carboxylate|Delta(1)-piperideine-2-carboxylate|delta(1)-piperideine-2-carboxylate 3,4,5,6-tetrahydropyridine-2-carboxylate 1,2-didehydropipecolate|1,2-didehydropiperidine-2-carboxylate|3,4,5,6-tetrahydropyridine-2-carboxylate|Delta(1)-piperideine-2-carboxylate|delta(1)-piperideine-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_16187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16188 biolink:ChemicalEntity octan-1-ol An octanol carrying the hydroxy group at position 1. cas:111-87-5|gmelin:82528|kegg.compound:C00756|knapsack:C00001264|pdb-ccd:OC9|pubmed:19846748|pubmed:20954704|pubmed:21485271|pubmed:24290301|pubmed:29881455|pubmed:32707169|pubmed:33099596|pubmed:33531600|pubmed:34003632|pubmed:35071860|pubmed:35779097|pubmed:35985434|pubmed:36130986|pubmed:36171735|reaxys:1697461|umbbd.compound:c0045 Graph 1-Octanol|1-Oktanol|1-hydroxyoctane|OCTAN-1-OL|capryl alcohol|caprylic alcohol|n-heptyl carbinol|n-octan-1-ol|octan-1-ol|primary octyl alcohol OCTAN-1-OL|octan-1-ol 1-Octanol|1-Oktanol|1-hydroxyoctane|OCTAN-1-OL|capryl alcohol|caprylic alcohol|n-heptyl carbinol|n-octan-1-ol|octan-1-ol|primary octyl alcohol http://purl.obolibrary.org/obo/CHEBI_16188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16189 biolink:ChemicalEntity sulfate A sulfur oxoanion obtained by deprotonation of both OH groups of sulfuric acid. cas:14808-79-8|gmelin:2120|hmdb:HMDB0001448|kegg.compound:C00059|kegg.drug:D05963|metacyc.compound:SULFATE|pdb-ccd:SO4|pubmed:11200094|pubmed:11452993|pubmed:11581495|pubmed:11798107|pubmed:12166931|pubmed:12668033|pubmed:14597181|pubmed:15093386|pubmed:15984785|pubmed:16186560|pubmed:16345535|pubmed:16347366|pubmed:16348007|pubmed:16483812|pubmed:16534979|pubmed:16656509|pubmed:16742508|pubmed:16742518|pubmed:17120760|pubmed:17420092|pubmed:17439666|pubmed:17709180|pubmed:18398178|pubmed:18815700|pubmed:18846414|pubmed:19047345|pubmed:19244483|pubmed:19544990|pubmed:19628332|pubmed:19812358|pubmed:30398859|reaxys:3648446|wikipedia.en:Sulfate Graph SO4(2-)|SULFATE ION|Sulfate|Sulfate anion(2-)|Sulfate dianion|Sulfate(2-)|Sulfuric acid ion(2-)|[SO4](2-)|sulfate|sulphate|sulphate ion|tetraoxidosulfate(2-)|tetraoxosulfate(2-)|tetraoxosulfate(VI) Sulfate|sulfate|tetraoxidosulfate(2-)|tetraoxosulfate(2-)|tetraoxosulfate(VI) SO4(2-)|SULFATE ION|Sulfate|Sulfate anion(2-)|Sulfate dianion|Sulfate(2-)|Sulfuric acid ion(2-)|[SO4](2-)|sulfate|sulphate|sulphate ion|tetraoxidosulfate(2-)|tetraoxosulfate(2-)|tetraoxosulfate(VI) http://purl.obolibrary.org/obo/CHEBI_16189 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16190 biolink:ChemicalEntity cis-cyclohexa-3,5-diene-1,2-diol The cis-stereoisomer of cyclohexa-3,5-diene-1,2-diol. beilstein:2205169|cas:17793-95-2|gmelin:200913|kegg.compound:C04091|reaxys:2205169|umbbd.compound:c0143 Graph Cis-1,2-dihydrobenzene-1,2-diol|cis-1,2-Dihydrobenzene-1,2-diol|cis-Benzeneglycol|cis-Cyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-cyclohexa-3,5-diene-1,2-diol rel-(1R,2S)-cyclohexa-3,5-diene-1,2-diol Cis-1,2-dihydrobenzene-1,2-diol|cis-1,2-Dihydrobenzene-1,2-diol|cis-Benzeneglycol|cis-Cyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-cyclohexa-3,5-diene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16190 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16192 biolink:ChemicalEntity 2'-deoxyguanosine 5'-monophosphate A purine 2'-deoxyribonucleoside 5'-monophosphate having guanine as the nucleobase. cas:902-04-5|drugbank:DB04457|ecmdb:ECMDB01044|hmdb:HMDB0001044|kegg.compound:C00362|knapsack:C00019356|metacyc.compound:DGMP|pdb-ccd:DGP|pubmed:13610867|pubmed:20085298|pubmed:21720611|pubmed:23365666|pubmed:2559771|pubmed:9858930|reaxys:58430|wikipedia.en:Deoxyguanosine_monophosphate|ymdb:YMDB00506 Graph 2'-Deoxy-GMP|2'-Deoxyguanosine 5'-(dihydrogen phosphate)|2'-Deoxyguanosine 5'-monophosphate|2'-Deoxyguanosine 5'-phosphate|2'-Deoxyguanylic acid|2'-dGMP|2'-deoxy-5'-guanylic acid|2'-deoxyguanosine 5'-monophosphate|Deoxy-GMP|Deoxyguanosine 5'-monophosphate|Deoxyguanosine 5'-phosphate|Deoxyguanosine monophosphate|Deoxyguanylic acid|dGMP 2'-deoxy-5'-guanylic acid 2'-Deoxy-GMP|2'-Deoxyguanosine 5'-(dihydrogen phosphate)|2'-Deoxyguanosine 5'-monophosphate|2'-Deoxyguanosine 5'-phosphate|2'-Deoxyguanylic acid|2'-dGMP|2'-deoxy-5'-guanylic acid|2'-deoxyguanosine 5'-monophosphate|Deoxy-GMP|Deoxyguanosine 5'-monophosphate|Deoxyguanosine 5'-phosphate|Deoxyguanosine monophosphate|Deoxyguanylic acid|dGMP http://purl.obolibrary.org/obo/CHEBI_16192 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16193 biolink:ChemicalEntity 3-hydroxybenzoate A monohydroxybenzoate that is the conjugate base of 3-hydroxybenzoic acid. gmelin:327380|kegg.compound:C00587|metacyc.compound:3-HYDROXYBENZOATE|reaxys:3904772|umbbd.compound:c0187 Graph 3-hydroxybenzoate 3-hydroxybenzoate 3-hydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_16193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16196 biolink:ChemicalEntity oleic acid An octadec-9-enoic acid in which the double bond at C-9 has Z (cis) stereochemistry. cas:112-80-1|drugbank:DB04224|drugcentral:3400|ecmdb:ECMDB21348|gmelin:109551|gmelin:57556|hmdb:HMDB0000207|kegg.compound:C00712|kegg.drug:D02315|knapsack:C00001232|lipidmaps:LMFA01030002|pdb-ccd:OLA|pubmed:11304127|pubmed:15325315|pubmed:15723125|pubmed:18772370|pubmed:19761868|pubmed:23844805|pubmed:24819471|pubmed:25584012|pubmed:25794012|pubmed:5332408|pubmed:6205897|reaxys:1726542|wikipedia.en:Oleic_acid Graph (9Z)-Octadecenoic acid|(9Z)-octadec-9-enoic acid|(Z)-Octadec-9-enoic acid|18:1 n-9|18:1Delta9cis|C18:1 n-9|FA 18:1|OLEIC ACID|Octadec-9-enoic acid|Oelsaeure|Oleate|Oleic acid|cis-9-octadecenoic acid|cis-Delta(9)-octadecenoic acid|cis-oleic acid (9Z)-octadec-9-enoic acid|Octadec-9-enoic acid (9Z)-Octadecenoic acid|(9Z)-octadec-9-enoic acid|(Z)-Octadec-9-enoic acid|18:1 n-9|18:1Delta9cis|C18:1 n-9|FA 18:1|OLEIC ACID|Octadec-9-enoic acid|Oelsaeure|Oleate|Oleic acid|cis-9-octadecenoic acid|cis-Delta(9)-octadecenoic acid|cis-oleic acid http://purl.obolibrary.org/obo/CHEBI_16196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16197 biolink:ChemicalEntity N-acylsphingosine 1-phosphate A ceramide phosphate compound having the phosphate group in the 1-position and an unspecified acyl group atached to the nitrogen atom. kegg.compound:C02960|lipidmaps:LMSP02050000 Graph Ceramide 1-phosphate|Ceramide phosphate|N-(acyl)-sphing-4-enine-1-phosphate|N-Acyl ceramide phosphate|ceramide 1-phosphates Ceramide 1-phosphate|Ceramide phosphate|N-(acyl)-sphing-4-enine-1-phosphate|N-Acyl ceramide phosphate|ceramide 1-phosphates http://purl.obolibrary.org/obo/CHEBI_16197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16199 biolink:ChemicalEntity urea A carbonyl group with two C-bound amine groups. The commercially available fertilizer has an analysis of 46-0-0 (N-P2O5-K2O). cas:57-13-6|drugbank:DB03904|drugcentral:4264|ecmdb:ECMDB04172|gmelin:1378|hmdb:HMDB0000294|kegg.compound:C00086|kegg.drug:D00023|knapsack:C00007314|metacyc.compound:UREA|pdb-ccd:URE|ppdb:1728|pubmed:18037357|pubmed:22770225|reaxys:635724|umbbd.compound:c0165|wikipedia.en:Urea|ymdb:YMDB00003 Graph 1728|Carbamide|E927b|H2NC(O)NH2|Harnstoff|Karbamid|UREA|Urea|carbamide|carbonyldiamide|ur|urea|uree UREA|Urea|urea 1728|Carbamide|E927b|H2NC(O)NH2|Harnstoff|Karbamid|UREA|Urea|carbamide|carbonyldiamide|ur|urea|uree http://purl.obolibrary.org/obo/CHEBI_16199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16200 biolink:ChemicalEntity questin A dihydroxyanthraquinone that is 1,6-dihyroxy-9,10-anthraquinone which is substituted by a methyl group at position 3 and a methoxy group at position 8. beilstein:2061188|cas:3774-64-9|kegg.compound:C01448|knapsack:C00000570 Graph 1,6-dihydroxy-3-methyl-8-(methyloxy)anthracene-9,10-dione|1,6-dihydroxy-8-methoxy-3-methyl-9,10-anthraquinone|1,6-dihydroxy-8-methoxy-3-methylanthracene-9,10-dione|3,8-dihydroxy-1-methoxy-6-methylanthracene-9,10-dione|Questin|emodin-8-methyl ether 1,6-dihydroxy-8-methoxy-3-methylanthracene-9,10-dione 1,6-dihydroxy-3-methyl-8-(methyloxy)anthracene-9,10-dione|1,6-dihydroxy-8-methoxy-3-methyl-9,10-anthraquinone|1,6-dihydroxy-8-methoxy-3-methylanthracene-9,10-dione|3,8-dihydroxy-1-methoxy-6-methylanthracene-9,10-dione|Questin|emodin-8-methyl ether http://purl.obolibrary.org/obo/CHEBI_16200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16204 biolink:ChemicalEntity phloroglucinol A benzenetriol with hydroxy groups at position 1, 3 and 5. cas:108-73-6|drugcentral:2153|hmdb:HMDB0013675|kegg.compound:C02183|kegg.drug:D00152|knapsack:C00002665|metacyc.compound:CPD-16|pubmed:25456733|pubmed:25640118|reaxys:1341907|umbbd.compound:c0026|wikipedia.en:Phloroglucinol Graph 1,3,5-Benzenetriol|1,3,5-Trihydroxybenzene|1,3,5-trihydroxybenzene|Phloroglucinol|benzene-1,3,5-triol|s-Trihydroxybenzene benzene-1,3,5-triol 1,3,5-Benzenetriol|1,3,5-Trihydroxybenzene|1,3,5-trihydroxybenzene|Phloroglucinol|benzene-1,3,5-triol|s-Trihydroxybenzene http://purl.obolibrary.org/obo/CHEBI_16204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16205 biolink:ChemicalEntity biphenyl-2,3-diol A member of the class of hydroxybiphenyls that is 1,1'-biphenyl substituted by hydroxy groups at positions 2 and 3. cas:1133-63-7|drugbank:DB02923|kegg.compound:C02526|metacyc.compound:BIPHENYL-23-DIOL|pdb-ccd:BPY|pubmed:9951522|reaxys:1869593 Graph (1,1'-biphenyl)-2,3-diol|2,3-Dihydroxybiphenyl|2,3-biphenyldiol|3-Phenylcatechol|BIPHENYL-2,3-DIOL|Biphenyl-2,3-diol|[1,1'-biphenyl]-2,3-diol|biphenyl-2,3-diol [1,1'-biphenyl]-2,3-diol (1,1'-biphenyl)-2,3-diol|2,3-Dihydroxybiphenyl|2,3-biphenyldiol|3-Phenylcatechol|BIPHENYL-2,3-DIOL|Biphenyl-2,3-diol|[1,1'-biphenyl]-2,3-diol|biphenyl-2,3-diol http://purl.obolibrary.org/obo/CHEBI_16205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16206 biolink:ChemicalEntity sn-3-O-(geranylgeranyl)glycerol 1-phosphate beilstein:6156507|kegg.compound:C04590 Graph (2S)-2-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate|sn-3-O-(Geranylgeranyl)glycerol 1-phosphate (2S)-2-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate (2S)-2-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate|sn-3-O-(Geranylgeranyl)glycerol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_16206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16207 biolink:ChemicalEntity 3-hydroxybenzaldehyde A hydroxybenzaldehyde carrying a hydroxy substituent at position 3. cas:100-83-4|gmelin:602042|kegg.compound:C03067|pubmed:24122667|reaxys:507099|umbbd.compound:c0055|wikipedia.en:3-Hydroxybenzaldehyde Graph 3-Hydroxybenzaldehyde|3-formylphenol|3-hydroxybenzaldehyde|m-formylphenol|m-hydroxybenzaldehyde|meta-hydroxybenzaldehyde 3-Hydroxybenzaldehyde|3-hydroxybenzaldehyde 3-Hydroxybenzaldehyde|3-formylphenol|3-hydroxybenzaldehyde|m-formylphenol|m-hydroxybenzaldehyde|meta-hydroxybenzaldehyde http://purl.obolibrary.org/obo/CHEBI_16207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16208 biolink:ChemicalEntity 3-mercaptopyruvic acid A 2-oxo monocarboxylic acid that is pyruvic acid substituted by a sulfanyl group at position 3. cas:2464-23-5|ecmdb:ECMDB01368|hmdb:HMDB0001368|kegg.compound:C00957|knapsack:C00007464|metacyc.compound:3-MERCAPTO-PYRUVATE|pubmed:7054184|reaxys:1747058|wikipedia.en:3-Mercaptopyruvic_acid Graph 2-oxo-3-sulfanylpropanoic acid|3-Mercaptopyruvate|3-Mercaptopyruvic acid|3-mercapto-2-oxopropanoic acid|Mercaptopyruvate 2-oxo-3-sulfanylpropanoic acid 2-oxo-3-sulfanylpropanoic acid|3-Mercaptopyruvate|3-Mercaptopyruvic acid|3-mercapto-2-oxopropanoic acid|Mercaptopyruvate http://purl.obolibrary.org/obo/CHEBI_16208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16209 biolink:ChemicalEntity hypotaurocyamine beilstein:2355606|kegg.compound:C02419 Graph 2-(carbamimidamido)ethanesulfinic acid|2-guanidinoethanesulfinic acid|Hypotaurocyamine 2-(carbamimidamido)ethanesulfinic acid 2-(carbamimidamido)ethanesulfinic acid|2-guanidinoethanesulfinic acid|Hypotaurocyamine http://purl.obolibrary.org/obo/CHEBI_16209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16210 biolink:ChemicalEntity sinapoyltartronic acid The ester obtained from formal condensation of sinapic acid and hydroxymalonic acid. kegg.compound:C02750 Graph Sinapoyltartronate|[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]propanedioic acid|trans-sinapoyltartronate|{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}malonic acid [(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]propanedioic acid Sinapoyltartronate|[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]propanedioic acid|trans-sinapoyltartronate|{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}malonic acid http://purl.obolibrary.org/obo/CHEBI_16210 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16211 biolink:ChemicalEntity cis-2-chloro-4-carboxymethylenebut-2-en-1,4-olide The 2-chloro derivative of cis-4-carboxymethylenebut-2-en-1,4-olide. beilstein:1366698|cas:115793-61-8|kegg.compound:C04706|umbbd.compound:c0293 Graph (2E)-[4-chloro-5-oxofuran-2(5H)-ylidene]acetic acid|cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide|cis-2-Chlorodienelactone (2E)-[4-chloro-5-oxofuran-2(5H)-ylidene]acetic acid (2E)-[4-chloro-5-oxofuran-2(5H)-ylidene]acetic acid|cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide|cis-2-Chlorodienelactone http://purl.obolibrary.org/obo/CHEBI_16211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16213 biolink:ChemicalEntity coformycin An N-glycosyl in which (8R)-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol is attached to ribofuranose via a β-N3-glycosidic bond. compound The parent of the class of coformycins. cas:11033-22-0|kegg.compound:C01677|metacyc.compound:COFORMYCIN|pubmed:11913523|pubmed:14630012|pubmed:6860359|pubmed:7204504|reaxys:5609987 Graph (8R)-3-beta-D-ribofuranosyl-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol|(R)-3,4,7,8-Tetrahydro-3-beta-D-ribofuranosylimidazo(4,5-d)(1,3)diazepin-8-ol|Coformycin (8R)-3-beta-D-ribofuranosyl-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol (8R)-3-beta-D-ribofuranosyl-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol|(R)-3,4,7,8-Tetrahydro-3-beta-D-ribofuranosylimidazo(4,5-d)(1,3)diazepin-8-ol|Coformycin http://purl.obolibrary.org/obo/CHEBI_16213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16214 biolink:ChemicalEntity dolichyl phosphate cas:12698-55-4|kegg.compound:C00110|kegg.glycan:G10622 Graph Dolichol phosphate|Dolicholmonophosphate|Dolichyl monophosphate|Dolichyl phosphate|alpha-[2-methyl-4-(phosphonooxy)butyl]-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dolichol monophosphate alpha-[2-methyl-4-(phosphonooxy)butyl]-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] Dolichol phosphate|Dolicholmonophosphate|Dolichyl monophosphate|Dolichyl phosphate|alpha-[2-methyl-4-(phosphonooxy)butyl]-omega-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dolichol monophosphate http://purl.obolibrary.org/obo/CHEBI_16214 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16215 biolink:ChemicalEntity phosphonate(2-) A divalent inorganic anion obtained by removal of both protons from phosphonic acid gmelin:1618|kegg.compound:C06701|metacyc.compound:PHOSPHONATE|pdb-ccd:2PO Graph PHO3(2-)|PHOSPHONATE|Phosphonate|[PHO3](2-)|hydridotrioxidophosphate(2-)|hydridotrioxophosphate(2-)|phosphonate hydridotrioxidophosphate(2-)|hydridotrioxophosphate(2-) PHO3(2-)|PHOSPHONATE|Phosphonate|[PHO3](2-)|hydridotrioxidophosphate(2-)|hydridotrioxophosphate(2-)|phosphonate http://purl.obolibrary.org/obo/CHEBI_16215 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16216 biolink:ChemicalEntity 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid A dicarboxylic acid that is succinic acid substituted at position 2 by an acetamidomethylidene group and at position 3 by a hydroxymethyl group. kegg.compound:C04690 Graph 2-(Acetamidomethylene)-3-(hydroxymethyl)succinate|2-(Hydroxymethyl)-3-(acetamidomethylene)succinate|2-(acetamidomethylidene)-3-(hydroxymethyl)butanedioic acid 2-(acetamidomethylidene)-3-(hydroxymethyl)butanedioic acid 2-(Acetamidomethylene)-3-(hydroxymethyl)succinate|2-(Hydroxymethyl)-3-(acetamidomethylene)succinate|2-(acetamidomethylidene)-3-(hydroxymethyl)butanedioic acid http://purl.obolibrary.org/obo/CHEBI_16216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16217 biolink:ChemicalEntity D-glucono-1,5-lactone An aldono-1,5-lactone obtained from D-gluconic acid. cas:90-80-2|drugbank:DB04564|drugcentral:5144|gmelin:50890|hmdb:HMDB0000150|kegg.compound:C00198|kegg.drug:D04332|pdb-ccd:LGC|pubmed:23349779|pubmed:24392858|reaxys:83286|wikipedia.en:Gluconolactone Graph (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one|(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one|1,5-D-gluconolactone|1,5-Gluconolactone|D-Aldonolactone|D-Glucono-1,5-lactone|D-Gluconolactone|D-gluconic acid delta-lactone|D-gluconic acid lactone|D-glucono-1,5-lactone|D-threo-Aldono-1,5-lactone|Glucarolactone|Gluconic acid lactone|Gluconic lactone|Gluconolactone|delta-D-gluconolactone|delta-Gluconolactone|gluconic delta-lactone (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one|Glucarolactone (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one|(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one|1,5-D-gluconolactone|1,5-Gluconolactone|D-Aldonolactone|D-Glucono-1,5-lactone|D-Gluconolactone|D-gluconic acid delta-lactone|D-gluconic acid lactone|D-glucono-1,5-lactone|D-threo-Aldono-1,5-lactone|Glucarolactone|Gluconic acid lactone|Gluconic lactone|Gluconolactone|delta-D-gluconolactone|delta-Gluconolactone|gluconic delta-lactone http://purl.obolibrary.org/obo/CHEBI_16217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16218 biolink:ChemicalEntity beta-D-glucose 1-phosphate The β-anomer of D-glucose 1-phosphate. beilstein:87850|kegg.compound:C00663|metacyc.compound:CPD-448|reaxys:87850|wikipedia.en:Glucose-1-phosphate Graph 1-O-phosphono-beta-D-glucopyranose|1-phospho-beta-D-glucopyranose|beta-D-Glucose 1-phosphate|beta-D-glucopyranose 1-(dihydrogen phosphate) beta-D-glucopyranose 1-(dihydrogen phosphate) 1-O-phosphono-beta-D-glucopyranose|1-phospho-beta-D-glucopyranose|beta-D-Glucose 1-phosphate|beta-D-glucopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16219 biolink:ChemicalEntity cucurbitacin Any one of a class of tetracyclic triterpenoids, formally derived from the triterpene hydrocarbon cucurbitane, developed by some plants (especially those of the family Cucurbitaceaeas) as a defence mechanism against herbivores. wikipedia.en:Cucurbitacin Graph cucurbitacins cucurbitacins http://purl.obolibrary.org/obo/CHEBI_16219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16220 biolink:ChemicalEntity coniferin A monosaccharide derivative that is coniferol attached to a β-D-glucopyranosyl residue at position 1 via a glycosidic linkage. cas:531-29-3|hmdb:HMDB0013682|kegg.compound:C00761|knapsack:C00002727|metacyc.compound:CPD-1777|pubmed:22689568|pubmed:24490565|reaxys:1296933|wikipedia.en:Coniferin Graph 4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenyl beta-D-glucopyranoside|4-O-(beta-D-glucosyl)-(E)-coniferol|Coniferin|Coniferyl alcohol beta-D-glucoside 4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenyl beta-D-glucopyranoside 4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenyl beta-D-glucopyranoside|4-O-(beta-D-glucosyl)-(E)-coniferol|Coniferin|Coniferyl alcohol beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16221 biolink:ChemicalEntity sn-glycerol 1-phosphate An optically active glycerol 1-phosphate having (S)-configuration. cas:5746-57-6|kegg.compound:C00623|metacyc.compound:SN-GLYCEROL-1-PHOSPHATE|pdb-ccd:1GP|pubmed:15066037|pubmed:16428851|pubmed:8586635|reaxys:1723976 Graph (2S)-2,3-dihydroxypropyl dihydrogen phosphate|D-(glycerol 3-phosphate)|L-(glycerol 1-phosphate)|L-Glycerol 1-phosphate|SN-GLYCEROL-1-PHOSPHATE|sn-Glycerol 1-phosphate|sn-Gro-1-P|sn-glycerol 1-(dihydrogen phosphate) (2S)-2,3-dihydroxypropyl dihydrogen phosphate|sn-Glycerol 1-phosphate|sn-glycerol 1-(dihydrogen phosphate) (2S)-2,3-dihydroxypropyl dihydrogen phosphate|D-(glycerol 3-phosphate)|L-(glycerol 1-phosphate)|L-Glycerol 1-phosphate|SN-GLYCEROL-1-PHOSPHATE|sn-Glycerol 1-phosphate|sn-Gro-1-P|sn-glycerol 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16222 biolink:ChemicalEntity D-galacto-hexodialdose beilstein:2440950|kegg.compound:C03269 Graph D-galacto-Hexodialdose|D-galacto-hexodialdose D-galacto-Hexodialdose|D-galacto-hexodialdose http://purl.obolibrary.org/obo/CHEBI_16222 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16223 biolink:ChemicalEntity dimethylarsinate The arsenic oxoanion that is the conjugate base of dimethylarsinic acid. kegg.compound:C07308|pdb-ccd:CAC|pubmed:19657532|pubmed:21093857|umbbd.compound:c0753 Graph CACODYLATE ION|DMA|Dimethylarsinate|Kakodylat|Me2AsO2(-)|[As(CH3)2O2](-)|dimethylarsinate Dimethylarsinate|dimethylarsinate CACODYLATE ION|DMA|Dimethylarsinate|Kakodylat|Me2AsO2(-)|[As(CH3)2O2](-)|dimethylarsinate http://purl.obolibrary.org/obo/CHEBI_16223 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:162247 biolink:ChemicalEntity 2-cis,6-trans-farnesyl diphosphate(3-) Trianion of 2-cis,6-trans-farnesyl diphosphate arising from deprotonation of the diphosphate OH groups; major species at pH 7.3. beilstein:12225173 Graph (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate|(2Z,6E)-farnesyl diphosphate|2-cis,6-trans-farnesyl diphosphate trianion (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate|(2Z,6E)-farnesyl diphosphate|2-cis,6-trans-farnesyl diphosphate trianion http://purl.obolibrary.org/obo/CHEBI_162247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16225 biolink:ChemicalEntity S-formylglutathione A S-acylglutathione in which the acyl group specified is formyl. cas:50409-81-9|ecmdb:ECMDB01550|hmdb:HMDB0001550|kegg.compound:C01031|metacyc.compound:CPD-548|pubmed:22937752|pubmed:23274177|pubmed:2806555|reaxys:2170960|umbbd.compound:c0270|ymdb:YMDB00320 Graph L-gamma-glutamyl-S-formyl-L-cysteinylglycine|N-(S-(formyl-N-L-gamma-glutamyl)-L-cysteinyl)glycine|S-Formylglutathione L-gamma-glutamyl-S-formyl-L-cysteinylglycine L-gamma-glutamyl-S-formyl-L-cysteinylglycine|N-(S-(formyl-N-L-gamma-glutamyl)-L-cysteinyl)glycine|S-Formylglutathione http://purl.obolibrary.org/obo/CHEBI_16225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16226 biolink:ChemicalEntity limonin agr:IND44319571|cas:1180-71-8|kegg.compound:C03514|kegg.compound:C16717|kegg.drug:D00173|knapsack:C00003719|pubmed:19782062|pubmed:21338095|pubmed:22907263|pubmed:22999474|wikipedia.en:Limonin Graph (4aS,6aR,8aR,8bR,9aS,12R,12aS,14aR,14bR)-12-(3-furyl)-6,6,8a,12a-tetramethyldecahydro-3H-oxireno[d]pyrano[4',3':3,3a][2]benzofuro[5,4-f]isochromene-3,8,10(6H,9aH)-trione|7,16-Dioxo-7,16-dideoxylimondiol|Citrolimonin|Dictamnolactone|Evodia fruit|Evodin|Limonin|Limonoate D-ring-lactone|Limonoic acid, di-delta-lactone|Obaculactone|limonin|limonoic acid 3,19:16,17-dilactone (4aS,6aR,8aR,8bR,9aS,12R,12aS,14aR,14bR)-12-(3-furyl)-6,6,8a,12a-tetramethyldecahydro-3H-oxireno[d]pyrano[4',3':3,3a][2]benzofuro[5,4-f]isochromene-3,8,10(6H,9aH)-trione (4aS,6aR,8aR,8bR,9aS,12R,12aS,14aR,14bR)-12-(3-furyl)-6,6,8a,12a-tetramethyldecahydro-3H-oxireno[d]pyrano[4',3':3,3a][2]benzofuro[5,4-f]isochromene-3,8,10(6H,9aH)-trione|7,16-Dioxo-7,16-dideoxylimondiol|Citrolimonin|Dictamnolactone|Evodia fruit|Evodin|Limonin|Limonoate D-ring-lactone|Limonoic acid, di-delta-lactone|Obaculactone|limonin|limonoic acid 3,19:16,17-dilactone http://purl.obolibrary.org/obo/CHEBI_16226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16227 biolink:ChemicalEntity pyridine An azaarene comprising a benzene core in which one -CH group is replaced by a nitrogen atom. It is the parent compound of the class pyridines. cas:110-86-1|gmelin:1996|hmdb:HMDB0000926|kegg.compound:C00747|pdb-ccd:0PY|pubmed:24364496|pubmed:24425539|pubmed:8070089|reaxys:103233|wikipedia.en:Pyridine Graph Azabenzene|Pyridine|py|pyridine Pyridine|pyridine Azabenzene|Pyridine|py|pyridine http://purl.obolibrary.org/obo/CHEBI_16227 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16228 biolink:ChemicalEntity 2,2-dialkylglycine A non-proteinogenic α-amino acid that is glycine substituted by two alkyl groups at position 2. kegg.compound:C02623 Graph 2,2-Dialkylglycine|2,2-dialkylglycines 2,2-Dialkylglycine|2,2-dialkylglycines http://purl.obolibrary.org/obo/CHEBI_16228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16229 biolink:ChemicalEntity 3beta-hydroxy-5beta-pregnan-20-one The 3β-stereoisomer of 3-hydroxy-5β-pregnan-20-one. cas:128-21-2|hmdb:HMDB0001471|kegg.compound:C11825|lipidmaps:LMST02030185|pubmed:1265794|pubmed:17583491|pubmed:347637|reaxys:3035289 Graph (3beta,5beta)-3-hydroxypregnan-20-one|3-beta-hydroxy-5-beta-pregnane-20-one|3beta-Hydroxy-5beta-pregnane-20-one|3beta-hydroxy-5beta-pregnan-20-one|3beta-hydroxy-5beta-tetrahydroprogesterone|epipregnanolone 3beta-hydroxy-5beta-pregnan-20-one (3beta,5beta)-3-hydroxypregnan-20-one|3-beta-hydroxy-5-beta-pregnane-20-one|3beta-Hydroxy-5beta-pregnane-20-one|3beta-hydroxy-5beta-pregnan-20-one|3beta-hydroxy-5beta-tetrahydroprogesterone|epipregnanolone http://purl.obolibrary.org/obo/CHEBI_16229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16230 biolink:ChemicalEntity 5-hydroxypentanoate A hydroxy monocarboxylic acid anion that is the conjugate base of 5-hydroxypentanoic acid. kegg.compound:C02804|reaxys:3661453 Graph 5-Hydroxypentanoate|5-hydroxypentanoate|5-hydroxyvalerate 5-Hydroxypentanoate|5-hydroxypentanoate 5-Hydroxypentanoate|5-hydroxypentanoate|5-hydroxyvalerate http://purl.obolibrary.org/obo/CHEBI_16230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16231 biolink:ChemicalEntity cis-4-hydroxy-D-proline A 4-hydroxy-D-proline in which the hydroxy group at position 4 has R-configuration. cas:2584-71-6|chemspider:389028|hmdb:HMDB0060460|kegg.compound:C03440|pdb-ccd:UYA|pubmed:22770225|pubmed:22804907|pubmed:25678137|pubmed:26833407|pubmed:29191113|pubmed:33333077|pubmed:5082949|reaxys:81439 Graph (2R,4R)-4-hydroxypyrrolidine-2-carboxylic acid|(4R)-4-hydroxy-D-proline|cis-4-hydroxy-D-proline (4R)-4-hydroxy-D-proline (2R,4R)-4-hydroxypyrrolidine-2-carboxylic acid|(4R)-4-hydroxy-D-proline|cis-4-hydroxy-D-proline http://purl.obolibrary.org/obo/CHEBI_16231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16232 biolink:ChemicalEntity N(6)-acyl-L-lysine Any N-acyl-L-α-amino acid that is L-lysine in which the N6 amino group has been acylated. kegg.compound:C02444 Graph N(6)-acyl-L-lysines|N6-Acyl-L-lysine N(6)-acyl-L-lysines|N6-Acyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_16232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16233 biolink:ChemicalEntity (S)-cheilanthifoline cas:483-44-3|kegg.compound:C05174|knapsack:C00026087 Graph (6aS)-6,6a,11,14-Tetrahydro-8-methoxy-12H-benzo[a]-1,3-benzodioxolo[4,5-g]quinolizim-9-ol|(6aS)-6,6a,11,14-tetrahydro-8-methoxy-12H-benzo[a]-1,3-benzodioxolo[4,5-g]quinolizim-9-ol|(6aS)-9-methoxy-6,11,12,14-tetrahydro-2H,6aH-[1,3]dioxolo[4,5-h]isoquino[2,1-b]isoquinolin-8-ol|(S)-Cheilanthifoline|(S)-cheilanthifoline (6aS)-9-methoxy-6,11,12,14-tetrahydro-2H,6aH-[1,3]dioxolo[4,5-h]isoquino[2,1-b]isoquinolin-8-ol (6aS)-6,6a,11,14-Tetrahydro-8-methoxy-12H-benzo[a]-1,3-benzodioxolo[4,5-g]quinolizim-9-ol|(6aS)-6,6a,11,14-tetrahydro-8-methoxy-12H-benzo[a]-1,3-benzodioxolo[4,5-g]quinolizim-9-ol|(6aS)-9-methoxy-6,11,12,14-tetrahydro-2H,6aH-[1,3]dioxolo[4,5-h]isoquino[2,1-b]isoquinolin-8-ol|(S)-Cheilanthifoline|(S)-cheilanthifoline http://purl.obolibrary.org/obo/CHEBI_16233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16234 biolink:ChemicalEntity hydroxide cas:14280-30-9|gmelin:24714|kegg.compound:C01328|pdb-ccd:OH Graph HO-|HYDROXIDE ION|Hydroxide ion|OH(-)|OH-|hydridooxygenate(1-)|hydroxide|oxidanide hydridooxygenate(1-)|hydroxide|oxidanide HO-|HYDROXIDE ION|Hydroxide ion|OH(-)|OH-|hydridooxygenate(1-)|hydroxide|oxidanide http://purl.obolibrary.org/obo/CHEBI_16234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16235 biolink:ChemicalEntity guanine A 2-aminopurine carrying a 6-oxo substituent. cas:73-40-5|drugbank:DB02377|gmelin:431879|hmdb:HMDB0000132|kegg.compound:C00242|knapsack:C00001501|metacyc.compound:GUANINE|pdb-ccd:GUN|pubmed:22770225|pubmed:8070089|reaxys:147911|wikipedia.en:Guanine Graph 2-Amino-6-hydroxypurine|2-amino-1,9-dihydro-6H-purin-6-one|2-amino-6-oxopurine|G|GUANINE|Gua|Guanine|guanine 2-amino-1,9-dihydro-6H-purin-6-one 2-Amino-6-hydroxypurine|2-amino-1,9-dihydro-6H-purin-6-one|2-amino-6-oxopurine|G|GUANINE|Gua|Guanine|guanine http://purl.obolibrary.org/obo/CHEBI_16235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16236 biolink:ChemicalEntity ethanol A primary alcohol that is ethane in which one of the hydrogens is substituted by a hydroxy group. cas:64-17-5|drugbank:DB00898|drugcentral:1076|gmelin:787|hmdb:HMDB0000108|kegg.compound:C00469|kegg.drug:D00068|kegg.drug:D06542|knapsack:C00019560|metacyc.compound:ETOH|molbase:858|molbase:859|pdb-ccd:EOH|ppdb:1373|pubmed:11046114|pubmed:11090978|pubmed:11198720|pubmed:11200745|pubmed:11262320|pubmed:11303910|pubmed:11333032|pubmed:11505026|pubmed:11590970|pubmed:11728426|pubmed:11750186|pubmed:11754521|pubmed:11810019|pubmed:11826039|pubmed:11981228|pubmed:12824058|pubmed:12829422|pubmed:12888778|pubmed:12946583|pubmed:14674846|pubmed:15019421|pubmed:15239123|pubmed:15285839|pubmed:15464411|pubmed:15465973|pubmed:15749123|pubmed:15900217|pubmed:15902919|pubmed:16084479|pubmed:16133132|pubmed:16352430|pubmed:16390872|pubmed:16737463|pubmed:16891664|pubmed:16934862|pubmed:17043811|pubmed:17190852|pubmed:17663926|pubmed:17687877|pubmed:18095657|pubmed:18249266|pubmed:18320157|pubmed:18347649|pubmed:18408978|pubmed:18411066|pubmed:18456322|pubmed:18513832|pubmed:18922656|pubmed:18925476|pubmed:19280886|pubmed:19359288|pubmed:19384566|pubmed:19458312|pubmed:19851413|pubmed:19901811|pubmed:21600756|pubmed:21762181|pubmed:21881875|pubmed:21967628|pubmed:22019193|pubmed:22222864|pubmed:22261437|pubmed:22286266|pubmed:22306018|pubmed:22331491|pubmed:22336593|reaxys:1718733|umbbd.compound:c0038|wikipedia.en:Ethanol Graph 1-hydroxyethane|Aethanol|Aethylalkohol|Alkohol|C2H5OH|Dehydrated ethanol|ETHANOL|EtOH|Ethanol|Ethyl alcohol|Methylcarbinol|[CH2Me(OH)]|[OEtH]|alcohol|alcohol etilico|alcool ethylique|etanol|ethanol|hydroxyethane|spiritus vini ETHANOL|Ethanol|ethanol 1-hydroxyethane|Aethanol|Aethylalkohol|Alkohol|C2H5OH|Dehydrated ethanol|ETHANOL|EtOH|Ethanol|Ethyl alcohol|Methylcarbinol|[CH2Me(OH)]|[OEtH]|alcohol|alcohol etilico|alcool ethylique|etanol|ethanol|hydroxyethane|spiritus vini http://purl.obolibrary.org/obo/CHEBI_16236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16237 biolink:ChemicalEntity 4-chlorophenylacetate A monocarboxylic acid anion that results from the removal of a proton from the carboxylic acid group of 4-chlorophenylacetic acid. kegg.compound:C03077|metacyc.compound:CPD-1786|reaxys:3665314|umbbd.compound:c0385 Graph (4-chlorophenyl)acetate|4-chlorophenylacetate (4-chlorophenyl)acetate (4-chlorophenyl)acetate|4-chlorophenylacetate http://purl.obolibrary.org/obo/CHEBI_16237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16238 biolink:ChemicalEntity FAD A flavin adenine dinucleotide in which the substituent at position 10 of the flavin nucleus is a 5'-adenosyldiphosphoribityl group. beilstein:1208946|cas:146-14-5|drugbank:DB03147|gmelin:108834|kegg.compound:C00016|kegg.drug:D00005|knapsack:C00001500|pdb-ccd:FAD|pubmed:24643482|pubmed:25108762 Graph Adenosine 5'-(trihydrogen pyrophosphate), 5'-5'-ester with riboflavine|FAD|FLAVIN-ADENINE DINUCLEOTIDE|Flavin adenine dinucleotide|Riboflavin 5'-(trihydrogen diphosphate), 5'-5'-ester with adenosine|Riboflavin 5'-adenosine diphosphate|adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate)|adenosine 5'-[3-(riboflavin-5'-yl) dihydrogen diphosphate] adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate) Adenosine 5'-(trihydrogen pyrophosphate), 5'-5'-ester with riboflavine|FAD|FLAVIN-ADENINE DINUCLEOTIDE|Flavin adenine dinucleotide|Riboflavin 5'-(trihydrogen diphosphate), 5'-5'-ester with adenosine|Riboflavin 5'-adenosine diphosphate|adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate)|adenosine 5'-[3-(riboflavin-5'-yl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16239 biolink:ChemicalEntity benzyl (2R,3S)-3-hydroxy-2-methylbutanoate The (2R,3S)-stereoisomer of benzyl 2-methyl-3-hydroxybutanoate. kegg.compound:C04561 Graph Benzyl (2R,3S)-2-methyl-3-hydroxybutanoate|benzyl (2R,3S)-2-methyl-3-hydroxybutanoate|benzyl (2R,3S)-3-hydroxy-2-methylbutanoate benzyl (2R,3S)-3-hydroxy-2-methylbutanoate Benzyl (2R,3S)-2-methyl-3-hydroxybutanoate|benzyl (2R,3S)-2-methyl-3-hydroxybutanoate|benzyl (2R,3S)-3-hydroxy-2-methylbutanoate http://purl.obolibrary.org/obo/CHEBI_16239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1624 biolink:ChemicalEntity 3-oxo-5beta-steroid Any 3-oxo steroid that has β- configuration at position 5. kegg.compound:C02797|metacyc.compound:3-Oxo-5-Beta-Steroids Graph 3-oxo-5beta steroid|3-oxo-5beta steroids|3-oxo-5beta- steroid|3-oxo-5beta- steroids|3-oxo-5beta-steroids|a 3-oxo-5-beta-steroid 3-oxo-5beta steroid|3-oxo-5beta steroids|3-oxo-5beta- steroid|3-oxo-5beta- steroids|3-oxo-5beta-steroids|a 3-oxo-5-beta-steroid http://purl.obolibrary.org/obo/CHEBI_1624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16240 biolink:ChemicalEntity hydrogen peroxide An inorganic peroxide consisting of two hydroxy groups joined by a covalent oxygen-oxygen single bond. cas:7722-84-1|drugcentral:3281|gmelin:509|hmdb:HMDB0003125|kegg.compound:C00027|kegg.drug:D00008|metacyc.compound:HYDROGEN-PEROXIDE|molbase:932|pdb-ccd:PEO|ppdb:387|pubmed:10455187|pubmed:10557015|pubmed:10849784|pubmed:11033421|pubmed:11105916|pubmed:11318558|pubmed:11387393|pubmed:11809417|pubmed:11864786|pubmed:11893576|pubmed:12867293|pubmed:12934880|pubmed:14679422|pubmed:15028418|pubmed:15133946|pubmed:15298493|pubmed:16337875|pubmed:16463018|pubmed:16864869|pubmed:17020896|pubmed:17179007|pubmed:17610934|pubmed:17948137|pubmed:18179203|pubmed:18182702|pubmed:18306736|pubmed:18443210|pubmed:18592736|pubmed:19107210|pubmed:19229032|pubmed:19297450|pubmed:19509065|pubmed:26352695|pubmed:26365231|pubmed:7548021|pubmed:7581816|pubmed:8048546|pubmed:8375042|pubmed:8451754|pubmed:9051670|pubmed:9100841|pubmed:9168257|pubmed:9202721|pubmed:9558114|reaxys:3587191|wikipedia.en:Hydrogen_peroxide Graph H(2)O(2)|H2O2|HOOH|HYDROGEN PEROXIDE|Hydrogen peroxide|Oxydol|[OH(OH)]|bis(hydridooxygen)(O--O)|dihydrogen dioxide|dihydrogen peroxide|dihydrogen(peroxide)|dioxidane|hydrogen peroxide|perhydrol HYDROGEN PEROXIDE|Hydrogen peroxide|bis(hydridooxygen)(O--O)|dihydrogen peroxide|dihydrogen(peroxide)|dioxidane|hydrogen peroxide H(2)O(2)|H2O2|HOOH|HYDROGEN PEROXIDE|Hydrogen peroxide|Oxydol|[OH(OH)]|bis(hydridooxygen)(O--O)|dihydrogen dioxide|dihydrogen peroxide|dihydrogen(peroxide)|dioxidane|hydrogen peroxide|perhydrol http://purl.obolibrary.org/obo/CHEBI_16240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16241 biolink:ChemicalEntity aldehydo-D-arabinose 5-phosphate The 5-phospho derivative of D-arabinose. It is an intermediate in the synthesis of lipopolysaccharides. cas:13137-52-5|kegg.compound:C01112|metacyc.compound:ARABINOSE-5P|pubmed:12805358|pubmed:21438567|pubmed:6541043|reaxys:1728060 Graph 5-O-phosphono-D-arabinose|D-A-5-P|D-Arabinose 5-phosphate|D-arabinose 5-(dihydrogen phosphate) D-Arabinose 5-phosphate|D-arabinose 5-(dihydrogen phosphate) 5-O-phosphono-D-arabinose|D-A-5-P|D-Arabinose 5-phosphate|D-arabinose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16243 biolink:ChemicalEntity quercetin A pentahydroxyflavone having the five hydroxy groups placed at the 3-, 3'-, 4'-, 5- and 7-positions. It is one of the most abundant flavonoids in edible vegetables, fruit and wine. cas:117-39-5|drugbank:DB04216|drugcentral:3514|foodb.food:FDB011904|gmelin:579210|hmdb:HMDB0005794|kegg.compound:C00389|knapsack:C00004631|lincs.smallmolecule:LSM-4199|lipidmaps:LMPK12110004|metacyc.compound:CPD-520|patent:KR20120121684|patent:US2013012577|pdb-ccd:QUE|pubmed:16226777|pubmed:17015250|pubmed:17135030|pubmed:17426744|pubmed:18096136|pubmed:18484521|pubmed:18549926|pubmed:18564899|pubmed:18579649|pubmed:18785622|pubmed:19043800|pubmed:19461927|pubmed:22920589|pubmed:23342112|pubmed:23359794|pubmed:27565033|pubmed:27589790|pubmed:27591927|pubmed:27704720|reaxys:317313|wikipedia.en:Quercetin Graph 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one|3,3',4',5,7-pentahydroxyflavone|3,5,7,3',4'-PENTAHYDROXYFLAVONE|3,5,7,3',4'-Pentahydroxyflavone|Quercetin|sophoretin|xanthaurine 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one|3,3',4',5,7-pentahydroxyflavone|3,5,7,3',4'-PENTAHYDROXYFLAVONE|3,5,7,3',4'-Pentahydroxyflavone|Quercetin|sophoretin|xanthaurine http://purl.obolibrary.org/obo/CHEBI_16243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16244 biolink:ChemicalEntity 4-(trimethylammonio)butanoate An amino-acid betaine γ-aminobutyric acid zwitterion in which all of the hydrogens attached to the nitrogen are replaced by methyl groups. cas:407-64-7|ecmdb:ECMDB21336|hmdb:HMDB0006831|metacyc.compound:GAMMA-BUTYROBETAINE|pubmed:3148329|pubmed:398096|reaxys:3538300 Graph 3-Dehydroxycarnitine|4-(N-trimethylamino)butyrate|4-(trimethylamino)butanoate|4-(trimethylammonio)butanoate|4-butyrobetaine|Actinine|butyrobetaine|deoxycarnitine|gamma-Butyrobetain|gamma-butyrobetaine 4-(trimethylammonio)butanoate 3-Dehydroxycarnitine|4-(N-trimethylamino)butyrate|4-(trimethylamino)butanoate|4-(trimethylammonio)butanoate|4-butyrobetaine|Actinine|butyrobetaine|deoxycarnitine|gamma-Butyrobetain|gamma-butyrobetaine http://purl.obolibrary.org/obo/CHEBI_16244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16246 biolink:ChemicalEntity D-ribitol 5-phosphate The 5-phospho derivative of D-ribitol. kegg.compound:C01068|pdb-ccd:R5P|pubmed:25108762 Graph 5-O-phosphono-D-ribitol|D-Ribitol 5-phosphate|D-ribitol 5-(dihydrogen phosphate)|L-Ribitol 1-phosphate|Rbt-5-P|Ribitol 5-phosphate 5-O-phosphono-D-ribitol|D-Ribitol 5-phosphate|D-ribitol 5-(dihydrogen phosphate) 5-O-phosphono-D-ribitol|D-Ribitol 5-phosphate|D-ribitol 5-(dihydrogen phosphate)|L-Ribitol 1-phosphate|Rbt-5-P|Ribitol 5-phosphate http://purl.obolibrary.org/obo/CHEBI_16246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16247 biolink:ChemicalEntity phospholipid A lipid containing phosphoric acid as a mono- or di-ester. The term encompasses phosphatidic acids and phosphoglycerides. kegg.compound:C00865 Graph Phospholipid|a phospholipid derivative|phospholipids Phospholipid|a phospholipid derivative|phospholipids http://purl.obolibrary.org/obo/CHEBI_16247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16249 biolink:ChemicalEntity protein disulfide kegg.compound:C02582 Graph Protein disulfide|protein disulfides Protein disulfide|protein disulfides http://purl.obolibrary.org/obo/CHEBI_16249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16251 biolink:ChemicalEntity deaminohydroxyblasticidin S kegg.compound:C03860|pdb-ccd:BLO Graph 1-{4-[3-amino-5-(N-methylcarbamimidamido)pentanamido]-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl}pyrimidine-2,4(1H,3H)-dione|Deaminohydroxyblasticidin S|Desaminohydroxyblasticidin-S 1-{4-[3-amino-5-(N-methylcarbamimidamido)pentanamido]-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl}pyrimidine-2,4(1H,3H)-dione 1-{4-[3-amino-5-(N-methylcarbamimidamido)pentanamido]-2,3,4-trideoxy-beta-D-erythro-hex-2-enopyranuronosyl}pyrimidine-2,4(1H,3H)-dione|Deaminohydroxyblasticidin S|Desaminohydroxyblasticidin-S http://purl.obolibrary.org/obo/CHEBI_16251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16252 biolink:ChemicalEntity 6-methoxymellein An isochromane that is mellein bearing a methoxy substituent at position 6. cas:6803-02-7|pubmed:10552637|pubmed:12797757|pubmed:7730162|pubmed:9630860|reaxys:169582 Graph 2,4-Dihydro-8-hydroxy-6-methoxy-3-methyl-1H-2-benzopyran-1-one|3,4-dihydro-8-hydroxy-6-methoxy-3-methylisocoumarin|3-methyl-6-methoxy-8-hydroxy-3,4-dihydroisocoumarin|6-Methoxy-8-hydroxy-3-methyl-3,4-dihydroisocoumarin|6-Mhmd-isocoumarin|6-methoxymellein|8-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one|8-hydroxy-6-methoxy-3-methylisochroman-1-one 8-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one 2,4-Dihydro-8-hydroxy-6-methoxy-3-methyl-1H-2-benzopyran-1-one|3,4-dihydro-8-hydroxy-6-methoxy-3-methylisocoumarin|3-methyl-6-methoxy-8-hydroxy-3,4-dihydroisocoumarin|6-Methoxy-8-hydroxy-3-methyl-3,4-dihydroisocoumarin|6-Mhmd-isocoumarin|6-methoxymellein|8-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one|8-hydroxy-6-methoxy-3-methylisochroman-1-one http://purl.obolibrary.org/obo/CHEBI_16252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16253 biolink:ChemicalEntity 2-(acetamidomethylidene)succinic acid A dicarboxylic acid that is succinic acid substituted by a acetamidomethylidene group at position 2. kegg.compound:C01215|reaxys:2102480 Graph 2-(Acetamidomethylene)succinate|2-(acetamidomethylidene)butanedioic acid 2-(acetamidomethylidene)butanedioic acid 2-(Acetamidomethylene)succinate|2-(acetamidomethylidene)butanedioic acid http://purl.obolibrary.org/obo/CHEBI_16253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16254 biolink:ChemicalEntity 11-cis-retinyl palmitate The 11-cis-isomer of retinyl palmitate. hmdb:HMDB0060338|kegg.compound:C03455|lipidmaps:LMPR01090052|pubmed:3793734|pubmed:3875178 Graph (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate|11-cis-Retinyl palmitate|11-cis-retinyl hexadecanoate|11-cis-retinyl palmitate (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate|11-cis-Retinyl palmitate|11-cis-retinyl hexadecanoate|11-cis-retinyl palmitate http://purl.obolibrary.org/obo/CHEBI_16254 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16255 biolink:ChemicalEntity L-histidinol A histidinol that has L-configuration. cas:4836-52-6|drugbank:DB03811|hmdb:HMDB0003431|kegg.compound:C00860|knapsack:C00007479|metacyc.compound:HISTIDINOL|pdb-ccd:HSO|pubmed:1617631|pubmed:1768057|pubmed:21573440|pubmed:2292205|pubmed:2405251|pubmed:7042909|pubmed:8297120|pubmed:885850|pubmed:9042234|pubmed:9778369|reaxys:81955 Graph (2S)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol|4-[(S)-2-amino-3-hydroxypropyl]imidazole|L-Histidinol (2S)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol (2S)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol|4-[(S)-2-amino-3-hydroxypropyl]imidazole|L-Histidinol http://purl.obolibrary.org/obo/CHEBI_16255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16256 biolink:ChemicalEntity 2-methyl-3-oxopropanoic acid The 2-methyl-3-oxo derivative of propanoic acid. kegg.compound:C00349 Graph 2-Methyl-3-oxopropanoate|2-methyl-3-oxopropanoic acid|3-Oxo-2-methylpropanoate|3-oxo-2-methylpropanoate|Methylmalonate semialdehyde 2-Methyl-3-oxopropanoate|2-methyl-3-oxopropanoic acid 2-Methyl-3-oxopropanoate|2-methyl-3-oxopropanoic acid|3-Oxo-2-methylpropanoate|3-oxo-2-methylpropanoate|Methylmalonate semialdehyde http://purl.obolibrary.org/obo/CHEBI_16256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16257 biolink:ChemicalEntity 5-O-(1-carboxyvinyl)-3-phosphoshikimic acid kegg.compound:C01269|knapsack:C00007627|pdb-ccd:EPS|pubmed:17586643 Graph (3R,4S,5R)-5-(1-carboxyethenyloxy)-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid|5-O-(1-Carboxyvinyl)-3-phosphoshikimate|5-O-(1-carboxyvinyl)-3-phosphoshikimate|O5-(1-Carboxyvinyl)-3-phosphoshikimate|O5-(1-carboxyvinyl)-3-phosphoshikimate (3R,4S,5R)-5-(1-carboxyethenyloxy)-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid (3R,4S,5R)-5-(1-carboxyethenyloxy)-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid|5-O-(1-Carboxyvinyl)-3-phosphoshikimate|5-O-(1-carboxyvinyl)-3-phosphoshikimate|O5-(1-Carboxyvinyl)-3-phosphoshikimate|O5-(1-carboxyvinyl)-3-phosphoshikimate http://purl.obolibrary.org/obo/CHEBI_16257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16259 biolink:ChemicalEntity N-acetyl-L-phenylalanine The N-acetyl derivative of L-phenylalanine. cas:2018-61-3|hmdb:HMDB0000512|kegg.compound:C03519|metacyc.compound:CPD-439|pubmed:22770225|reaxys:2213853 Graph (2S)-2-(acetylamino)-3-phenylpropanoic acid|Acetyl-L-phenylalanine|Acetylphenylalanine|L-N-Acetylphenylalanine|N-Acetyl-L-phenylalanine|N-Acetylphenylalanine|N-acetyl-L-phenylalanine (2S)-2-(acetylamino)-3-phenylpropanoic acid|N-Acetyl-L-phenylalanine|N-acetyl-L-phenylalanine (2S)-2-(acetylamino)-3-phenylpropanoic acid|Acetyl-L-phenylalanine|Acetylphenylalanine|L-N-Acetylphenylalanine|N-Acetyl-L-phenylalanine|N-Acetylphenylalanine|N-acetyl-L-phenylalanine http://purl.obolibrary.org/obo/CHEBI_16259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16260 biolink:ChemicalEntity 2-nitrophenol A member of the class of 2-nitrophenols that is phenol in which one of the hydrogens that is ortho to the hydroxy group has been replaced by a nitro group. cas:88-75-5|gmelin:101867|kegg.compound:C01988|metacyc.compound:CPD-258|pubmed:23796307|pubmed:24347320|reaxys:775403 Graph 2-Nitrophenol|2-hydroxynitrobenzene|2-nitrophenol|o-hydroxynitrobenzene|o-nitrophenol 2-Nitrophenol|2-nitrophenol 2-Nitrophenol|2-hydroxynitrobenzene|2-nitrophenol|o-hydroxynitrobenzene|o-nitrophenol http://purl.obolibrary.org/obo/CHEBI_16260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16261 biolink:ChemicalEntity chitosan An aminoglycan consisting of β-(1→4)-linked D-glucosamine residues. cas:9012-76-4|drugbank:DB14155|foodb.food:FDB015634|hmdb:HMDB0003404|kegg.compound:C00734|kegg.glycan:G10536|metacyc.compound:Chitosan|pesticides:chitosan|pubmed:33208634|pubmed:34885715|pubmed:36076877|pubmed:36191784|pubmed:36315326|pubmed:36362923|pubmed:36431043|pubmed:36437390|pubmed:36449553|pubmed:36501559|pubmed:36547302|pubmed:36547931|wikipedia.en:Chitosan Graph (1->4)-2-amino-2-deoxy-beta-D-glucan|Chitosan|Deacetylchitin|[4)-beta-D-GlcpN(1->]n|beta-1,4-Poly-D-glucosamine|poliglusam (1->4)-2-amino-2-deoxy-beta-D-glucan (1->4)-2-amino-2-deoxy-beta-D-glucan|Chitosan|Deacetylchitin|[4)-beta-D-GlcpN(1->]n|beta-1,4-Poly-D-glucosamine|poliglusam http://purl.obolibrary.org/obo/CHEBI_16261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16264 biolink:ChemicalEntity UDP-N-acetyl-alpha-D-glucosamine A UDP-amino sugar having N-acetyl-α-D-glucosamine as the amino sugar component. cas:528-04-1|hmdb:HMDB0000290|kegg.compound:C00043|kegg.glycan:G10610|knapsack:C00019358|pdb-ccd:UD1|pubmed:21627825|pubmed:22825354|pubmed:22887999|pubmed:22901411|reaxys:78982 Graph (2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)|UDP-GlcNAc|UDP-N-acetyl-D-glucosamine|UDP-N-acetylglucosamine|URIDINE-DIPHOSPHATE-N-ACETYLGLUCOSAMINE|uridine 5'-[3-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl) dihydrogen diphosphate] (2R,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl [(2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)|UDP-GlcNAc|UDP-N-acetyl-D-glucosamine|UDP-N-acetylglucosamine|URIDINE-DIPHOSPHATE-N-ACETYLGLUCOSAMINE|uridine 5'-[3-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16265 biolink:ChemicalEntity succinic semialdehyde beilstein:1745187|cas:692-29-5|kegg.compound:C00232|knapsack:C00019682|umbbd.compound:c0311 Graph 3-formylpropanoic acid|3-formylpropionic acid|4-Oxobutanoate|4-oxobutanoic acid|Succinate semialdehyde|Succinic semialdehyde|beta-formylpropionic acid|semialdehyde succinique|succinaldehydic acid|succinic acid semialdehyde 4-oxobutanoic acid 3-formylpropanoic acid|3-formylpropionic acid|4-Oxobutanoate|4-oxobutanoic acid|Succinate semialdehyde|Succinic semialdehyde|beta-formylpropionic acid|semialdehyde succinique|succinaldehydic acid|succinic acid semialdehyde http://purl.obolibrary.org/obo/CHEBI_16265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16266 biolink:ChemicalEntity 2,3-bis-O-(geranylgeranyl)glycerol 1-phosphate kegg.compound:C04638 Graph 2,3-Bis-O-(geranylgeranyl)glycerol 1-phosphate|2,3-bis-O-(geranylgeranyl)glycerol 1-(dihydrogen phosphate)|2,3-bis[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate 2,3-bis[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate 2,3-Bis-O-(geranylgeranyl)glycerol 1-phosphate|2,3-bis-O-(geranylgeranyl)glycerol 1-(dihydrogen phosphate)|2,3-bis[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_16266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16267 biolink:ChemicalEntity (R)-4-hydroxymandelonitrile beta-D-glucoside A β-D-glucoside consisting of (R)-prunasin carrying a hydroxy substituent at position 4 on the phenyl ring. cas:21401-21-8|kegg.compound:C01855|patent:CN101112354|patent:CN101112355|pubmed:10380623|pubmed:1194256|pubmed:12711800|pubmed:16989538|pubmed:17340339|pubmed:7012151|pubmed:7458352|reaxys:92612 Graph (2R)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(R)-4-Hydroxymandelonitrile beta-D-glucoside|(R)-alpha-(beta-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile|(R)-p-hydroxymandelonitrile-D-glucopyranoside|Taxiphyllin|taxiphyllin (2R)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile (2R)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(R)-4-Hydroxymandelonitrile beta-D-glucoside|(R)-alpha-(beta-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile|(R)-p-hydroxymandelonitrile-D-glucopyranoside|Taxiphyllin|taxiphyllin http://purl.obolibrary.org/obo/CHEBI_16267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16268 biolink:ChemicalEntity nitroethane A nitroalkane that is ethane substituted by a nitro group. cas:79-24-3|gmelin:68639|kegg.compound:C01837|metacyc.compound:CPD-12077|pdb-ccd:NIE|pubmed:18491914|pubmed:24963606|reaxys:1209324|wikipedia.en:Nitroethane Graph 1-nitroethane|Nitroethan|Nitroethane|nitroethane Nitroethane|nitroethane 1-nitroethane|Nitroethan|Nitroethane|nitroethane http://purl.obolibrary.org/obo/CHEBI_16268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16269 biolink:ChemicalEntity N,N-dimethylaniline A tertiary amine that is aniline in which the amino hydrogens are replaced by two methyl groups. cas:121-69-7|hmdb:HMDB0001020|kegg.compound:C02846|metacyc.compound:NN-DIMETHYLANILINE|pubmed:24315030|reaxys:507140|wikipedia.en:Dimethylaniline Graph Dimethylaminobenzene|Dimethylaniline|Dimethylphenylamine|N,N-Dimethyl-N-phenylamine|N,N-Dimethylaniline|N,N-Dimethylbenzenamine|N,N-Dimethylbenzeneamine|N,N-Dimethylphenylamine|N,N-dimethylaniline Dimethylaminobenzene|Dimethylaniline|Dimethylphenylamine|N,N-Dimethyl-N-phenylamine|N,N-Dimethylaniline|N,N-Dimethylbenzenamine|N,N-Dimethylbenzeneamine|N,N-Dimethylphenylamine|N,N-dimethylaniline http://purl.obolibrary.org/obo/CHEBI_16269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16270 biolink:ChemicalEntity benzoylagmatine kegg.compound:C02253 Graph Benzoylagmatine|N-(4-guanidinobutyl)benzamide|N-[4-(carbamimidamido)butyl]benzamide N-[4-(carbamimidamido)butyl]benzamide Benzoylagmatine|N-(4-guanidinobutyl)benzamide|N-[4-(carbamimidamido)butyl]benzamide http://purl.obolibrary.org/obo/CHEBI_16270 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16271 biolink:ChemicalEntity 2-exo-hydroxy-1,8-cineole A cineole in which the 1,8-cineole skeleton is substituted at C-2 with a hydroxy group oriented exo (S configuration). beilstein:5727572|kegg.compound:C03092|lipidmaps:LMPR0102090065|pubmed:11159812 Graph (1R,4S,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-ol|2-exo-hydroxy-1,8-cineole|6-endo-Hydroxycineole (1R,4S,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-ol (1R,4S,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-ol|2-exo-hydroxy-1,8-cineole|6-endo-Hydroxycineole http://purl.obolibrary.org/obo/CHEBI_16271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16274 biolink:ChemicalEntity 5,12-dihydroxanthommatin cas:25705-16-2|kegg.compound:C03476 Graph 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-6,12-dihydro-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid|5,12-Dihydroxanthommatin 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-6,12-dihydro-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-6,12-dihydro-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid|5,12-Dihydroxanthommatin http://purl.obolibrary.org/obo/CHEBI_16274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16275 biolink:ChemicalEntity all-trans-octaprenyl diphosphate An all-trans-polyprenyl diphosphate composed from eight isoprenyl units. kegg.compound:C04146|lipidmaps:LMPR01070226|pdb-ccd:OTP Graph (2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAENYL TRIHYDROGEN DIPHOSPHATE|(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl trihydrogen diphosphate|Farnesylfarnesylgeraniol|all-trans-Octaprenyl diphosphate|all-trans-octaprenyl pyrophosphate (2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl trihydrogen diphosphate (2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAENYL TRIHYDROGEN DIPHOSPHATE|(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl trihydrogen diphosphate|Farnesylfarnesylgeraniol|all-trans-Octaprenyl diphosphate|all-trans-octaprenyl pyrophosphate http://purl.obolibrary.org/obo/CHEBI_16275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16277 biolink:ChemicalEntity haloacetic acid A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by a halogen atom. kegg.compound:C01812 Graph http://purl.obolibrary.org/obo/CHEBI_16277 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16278 biolink:ChemicalEntity 2-hydroxy-3-oxoadipic acid An oxo dicarboxylic acid comprising adipic acid having the oxo group at the 3-position as well as a hydroxy substituent at the 2-position. kegg.compound:C03217 Graph 2-Hydroxy-3-oxoadipate|2-hydroxy-3-oxohexanedioic acid 2-hydroxy-3-oxohexanedioic acid 2-Hydroxy-3-oxoadipate|2-hydroxy-3-oxohexanedioic acid http://purl.obolibrary.org/obo/CHEBI_16278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16279 biolink:ChemicalEntity 1-O-trans-cinnamoyl-beta-D-glucopyranose An O-acyl carbohydrate consisting of β-D-glucose carrying a O-trans-cinnamoyl group at the anomeric position. kegg.compound:C04164|pubmed:11330708|pubmed:11409967|reaxys:7436104 Graph 1-O-(trans-cinnamoyl)-beta-D-glucose|1-O-[(2E)-3-phenylprop-2-enoyl]-beta-D-glucopyranose|1-O-trans-Cinnamoyl-beta-D-glucopyranose|trans-Cinnamoyl beta-D-glucoside 1-O-[(2E)-3-phenylprop-2-enoyl]-beta-D-glucopyranose 1-O-(trans-cinnamoyl)-beta-D-glucose|1-O-[(2E)-3-phenylprop-2-enoyl]-beta-D-glucopyranose|1-O-trans-Cinnamoyl-beta-D-glucopyranose|trans-Cinnamoyl beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16281 biolink:ChemicalEntity 3-(2-carboxyethenyl)-cis,cis-muconic acid kegg.compound:C04366 Graph (2Z,5Z)-4-(carboxymethylidene)hepta-2,5-dienedioic acid|3-(2-Carboxyethenyl)-cis,cis-muconate|3-(2-carboxyethenyl)-cis,cis-muconate|3-(2-carboxyvinyl)-cis,cis-muconate (2Z,5Z)-4-(carboxymethylidene)hepta-2,5-dienedioic acid (2Z,5Z)-4-(carboxymethylidene)hepta-2,5-dienedioic acid|3-(2-Carboxyethenyl)-cis,cis-muconate|3-(2-carboxyethenyl)-cis,cis-muconate|3-(2-carboxyvinyl)-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_16281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16282 biolink:ChemicalEntity 2-ureidoglycine Allantoic acid in which one of the aminocarbonyl groups is replaced by hydrogen. kegg.compound:C02091 Graph (+-)-2-(carbamoylamino)glycine|(+-)-2-ureidoglycine|(+-)-amino(carbamoylamino)acetic acid|2-(carbamoylamino)glycine|Ureidoglycine|amino(carbamoylamino)acetic acid 2-(carbamoylamino)glycine (+-)-2-(carbamoylamino)glycine|(+-)-2-ureidoglycine|(+-)-amino(carbamoylamino)acetic acid|2-(carbamoylamino)glycine|Ureidoglycine|amino(carbamoylamino)acetic acid http://purl.obolibrary.org/obo/CHEBI_16282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16283 biolink:ChemicalEntity L-cystine The L-enantiomer of the sulfur-containing amino acid cystine. cas:56-89-3|drugbank:DB00138|drugcentral:4130|gmelin:397179|hmdb:HMDB0000192|kegg.compound:C00491|kegg.drug:D03636|knapsack:C00001352|pubmed:14726201|pubmed:24264736|pubmed:24327171|reaxys:1728094 Graph (2R,2'R)-3,3'-disulfanediylbis(2-aminopropanoic acid)|(R,R)-3,3'-dithiobis(2-aminopropanoic acid)|(R-(R*,R*))-3,3'-Dithiobis(2-aminopropanoic acid)|3,3'-Dithiobis-L-alanine|E921|L-Cystine|L-Dicysteine|L-alpha-Diamino-beta-dithiolactic acid|L-cystine|beta,beta'-diamino-beta,beta'-dicarboxydiethyl disulfide|beta,beta'-dithiodialanine|bis(beta-amino-beta-carboxyethyl) disulfide|oxidized L-cysteine (2R,2'R)-3,3'-disulfanediylbis(2-aminopropanoic acid)|L-Cystine|L-cystine (2R,2'R)-3,3'-disulfanediylbis(2-aminopropanoic acid)|(R,R)-3,3'-dithiobis(2-aminopropanoic acid)|(R-(R*,R*))-3,3'-Dithiobis(2-aminopropanoic acid)|3,3'-Dithiobis-L-alanine|E921|L-Cystine|L-Dicysteine|L-alpha-Diamino-beta-dithiolactic acid|L-cystine|beta,beta'-diamino-beta,beta'-dicarboxydiethyl disulfide|beta,beta'-dithiodialanine|bis(beta-amino-beta-carboxyethyl) disulfide|oxidized L-cysteine http://purl.obolibrary.org/obo/CHEBI_16283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16284 biolink:ChemicalEntity dATP A purine 2'-deoxyribonucleoside 5'-triphosphate having adenine as the nucleobase. cas:1927-31-7|chemspider:15194|drugbank:DB03222|foodb.food:FDB022674|hmdb:HMDB0001532|kegg.compound:C00131|pdb-ccd:DTP|pubmed:22595174|pubmed:26100204|pubmed:26497964|pubmed:26727048|pubmed:29712847|pubmed:31110001|pubmed:32787210|pubmed:32818298|pubmed:32956632|pubmed:6783298|wikipedia.en:Deoxyadenosine_triphosphate Graph 2'-Deoxyadenosine 5'-triphosphate|2'-dATP|2'-deoxy-ATP|2'-deoxyadenosine 5'-(tetrahydrogen triphosphate)|2'-deoxyadenosine 5'-triphosphate|2'-deoxyadenosine triphosphate|Deoxyadenosine 5'-triphosphate|Deoxyadenosine triphosphate|dATP 2'-deoxyadenosine 5'-(tetrahydrogen triphosphate) 2'-Deoxyadenosine 5'-triphosphate|2'-dATP|2'-deoxy-ATP|2'-deoxyadenosine 5'-(tetrahydrogen triphosphate)|2'-deoxyadenosine 5'-triphosphate|2'-deoxyadenosine triphosphate|Deoxyadenosine 5'-triphosphate|Deoxyadenosine triphosphate|dATP http://purl.obolibrary.org/obo/CHEBI_16284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16285 biolink:ChemicalEntity phytanic acid A branched-chain saturated fatty acid consisting of hexadecanoic acid carrying methyl substituents at positions 3, 7, 11 and 15. cas:14721-66-5|kegg.compound:C01607|lipidmaps:LMFA01020251|pubmed:12187408|pubmed:17956237|pubmed:9819701|reaxys:1789963 Graph 3,7,11,15-Tetramethyl-hexadecansaeure|3,7,11,15-tetramethyl hexadecanoic acid|3,7,11,15-tetramethyl-hexadecanoic acid|3,7,11,15-tetramethylhexadecanoic acid|Phytanic acid 3,7,11,15-tetramethylhexadecanoic acid 3,7,11,15-Tetramethyl-hexadecansaeure|3,7,11,15-tetramethyl hexadecanoic acid|3,7,11,15-tetramethyl-hexadecanoic acid|3,7,11,15-tetramethylhexadecanoic acid|Phytanic acid http://purl.obolibrary.org/obo/CHEBI_16285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16287 biolink:ChemicalEntity UDP-N-acetyl-D-mannosamine A UDP-amino sugar having N-acetyl-D-mannosamine as the amino sugar component. kegg.glycan:G11112 Graph UDP-N-acetyl-D-mannosamine|uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyl) dihydrogen diphosphate] UDP-N-acetyl-D-mannosamine|uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16287 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16288 biolink:ChemicalEntity O-acetyl-L-homoserine The O-acetyl derivative of L-homoserine. beilstein:1724342|cas:7540-67-2|kegg.compound:C01077|knapsack:C00019570|metacyc.compound:CPD-667|pubmed:11566369|pubmed:16233482|pubmed:2517474|pubmed:35287716 Graph (2S)-4-(acetyloxy)-2-aminobutanoic acid|O-Acetyl-L-homoserine|O-Acetylhomoserine (2S)-4-(acetyloxy)-2-aminobutanoic acid (2S)-4-(acetyloxy)-2-aminobutanoic acid|O-Acetyl-L-homoserine|O-Acetylhomoserine http://purl.obolibrary.org/obo/CHEBI_16288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16289 biolink:ChemicalEntity beta-D-galactosyl group A galactosyl group obtained by removing the hydroxy group from the hemiacetal function of β-D-galactose and, by extension, of a lower oligosaccharide having galactose at the reducing end. The unsubstituted parent of the class of β-D-galactosyl groups. pubmed:29069089 Graph Galbeta-yl|Galbeta-yl group|beta-D-Galp|beta-D-galactopyranosyl|beta-D-galactosyl|beta-D-galactosyl group beta-D-galactopyranosyl Galbeta-yl|Galbeta-yl group|beta-D-Galp|beta-D-galactopyranosyl|beta-D-galactosyl|beta-D-galactosyl group http://purl.obolibrary.org/obo/CHEBI_16289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16290 biolink:ChemicalEntity 5alpha-cholesta-7,24-dien-3beta-ol cas:651-54-7|kegg.compound:C05439 Graph (3beta,5alpha)-cholesta-7,24-dien-3-ol|5-alpha-cholesta-7,24-dien-3-beta-ol|5alpha-Cholesta-7,24-dien-3beta-ol|5alpha-cholesta-7,24-dien-3beta-ol|cholesta-7,24-dien-3-ol 5alpha-Cholesta-7,24-dien-3beta-ol|5alpha-cholesta-7,24-dien-3beta-ol (3beta,5alpha)-cholesta-7,24-dien-3-ol|5-alpha-cholesta-7,24-dien-3-beta-ol|5alpha-Cholesta-7,24-dien-3beta-ol|5alpha-cholesta-7,24-dien-3beta-ol|cholesta-7,24-dien-3-ol http://purl.obolibrary.org/obo/CHEBI_16290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16291 biolink:ChemicalEntity 1-alkyl-2-acetyl-sn-glycerol A 1-alkyl-2-acylglycerol having acetyl as the acyl substituent. kegg.compound:C03820 Graph 1-Alkyl-2-acetyl-sn-glycerol|1-O-Alkyl-2-acetyl-sn-glycerol|1-alkyl-2-acetyl-sn-glycerols|2-Acetyl-1-alkyl-sn-glycerol|a 1-O-alkyl-2-acetyl-sn-glycerol 1-Alkyl-2-acetyl-sn-glycerol|1-O-Alkyl-2-acetyl-sn-glycerol|1-alkyl-2-acetyl-sn-glycerols|2-Acetyl-1-alkyl-sn-glycerol|a 1-O-alkyl-2-acetyl-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_16291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16292 biolink:ChemicalEntity D-arabinono-1,4-lactone cas:2782-09-4|kegg.compound:C00652 Graph (3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one|1,4-D-Arabinonolactone|D-Arabinonic acid, gamma-lactone|D-Arabinono-1,4-lactone|D-Arabonolactone|D-arabinono-1,4-lactone (3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one (3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one|1,4-D-Arabinonolactone|D-Arabinonic acid, gamma-lactone|D-Arabinono-1,4-lactone|D-Arabonolactone|D-arabinono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_16292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16294 biolink:ChemicalEntity barbituric acid A barbiturate, the structure of which is that of perhydropyrimidine substituted at C-2, -4 and -6 by oxo groups. Barbituric acid is the parent compound of barbiturate drugs, although it is not itself pharmacologically active. cas:67-52-7|gmelin:101571|hmdb:HMDB0041833|kegg.compound:C00813|pubmed:22139480|pubmed:23038042|pubmed:23915243|pubmed:3654008|reaxys:120502|wikipedia.en:Barbituric_acid Graph 2,4,6(1H,3H,5H)-pyrimidinetrione|Barbituric acid|Barbitursaeure|Malonylharnstoff|Malonylurea|pyrimidine-2,4,6(1H,3H,5H)-trione pyrimidine-2,4,6(1H,3H,5H)-trione 2,4,6(1H,3H,5H)-pyrimidinetrione|Barbituric acid|Barbitursaeure|Malonylharnstoff|Malonylurea|pyrimidine-2,4,6(1H,3H,5H)-trione http://purl.obolibrary.org/obo/CHEBI_16294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16295 biolink:ChemicalEntity alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->3')-1-alkyl-2-acylglycerol A glycosylglycerol derivative in which the glycosyl moiety α-D-glucosyl-(1→6)-α-D-glucosyl-(1→6)-α-D-glucose is attached at position 3 of 1-alkyl-2-acylglycerol kegg.compound:C04909|metacyc.compound:ALPHA-D-GLUCOSYL-ETCETERA-ACYLGLYCEROL Graph an alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->3)-1-alkyl-2-acylglycerol an alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->3)-1-alkyl-2-acylglycerol http://purl.obolibrary.org/obo/CHEBI_16295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16296 biolink:ChemicalEntity D-tryptophan The D-enantiomer of tryptophan. cas:153-94-6|drugbank:DB03225|gmelin:83743|hmdb:HMDB0013609|kegg.compound:C00525|metacyc.compound:D-TRYPTOPHAN|pdb-ccd:DTR|pubmed:21560237|pubmed:22156410|pubmed:22336999|pubmed:24097941|reaxys:86198|ymdb:YMDB00998 Graph (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid|(R)-tryptophan|D-TRYPTOPHAN|D-Tryptophan|D-tryptophan|DTR D-Tryptophan|D-tryptophan (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid|(R)-tryptophan|D-TRYPTOPHAN|D-Tryptophan|D-tryptophan|DTR http://purl.obolibrary.org/obo/CHEBI_16296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16298 biolink:ChemicalEntity D-mannitol 1-phosphate An alditol 1-phosphate that is the 1-O-phospho derivative of mannitol with D-configuration. cas:15806-48-1|hmdb:HMDB0001530|kegg.compound:C00644|knapsack:C00019638|metacyc.compound:MANNITOL-1P|pubmed:21299839|reaxys:1728362 Graph 1-O-phosphono-D-mannitol|D-Mannitol 1-phosphate|D-mannitol 1-(dihydrogen phosphate) 1-O-phosphono-D-mannitol|D-Mannitol 1-phosphate|D-mannitol 1-(dihydrogen phosphate) 1-O-phosphono-D-mannitol|D-Mannitol 1-phosphate|D-mannitol 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16298 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16299 biolink:ChemicalEntity dehydrocoformycin A coformycin derivative in which the hydroxy group on the diazepine ring of coformycin is replaced by an oxo group. kegg.compound:C02243 Graph 3-(beta-D-ribofuranosyl)-6,7-dihydroimidazo[4,5-d][1,3]diazepin-8(3H)-one|8-Oxocoformycin 3-(beta-D-ribofuranosyl)-6,7-dihydroimidazo[4,5-d][1,3]diazepin-8(3H)-one 3-(beta-D-ribofuranosyl)-6,7-dihydroimidazo[4,5-d][1,3]diazepin-8(3H)-one|8-Oxocoformycin http://purl.obolibrary.org/obo/CHEBI_16299 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16300 biolink:ChemicalEntity alpha-D-ribose 1-phosphate The 1-phospho derivative of α-D-ribose. cas:14075-00-4|drugbank:DB03101|hmdb:HMDB0001489|kegg.compound:C00620|metacyc.compound:RIBOSE-1P|pdb-ccd:R1P|reaxys:85832 Graph 1-O-phosphono-alpha-D-ribofuranose|1-phospho-alpha-D-ribofuranose|D-Ribose 1-phosphate|Ribose 1-phosphate|alpha-D-Ribose 1-phosphate|alpha-D-ribofuranose 1-(dihydrogen phosphate)|alpha-D-ribose 1-phosphate alpha-D-ribofuranose 1-(dihydrogen phosphate) 1-O-phosphono-alpha-D-ribofuranose|1-phospho-alpha-D-ribofuranose|D-Ribose 1-phosphate|Ribose 1-phosphate|alpha-D-Ribose 1-phosphate|alpha-D-ribofuranose 1-(dihydrogen phosphate)|alpha-D-ribose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_16300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16301 biolink:ChemicalEntity nitrite The nitrogen oxoanion formed by loss of a proton from nitrous acid. cas:14797-65-0|gmelin:977|kegg.compound:C00088|pdb-ccd:NO2|wikipedia.en:Nitrite Graph NITRITE ION|NO2|NO2(-)|Nitrit|Nitrite|[NO2](-)|dioxidonitrate(1-)|dioxonitrate(1-)|dioxonitrate(III)|nitrite|nitrite anion|nitrite(1-)|nitrous acid, ion(1-) Nitrite|dioxidonitrate(1-)|dioxonitrate(1-)|dioxonitrate(III)|nitrite NITRITE ION|NO2|NO2(-)|Nitrit|Nitrite|[NO2](-)|dioxidonitrate(1-)|dioxonitrate(1-)|dioxonitrate(III)|nitrite|nitrite anion|nitrite(1-)|nitrous acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_16301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16302 biolink:ChemicalEntity 11-cis-retinol cas:22737-96-8|kegg.compound:C00899|lipidmaps:LMPR01090005 Graph (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol|11-cis-Retinol|11-cis-retinol (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol|11-cis-Retinol|11-cis-retinol (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol|11-cis-Retinol|11-cis-retinol http://purl.obolibrary.org/obo/CHEBI_16302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16303 biolink:ChemicalEntity 3-amino-L-alanine A 3-aminoalanine that has S configuration. cas:4033-39-0|kegg.compound:C03401|pdb-ccd:DPP|pubmed:22182933|reaxys:1721400|wikipedia.en:2,3-Diaminopropionic_acid Graph (2S)-2,3-diaminopropanoic acid|3-amino-L-alanine|Dpr|L-2,3-Diaminopropanoate|L-2,3-Diaminopropanoic acid|L-2,3-Diaminopropionate|L-2,3-Diaminopropionic acid (2S)-2,3-diaminopropanoic acid|3-amino-L-alanine (2S)-2,3-diaminopropanoic acid|3-amino-L-alanine|Dpr|L-2,3-Diaminopropanoate|L-2,3-Diaminopropanoic acid|L-2,3-Diaminopropionate|L-2,3-Diaminopropionic acid http://purl.obolibrary.org/obo/CHEBI_16303 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16304 biolink:ChemicalEntity cob(II)alamin A cobalamin in which the central cobalt atom has an oxidation state of +2. cas:14463-33-3|gmelin:1243558|kegg.compound:C00541 Graph Cob(II)alamin|Vitamin B12r|cob(II)alamin|vitamin B-12r Cob(II)alamin|cob(II)alamin Cob(II)alamin|Vitamin B12r|cob(II)alamin|vitamin B-12r http://purl.obolibrary.org/obo/CHEBI_16304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16307 biolink:ChemicalEntity anthocyanidin 3-O-beta-D-glucoside An anthocyanidin glucoside having the glucosyl residue at the 3-position attached via a β-linkage. kegg.compound:C03940 Graph Anthocyanidin-3-O-D-glucoside|Anthocyanidin-3-O-beta-D-glucoside|an anthocyanidin 3-O-beta-D-glucoside Anthocyanidin-3-O-D-glucoside|Anthocyanidin-3-O-beta-D-glucoside|an anthocyanidin 3-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16308 biolink:ChemicalEntity sucrose 6(F)-phosphate kegg.compound:C02591|kegg.glycan:G10508|pdb-ccd:SUP Graph 6-O-Phosphonosucrose|6-O-phosphono-beta-D-fructofuranosyl alpha-D-glucopyranoside|6-Phosphosucrose|Sucrose 6-phosphate|Sucrose 6F-phosphate|beta-D-Fructofuranosyl-6-O-phosphono-alpha-D-glucopyranoside|sugar 1-phosphate 6-O-phosphono-beta-D-fructofuranosyl alpha-D-glucopyranoside 6-O-Phosphonosucrose|6-O-phosphono-beta-D-fructofuranosyl alpha-D-glucopyranoside|6-Phosphosucrose|Sucrose 6-phosphate|Sucrose 6F-phosphate|beta-D-Fructofuranosyl-6-O-phosphono-alpha-D-glucopyranoside|sugar 1-phosphate http://purl.obolibrary.org/obo/CHEBI_16308 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16309 biolink:ChemicalEntity 4-sulfobenzoate(1-) Graph 4-sulfobenzoate|4-sulphobenzoate|HO3S-C6H4-COO(-) 4-sulfobenzoate 4-sulfobenzoate|4-sulphobenzoate|HO3S-C6H4-COO(-) http://purl.obolibrary.org/obo/CHEBI_16309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16310 biolink:ChemicalEntity sulcatone A heptenone that is hept-5-en-2-one substituted by a methyl group at position 6. It is a volatile oil component of citronella oil, lemon-grass oil and palmarosa oil. cas:110-93-0|hmdb:HMDB0035915|kegg.compound:C07287|knapsack:C00011400|pubmed:23590828|pubmed:24627092|reaxys:1741705 Graph 6-Methyl-5-hepten-2-one|6-Methylhept-5-en-2-one|6-methyl-5-hepten-2-one|6-methylhept-5-en-2-one|Sulcatone|sulcatone 6-Methylhept-5-en-2-one|6-methylhept-5-en-2-one 6-Methyl-5-hepten-2-one|6-Methylhept-5-en-2-one|6-methyl-5-hepten-2-one|6-methylhept-5-en-2-one|Sulcatone|sulcatone http://purl.obolibrary.org/obo/CHEBI_16310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16311 biolink:ChemicalEntity dCTP A 2'-deoxycytidine phosphate having cytosine as the nucleobase. cas:2056-98-6|chemspider:58601|drugbank:DB03258|foodb.food:FDB022359|hmdb:HMDB0000998|kegg.compound:C00458|pdb-ccd:DCP|pubmed:11200258|pubmed:15787173|pubmed:15935150|pubmed:16061253|pubmed:16061997|pubmed:16120835|pubmed:19328748|pubmed:22212996|pubmed:29989586|pubmed:31377845|pubmed:32800127|pubmed:32926292|pubmed:34110794|pubmed:6601514|pubmed:761229|pubmed:7877593|wikipedia.en:Deoxycytidine_triphosphate Graph 2'-deoxy-CTP|2'-deoxycytidine 5'-(tetrahydrogen triphosphate)|2'-deoxycytidine 5'-triphosphate|2'-deoxycytidine triphosphate|dCTP|deoxy-CTP|deoxycytidine 5'-triphosphate|deoxycytidine triphosphate|deoxycytidine-triphosphate 2'-deoxycytidine 5'-(tetrahydrogen triphosphate) 2'-deoxy-CTP|2'-deoxycytidine 5'-(tetrahydrogen triphosphate)|2'-deoxycytidine 5'-triphosphate|2'-deoxycytidine triphosphate|dCTP|deoxy-CTP|deoxycytidine 5'-triphosphate|deoxycytidine triphosphate|deoxycytidine-triphosphate http://purl.obolibrary.org/obo/CHEBI_16311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16312 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanic acid beilstein:3224670|cas:2458-08-4|kegg.compound:C01292|lipidmaps:LMST04010176 Graph (3alpha,5beta,7alpha)-3,7-dihydroxy-12-oxocholan-24-oic acid|3,7-dihydroxy-12-oxocholanoic acid|3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate|3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid (3alpha,5beta,7alpha)-3,7-dihydroxy-12-oxocholan-24-oic acid|3,7-dihydroxy-12-oxocholanoic acid|3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate|3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid http://purl.obolibrary.org/obo/CHEBI_16312 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16313 biolink:ChemicalEntity D-proline The D-enantiomer of proline. cas:344-25-2|drugbank:DB02853|gmelin:833984|hmdb:HMDB0003411|kegg.compound:C00763|metacyc.compound:D-PROLINE|pdb-ccd:DPR|pubmed:19023642|pubmed:20023020|pubmed:20959625|pubmed:21374575|pubmed:21563681|pubmed:22475019|pubmed:22479580|reaxys:80811|wikipedia.en:D-proline Graph (2R)-pyrrolidine-2-carboxylic acid|(R)-2-Carboxypyrrolidine|(R)-pyrrolidine-2-carboxylic acid|D-PROLINE|D-Prolin|D-Proline|D-proline|DPR D-Proline|D-proline (2R)-pyrrolidine-2-carboxylic acid|(R)-2-Carboxypyrrolidine|(R)-pyrrolidine-2-carboxylic acid|D-PROLINE|D-Prolin|D-Proline|D-proline|DPR http://purl.obolibrary.org/obo/CHEBI_16313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16314 biolink:ChemicalEntity N-formylmethanofuran cas:94483-60-0|kegg.compound:C01001 Graph Formylmethanofuran|N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(formamidomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(formamidomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine Formylmethanofuran|N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(formamidomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine http://purl.obolibrary.org/obo/CHEBI_16314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16317 biolink:ChemicalEntity 3alpha-hydroxyglycyrrhetinic acid kegg.compound:C03930 Graph 3-alpha-hydroxyglycyrrhetinate|3alpha-Hydroxyglycyrrhetinate|3alpha-hydroxy-11-oxoolean-12-en-30-oic acid|3betaH-glycyrrhetinate|3betaH-glycyrrhetinic acid 3alpha-hydroxy-11-oxoolean-12-en-30-oic acid 3-alpha-hydroxyglycyrrhetinate|3alpha-Hydroxyglycyrrhetinate|3alpha-hydroxy-11-oxoolean-12-en-30-oic acid|3betaH-glycyrrhetinate|3betaH-glycyrrhetinic acid http://purl.obolibrary.org/obo/CHEBI_16317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16318 biolink:ChemicalEntity 4-nitrocatechol A member of the class of catechols that is benzene-1,2-diol substituted by a nitro group at position 4.It is the by-product of the hydroxylation of p-nitrophenol. cas:3316-09-4|drugbank:DB03407|hmdb:HMDB0002916|kegg.compound:C02235|metacyc.compound:CPD-158|pdb-ccd:4NC|pubmed:14993710|pubmed:20854995|pubmed:8214571|pubmed:8267647|reaxys:1867508|umbbd.compound:c0263 Graph 1,2-Dihydroxy-4-nitrobenzene|4-Nitrocatechol|4-Nitropyrocatechol|4-nitrobenzene-1,2-diol 4-nitrobenzene-1,2-diol 1,2-Dihydroxy-4-nitrobenzene|4-Nitrocatechol|4-Nitropyrocatechol|4-nitrobenzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16318 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16319 biolink:ChemicalEntity 2-acetamido-5-oxopentanoic acid A glutamic semialdehyde that is L-glutamate 5-semialdehyde in which one of the hydrogens of the amino group has been replaced by an acetyl group. kegg.compound:C01250 Graph (2S)-2-acetamido-5-oxopentanoic acid|2-acetamido-5-oxovaleric acid|N-Acetyl-L-glutamate 5-semialdehyde|N-acetyl-5-oxo-L-norvaline (2S)-2-acetamido-5-oxopentanoic acid (2S)-2-acetamido-5-oxopentanoic acid|2-acetamido-5-oxovaleric acid|N-Acetyl-L-glutamate 5-semialdehyde|N-acetyl-5-oxo-L-norvaline http://purl.obolibrary.org/obo/CHEBI_16319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16320 biolink:ChemicalEntity (R)-3-aminoisobutyric acid The (R)-enantiomer of 3-aminoisobutyric acid. beilstein:1720957|kegg.compound:C01205|reaxys:1720957 Graph (2R)-3-amino-2-methylpropanoic acid|(R)-3-Amino-2-methylpropanoate|(R)-3-amino-2-methylpropanoate|(R)-beta-aminoisobutyric acid|D-3-Amino-isobutanoate (2R)-3-amino-2-methylpropanoic acid (2R)-3-amino-2-methylpropanoic acid|(R)-3-Amino-2-methylpropanoate|(R)-3-amino-2-methylpropanoate|(R)-beta-aminoisobutyric acid|D-3-Amino-isobutanoate http://purl.obolibrary.org/obo/CHEBI_16320 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16321 biolink:ChemicalEntity 4-carboxy-2-hydroxyhexa-2,4-dienedioic acid A tricarboxylic acid that is buta-1,3-diene-1,2,4-tricarboxylic acid substituted by a hydroxy group at position 4. pubmed:32586023 Graph 4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid 4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid 4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_16321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16322 biolink:ChemicalEntity myo-inositol 1,3,4,5,6-pentakisphosphate beilstein:2495585|kegg.compound:C01284|pdb-ccd:5MY Graph 1D-myo-Inositol 1,3,4,5,6-pentakisphosphate|D-myo-Inositol 1,3,4,5,6-pentakisphosphate|Inositol 1,3,4,5,6-pentakisphosphate|myo-inositol 1,3,4,5,6-pentakis(dihydrogen phosphate) myo-inositol 1,3,4,5,6-pentakis(dihydrogen phosphate) 1D-myo-Inositol 1,3,4,5,6-pentakisphosphate|D-myo-Inositol 1,3,4,5,6-pentakisphosphate|Inositol 1,3,4,5,6-pentakisphosphate|myo-inositol 1,3,4,5,6-pentakis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16322 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16324 biolink:ChemicalEntity rifamycin O cas:14487-05-9|kegg.compound:C01849|knapsack:C00018712|lipidmaps:LMPK05000004 Graph (2'S,12'Z,14'E,16'S,17'S,18'R,19'R,20'R,21'S,22'R,23'S,24'E)-5',17',19'-trihydroxy-23'-methoxy-2',4',12',16',18',20',22'-heptamethyl-1',4,6',11'-tetraoxo-1',2'-dihydro-6'H-spiro[1,3-dioxolane-2,9'-[2,7](epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan]-21'-yl acetate|Rifamycin O|Rifamycin, 4-O-(carboxymethyl)-1-deoxy-1,4-dihydro-4-hydroxy-1-oxo-, gamma-lactone|rifamycin O (2'S,12'Z,14'E,16'S,17'S,18'R,19'R,20'R,21'S,22'R,23'S,24'E)-5',17',19'-trihydroxy-23'-methoxy-2',4',12',16',18',20',22'-heptamethyl-1',4,6',11'-tetraoxo-1',2'-dihydro-6'H-spiro[1,3-dioxolane-2,9'-[2,7](epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan]-21'-yl acetate (2'S,12'Z,14'E,16'S,17'S,18'R,19'R,20'R,21'S,22'R,23'S,24'E)-5',17',19'-trihydroxy-23'-methoxy-2',4',12',16',18',20',22'-heptamethyl-1',4,6',11'-tetraoxo-1',2'-dihydro-6'H-spiro[1,3-dioxolane-2,9'-[2,7](epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan]-21'-yl acetate|Rifamycin O|Rifamycin, 4-O-(carboxymethyl)-1-deoxy-1,4-dihydro-4-hydroxy-1-oxo-, gamma-lactone|rifamycin O http://purl.obolibrary.org/obo/CHEBI_16324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16325 biolink:ChemicalEntity lithocholic acid A monohydroxy-5β-cholanic acid with a α-hydroxy substituent at position 3. It is a bile acid obtained from chenodeoxycholic acid by bacterial action. cas:434-13-9|hmdb:HMDB0000761|kegg.compound:C03990|lincs.smallmolecule:LSM-5371|lipidmaps:LMST04010003|metacyc.compound:CPD-7235|pdb-ccd:4OA|pubmed:20622262|pubmed:23639599|pubmed:24270587|pubmed:24332653|pubmed:24399466|pubmed:7068113|reaxys:3217757|wikipedia.en:Lithocholic_acid Graph (3alpha,5beta)-3-hydroxycholan-24-oic acid|3alpha-Hydroxy-5beta-cholanate|3alpha-Hydroxy-5beta-cholanic acid|3alpha-hydroxy-5beta-cholan-24-oic acid|3alpha-hydroxy-5beta-cholanic acid|3alpha-hydroxy-5beta-cholanoic acid|5beta-cholanic acid-3alpha-ol|Lithocholic acid 3alpha-hydroxy-5beta-cholan-24-oic acid (3alpha,5beta)-3-hydroxycholan-24-oic acid|3alpha-Hydroxy-5beta-cholanate|3alpha-Hydroxy-5beta-cholanic acid|3alpha-hydroxy-5beta-cholan-24-oic acid|3alpha-hydroxy-5beta-cholanic acid|3alpha-hydroxy-5beta-cholanoic acid|5beta-cholanic acid-3alpha-ol|Lithocholic acid http://purl.obolibrary.org/obo/CHEBI_16325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16326 biolink:ChemicalEntity alpha-D-hexose 1-phosphate Any hexose-1-phosphate which has D configuration at position 5 and α-configuration at the anomeric centre. kegg.compound:C01171 Graph alpha-D-Hexose 1-phosphate|alpha-D-hexose 1-phosphates alpha-D-Hexose 1-phosphate|alpha-D-hexose 1-phosphates http://purl.obolibrary.org/obo/CHEBI_16326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16327 biolink:ChemicalEntity 2-oxosuccinamic acid A dicarboxylic acid monoamide that is succinamic acid substituted by an oxo group at position 2. kegg.compound:C02362|pubmed:186027 Graph 2-Oxosuccinamate|2-Oxosuccinamic acid|4-amino-2,4-dioxobutanoic acid|Oxaloacetamid|gamma-Aminooxaloacetate 4-amino-2,4-dioxobutanoic acid 2-Oxosuccinamate|2-Oxosuccinamic acid|4-amino-2,4-dioxobutanoic acid|Oxaloacetamid|gamma-Aminooxaloacetate http://purl.obolibrary.org/obo/CHEBI_16327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16329 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysine kegg.compound:C05892 Graph UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine|UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine|UDPMurAc(oyl-L-Ala-D-gamma-Glu-L-Lys)|uridine 5'-(3-{2-acetamido-3-O-[1-({(2S)-1-[(4-{[(1S)-5-amino-1-carboxypentyl]amino}-1-carboxy-4-oxobutyl)amino]-1-oxopropan-2-yl}amino)-1-oxopropan-2-yl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) uridine 5'-(3-{2-acetamido-3-O-[1-({(2S)-1-[(4-{[(1S)-5-amino-1-carboxypentyl]amino}-1-carboxy-4-oxobutyl)amino]-1-oxopropan-2-yl}amino)-1-oxopropan-2-yl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine|UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine|UDPMurAc(oyl-L-Ala-D-gamma-Glu-L-Lys)|uridine 5'-(3-{2-acetamido-3-O-[1-({(2S)-1-[(4-{[(1S)-5-amino-1-carboxypentyl]amino}-1-carboxy-4-oxobutyl)amino]-1-oxopropan-2-yl}amino)-1-oxopropan-2-yl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_16329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16330 biolink:ChemicalEntity 17beta-hydroxy-5alpha-androstan-3-one A 17β-hydroxy steroid that is testosterone in which the 4,5 double bond has been reduced to a single bond with α-configuration at position 5. cas:521-18-6|drugbank:DB02901|drugcentral:3927|hmdb:HMDB0002961|kegg.compound:C03917|kegg.drug:D07456|lipidmaps:LMST02020042|metacyc.compound:17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O|pdb-ccd:DHT|pubmed:15251265|pubmed:15811352|pubmed:18076420|wikipedia.en:Dihydrotestosterone Graph 17-beta-hydroxy-5-alpha-androstan-3-one|17beta-Hydroxy-5alpha-androstan-3-one|17beta-Hydroxyandrostan-3-one|17beta-hydroxy-5alpha-androstan-3-one|17beta-hydroxyandrostan-3-one|4,5alpha-dihydrotestosterone|5alpha-DHT|5alpha-Dihydrotestosterone|5alpha-dihydrotestosterone|Androstanolone|DHT|DIHYDROTESTOSTERONE|Dihydrotestosteron|Stanolone|androstanolona|androstanolone|androstanolonum|dihydrotestosterone 17beta-Hydroxy-5alpha-androstan-3-one|17beta-hydroxy-5alpha-androstan-3-one 17-beta-hydroxy-5-alpha-androstan-3-one|17beta-Hydroxy-5alpha-androstan-3-one|17beta-Hydroxyandrostan-3-one|17beta-hydroxy-5alpha-androstan-3-one|17beta-hydroxyandrostan-3-one|4,5alpha-dihydrotestosterone|5alpha-DHT|5alpha-Dihydrotestosterone|5alpha-dihydrotestosterone|Androstanolone|DHT|DIHYDROTESTOSTERONE|Dihydrotestosteron|Stanolone|androstanolona|androstanolone|androstanolonum|dihydrotestosterone http://purl.obolibrary.org/obo/CHEBI_16330 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16331 biolink:ChemicalEntity phloretate A hydroxy monocarboxylic acid anion that is the conjugate base of phloretic acid, arising from deprotonation of the carboxy group. gmelin:1785227|kegg.compound:C01744 Graph 3-(4-hydroxyphenyl)propanate|3-(4-hydroxyphenyl)propanoate|phloretate 3-(4-hydroxyphenyl)propanoate 3-(4-hydroxyphenyl)propanate|3-(4-hydroxyphenyl)propanoate|phloretate http://purl.obolibrary.org/obo/CHEBI_16331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16332 biolink:ChemicalEntity D-xylulose 5-phosphate The D-enantiomer of xylulose 5-phosphate. cas:60802-29-1|kegg.compound:C00231|knapsack:C00019693|reaxys:1913425 Graph 5-O-phosphono-D-threo-pentos-2-ulose|5-O-phosphono-D-xylulose|D-Xylulose 5-phosphate|D-Xylulose-5-phosphate|D-threo-pentos-2-ulose 5-(dihydrogen phosphate)|D-xylulose 5-(dihydrogen phosphate) D-Xylulose 5-phosphate|D-threo-pentos-2-ulose 5-(dihydrogen phosphate)|D-xylulose 5-(dihydrogen phosphate) 5-O-phosphono-D-threo-pentos-2-ulose|5-O-phosphono-D-xylulose|D-Xylulose 5-phosphate|D-Xylulose-5-phosphate|D-threo-pentos-2-ulose 5-(dihydrogen phosphate)|D-xylulose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16333 biolink:ChemicalEntity 2-arylpropionic acid A class of carboxylic acids of general formula RCHCH3C(=O)OH where R represents an aryl group. kegg.compound:C06389 Graph 2-Arylpropionate|2-arylpropanoic acid|2-arylpropionic acids 2-Arylpropionate|2-arylpropanoic acid|2-arylpropionic acids http://purl.obolibrary.org/obo/CHEBI_16333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16335 biolink:ChemicalEntity adenosine A ribonucleoside composed of a molecule of adenine attached to a ribofuranose moiety via a β‒N9-glycosidic bond. cas:58-61-7|drugbank:DB00640|drugcentral:90|ecmdb:ECMDB00050|gmelin:53385|hmdb:HMDB0000050|kegg.compound:C00212|kegg.drug:D00045|knapsack:C00007444|lincs.smallmolecule:LSM-28568|metacyc.compound:ADENOSINE|pdb-ccd:ADN|pdb-ccd:ArF00|pdb-ccd:ArS00|pubmed:11213237|pubmed:11820865|pubmed:11978011|pubmed:16183671|pubmed:16917093|pubmed:17190852|pubmed:18000974|pubmed:323854|reaxys:93029|wikipedia.en:Adenosine|ymdb:YMDB00058 Graph (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol|6-Amino-9-beta-D-ribofuranosyl-9H-purine|9-beta-D-Ribofuranosidoadenine|9-beta-D-Ribofuranosyl-9H-purin-6-amine|9-beta-D-ribofuranosyl-9H-purin-6-amine|9-beta-D-ribofuranosyladenine|ADENOSINE|Ade-Rib|Adenocard|Adenocor|Adenoscan|Adenosin|Adenosine|Ado|adenine riboside|adenosine|beta-D-adenosine ADENOSINE|Adenosine|adenosine (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol|6-Amino-9-beta-D-ribofuranosyl-9H-purine|9-beta-D-Ribofuranosidoadenine|9-beta-D-Ribofuranosyl-9H-purin-6-amine|9-beta-D-ribofuranosyl-9H-purin-6-amine|9-beta-D-ribofuranosyladenine|ADENOSINE|Ade-Rib|Adenocard|Adenocor|Adenoscan|Adenosin|Adenosine|Ado|adenine riboside|adenosine|beta-D-adenosine http://purl.obolibrary.org/obo/CHEBI_16335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16336 biolink:ChemicalEntity hyaluronic acid A mucopolysaccharide composed of N-acetylglucosamine and glucuronic acid subunits. It is found in the connective tissues of vertebrates. A principal constituent of the extracellular matrix (ECM), it mediates the growth and metastasis of tumour cells. beilstein:8538277|cas:9004-61-9|hmdb:HMDB0010366|kegg.compound:C00518|kegg.drug:D08043|kegg.glycan:G10505|pubmed:11122186|pubmed:18056362|pubmed:18290544|reaxys:8187837|wikipedia.en:Hyaluronan Graph Hyaluronic acid|Hyaluronsaeure|[beta-D-glucopyranuronosyl-(1->3)-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->4)]n|[beta-N-Acetyl-D-glucosaminyl(1,4)beta-D-glucuronosyl(1,3)]n|acide hyaluronique|acido hialuronico|hyaluronan Hyaluronic acid|Hyaluronsaeure|[beta-D-glucopyranuronosyl-(1->3)-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->4)]n|[beta-N-Acetyl-D-glucosaminyl(1,4)beta-D-glucuronosyl(1,3)]n|acide hyaluronique|acido hialuronico|hyaluronan http://purl.obolibrary.org/obo/CHEBI_16336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16337 biolink:ChemicalEntity phosphatidic acid A derivative of glycerol in which one hydroxy group, commonly but not necessarily primary, is esterified with phosphoric acid and the other two are esterified with fatty acids. kegg.compound:C00416 Graph 1,2-Diacyl-sn-glycerol 3-phosphate|3-sn-Phosphatidate|Phosphatidate|Phosphatidic acid|phosphatidic acids 1,2-Diacyl-sn-glycerol 3-phosphate|3-sn-Phosphatidate|Phosphatidate|Phosphatidic acid|phosphatidic acids http://purl.obolibrary.org/obo/CHEBI_16337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16338 biolink:ChemicalEntity 4-hydroxy-L-glutamate(2-) A doubly-charged L-α-amino acid anion resulting from deprotonation of both carboxy groups of 4-hydroxy-L-glutamic acid. kegg.compound:C03079 Graph (2S)-2-amino-4-hydroxypentanedioate|4-hydroxy-L-glutamate 4-hydroxy-L-glutamate (2S)-2-amino-4-hydroxypentanedioate|4-hydroxy-L-glutamate http://purl.obolibrary.org/obo/CHEBI_16338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16342 biolink:ChemicalEntity L-5-carboxymethylhydantoin An imidazolidine-2,4-dione having a carboxymethyl group at the 5-position. kegg.compound:C03703 Graph L-5-Carboxymethylhydantoin|[(4S)-2,5-dioxoimidazolidin-4-yl]acetic acid [(4S)-2,5-dioxoimidazolidin-4-yl]acetic acid L-5-Carboxymethylhydantoin|[(4S)-2,5-dioxoimidazolidin-4-yl]acetic acid http://purl.obolibrary.org/obo/CHEBI_16342 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16343 biolink:ChemicalEntity phenylethanolamine The simplest member of the class of phenylethanolamines that is 2-aminoethanol bearing a phenyl substituent at the 1-position. The parent of the phenylethanolamine class. cas:7568-93-6|drugcentral:3460|hmdb:HMDB0001065|kegg.compound:C02735|metacyc.compound:PHENYLETHANOLAMINE|pubmed:3137238|pubmed:7201021|reaxys:971222|wikipedia.en:Phenylethanolamine Graph 2-Amino-1-phenylethanol|2-Hydroxy-2-phenylethylamine|2-Hydroxyphenethylamine|2-Phenyl-2-hydroxyethylamine|2-amino-1-phenylethanol|Bisnorephedrine|Phenethanolamine|Phenylethanolamine|alpha-(Aminomethyl)benzyl alcohol|alpha-(aminomethyl)benzyl alcohol|beta-Hydroxy-beta-phenylethylamine|beta-Hydroxyphenethylamine|beta-Phenethanolamine|beta-Phenylethanolamine 2-Amino-1-phenylethanol|2-amino-1-phenylethanol 2-Amino-1-phenylethanol|2-Hydroxy-2-phenylethylamine|2-Hydroxyphenethylamine|2-Phenyl-2-hydroxyethylamine|2-amino-1-phenylethanol|Bisnorephedrine|Phenethanolamine|Phenylethanolamine|alpha-(Aminomethyl)benzyl alcohol|alpha-(aminomethyl)benzyl alcohol|beta-Hydroxy-beta-phenylethylamine|beta-Hydroxyphenethylamine|beta-Phenethanolamine|beta-Phenylethanolamine http://purl.obolibrary.org/obo/CHEBI_16343 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16344 biolink:ChemicalEntity guanidinoacetic acid The N-amidino derivative of glycine. cas:352-97-6|drugbank:DB02751|hmdb:HMDB0000128|kegg.compound:C00581|metacyc.compound:GUANIDOACETIC_ACID|pdb-ccd:NMG|pubmed:15462098|pubmed:16538977|pubmed:22770225|pubmed:23329885|pubmed:24103317|pubmed:25460748|pubmed:25468046|pubmed:25622538|pubmed:25680689|pubmed:25896543|pubmed:26079223|pubmed:26216477|pubmed:26255041|pubmed:26311810|pubmed:26376857|pubmed:26411433|pubmed:26445773|pubmed:26485404|pubmed:26684475|reaxys:1759179|wikipedia.en:Glycocyamine Graph (carbamimidamido)acetic acid|Glycocyamine|Guanidinoacetate|Guanidinoacetic acid|Guanidoacetic acid|N-(carbamimidoyl)glycine|N-Amidinoglycine|N-[Amino(Imino)Methyl]Glycine|N-amidinoglycine|N-carbamimidoylglycine|N-guanylglycine|guanidineacetic acid (carbamimidamido)acetic acid|N-carbamimidoylglycine (carbamimidamido)acetic acid|Glycocyamine|Guanidinoacetate|Guanidinoacetic acid|Guanidoacetic acid|N-(carbamimidoyl)glycine|N-Amidinoglycine|N-[Amino(Imino)Methyl]Glycine|N-amidinoglycine|N-carbamimidoylglycine|N-guanylglycine|guanidineacetic acid http://purl.obolibrary.org/obo/CHEBI_16344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16345 biolink:ChemicalEntity 3-sulfino-L-alanine The organosulfinic acid arising from oxidation of the sulfhydryl group of L-cysteine. cas:1115-65-7|drugbank:DB02153|hmdb:HMDB0000996|kegg.compound:C00606|pdb-ccd:CSD|pubmed:18559081|pubmed:19885389|pubmed:7978266|reaxys:1724100|wikipedia.en:Cysteine_sulfinic_acid Graph (2R)-2-amino-3-sulfinopropanoic acid|3-SULFINOALANINE|3-Sulfino-L-alanine|3-Sulfinoalanine|3-Sulphino-L-alanine|3-sulfino-L-alanine|L-Cysteinesulfinic acid 3-Sulfino-L-alanine|3-sulfino-L-alanine (2R)-2-amino-3-sulfinopropanoic acid|3-SULFINOALANINE|3-Sulfino-L-alanine|3-Sulfinoalanine|3-Sulphino-L-alanine|3-sulfino-L-alanine|L-Cysteinesulfinic acid http://purl.obolibrary.org/obo/CHEBI_16345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16346 biolink:ChemicalEntity (S)-1-phenylethanol The (S)-enantiomer of 1-phenylethanol. cas:1445-91-6|gmelin:26803|kegg.compound:C11348|pdb-ccd:SS1|reaxys:2039797|umbbd.compound:c0266 Graph (1S)-1-phenylethanol|(S)-1-Phenethyl alcohol|(S)-1-Phenylethanol|(S)-1-phenylethanol|(S)-alpha-methylbenzenemethanol (1S)-1-phenylethanol (1S)-1-phenylethanol|(S)-1-Phenethyl alcohol|(S)-1-Phenylethanol|(S)-1-phenylethanol|(S)-alpha-methylbenzenemethanol http://purl.obolibrary.org/obo/CHEBI_16346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16347 biolink:ChemicalEntity (R)-carnitine The (R)-enantiomer of carnitine. beilstein:4292315|beilstein:5732837|cas:541-15-1|drugbank:DB00583|drugcentral:513|gmelin:1782973|hmdb:HMDB0000062|kegg.compound:C00318|kegg.drug:D02176|metacyc.compound:CARNITINE|pdb-ccd:152 Graph (-)-Carnitine|(-)-L-Carnitine|(3R)-3-hydroxy-4-(trimethylammonio)butanoate|(R)-Carnitine|(R)-carnitine|3-Carboxy-2-hydroxy-N,N,N-trimethyl-1-propanaminium hydroxide, inner salt|Carnicor|Carnitene|Carnitine|Carnitor|L-Carnitine|Levocarnitine|Vitamin BT (3R)-3-hydroxy-4-(trimethylammonio)butanoate (-)-Carnitine|(-)-L-Carnitine|(3R)-3-hydroxy-4-(trimethylammonio)butanoate|(R)-Carnitine|(R)-carnitine|3-Carboxy-2-hydroxy-N,N,N-trimethyl-1-propanaminium hydroxide, inner salt|Carnicor|Carnitene|Carnitine|Carnitor|L-Carnitine|Levocarnitine|Vitamin BT http://purl.obolibrary.org/obo/CHEBI_16347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16348 biolink:ChemicalEntity 3-nitropropanoic acid A C-nitro compound that is propanoic acid in which one of the methyl hydrogens has been replaced by a nitro group. beilstein:1759889|cas:504-88-1|gmelin:533092|kegg.compound:C05669|knapsack:C00018684|lincs.smallmolecule:LSM-6632|pdb-ccd:3NP|pubmed:11409756|pubmed:11785916|pubmed:14700739|pubmed:16038559|pubmed:16300642|pubmed:16443208|pubmed:16940769|pubmed:17183449|pubmed:17344940|pubmed:17566644|pubmed:19755148|pubmed:19763544|pubmed:19779956|pubmed:25963711|pubmed:26796265|pubmed:26957301|pubmed:27289244|pubmed:27682807|pubmed:27690136|pubmed:27890093|pubmed:28164735|pubmed:28271107|pubmed:8848189 Graph 3-NITROPROPANOIC ACID|3-nitropropanoic acid|3-nitropropionic acid|Bovinocidin|beta-Nitropropanoic acid|beta-Nitropropionic acid 3-NITROPROPANOIC ACID|3-nitropropanoic acid 3-NITROPROPANOIC ACID|3-nitropropanoic acid|3-nitropropionic acid|Bovinocidin|beta-Nitropropanoic acid|beta-Nitropropionic acid http://purl.obolibrary.org/obo/CHEBI_16348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16349 biolink:ChemicalEntity L-citrulline The L-enantiomer of citrulline. beilstein:6055157|cas:372-75-8|drugbank:DB00155|drugcentral:3103|ecmdb:ECMDB00904|gmelin:774677|hmdb:HMDB0000904|kegg.compound:C00327|kegg.drug:D07706|knapsack:C00001348|metacyc.compound:L-CITRULLINE|pdb-ccd:CIR|pubmed:11862757|pubmed:17190852|pubmed:18022291|pubmed:19173225|pubmed:21067832|pubmed:21915076|pubmed:21955999|pubmed:22119809|pubmed:22345866|pubmed:22348173|pubmed:22387109|pubmed:22388927|pubmed:22402328|pubmed:22402472|pubmed:22512552|reaxys:1725416|wikipedia.en:Citrulline|ymdb:YMDB00060 Graph (2S)-2-amino-5-(carbamoylamino)pentanoic acid|(S)-2-Amino-5-ureidopentanoic acid|2-Amino-5-ureidovaleric acid|CITRULLINE|Cit|Citrulline|L-2-Amino-5-ureidovaleric acid|L-Citrulline|L-citrulline|N(5)-(aminocarbonyl)-L-ornithine|N(5)-carbamoyl-L-ornithine|N(delta)-carbamylornithine|N5-(Aminocarbonyl)ornithine|N5-carbamoylornithine|alpha-amino-delta-ureidovaleric acid|delta-ureidonorvaline (2S)-2-amino-5-(carbamoylamino)pentanoic acid|CITRULLINE|L-Citrulline|L-citrulline|N(5)-carbamoyl-L-ornithine (2S)-2-amino-5-(carbamoylamino)pentanoic acid|(S)-2-Amino-5-ureidopentanoic acid|2-Amino-5-ureidovaleric acid|CITRULLINE|Cit|Citrulline|L-2-Amino-5-ureidovaleric acid|L-Citrulline|L-citrulline|N(5)-(aminocarbonyl)-L-ornithine|N(5)-carbamoyl-L-ornithine|N(delta)-carbamylornithine|N5-(Aminocarbonyl)ornithine|N5-carbamoylornithine|alpha-amino-delta-ureidovaleric acid|delta-ureidonorvaline http://purl.obolibrary.org/obo/CHEBI_16349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16350 biolink:ChemicalEntity 2'-deoxyribonucleoside 5'-diphosphate kegg.compound:C03786 Graph 2'-deoxyribonucleoside 5'-diphosphates|Deoxynucleoside diphosphate 2'-deoxyribonucleoside 5'-diphosphates|Deoxynucleoside diphosphate http://purl.obolibrary.org/obo/CHEBI_16350 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:16351 biolink:ChemicalEntity 2-(alpha-D-mannosyl)-3-phosphoglyceric acid A is a monophosphoglyceric acid having the phosphate group at the 3-position as well as an α-D-mannosyl residue attached at the 2-position. kegg.compound:C11516 Graph 2-(alpha-D-Mannosyl)-3-phosphoglycerate|2-(alpha-D-mannopyranosyloxy)-3-(phosphonooxy)propanoic acid 2-(alpha-D-mannopyranosyloxy)-3-(phosphonooxy)propanoic acid 2-(alpha-D-Mannosyl)-3-phosphoglycerate|2-(alpha-D-mannopyranosyloxy)-3-(phosphonooxy)propanoic acid http://purl.obolibrary.org/obo/CHEBI_16351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16352 biolink:ChemicalEntity 4-hydroxy-1-pyrroline-2-carboxylic acid A 1-pyrrolinecarboxylic acid having a hydroxy substituent at the 4-position. beilstein:471742|hmdb:HMDB0002234|kegg.compound:C04282 Graph 1-Pyrroline-4-hydroxy-2-carboxylate|3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid 3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid 1-Pyrroline-4-hydroxy-2-carboxylate|3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16353 biolink:ChemicalEntity sinapine An acylcholine in which the acyl group specified is sinapoyl. cas:18696-26-9|kegg.compound:C00933|knapsack:C00002777|pubmed:16827311|pubmed:18589789|pubmed:23030806|reaxys:4933491 Graph 2-(4-hydroxy-3,5-dimethoxycinnamoyloxy)-N,N,N-trimethylethanaminium|2-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]-N,N,N-trimethylethanaminium|O-sinapoylcholine|Sinapine|Sinapoylcholine 2-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]-N,N,N-trimethylethanaminium 2-(4-hydroxy-3,5-dimethoxycinnamoyloxy)-N,N,N-trimethylethanaminium|2-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyloxy]-N,N,N-trimethylethanaminium|O-sinapoylcholine|Sinapine|Sinapoylcholine http://purl.obolibrary.org/obo/CHEBI_16353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16354 biolink:ChemicalEntity N-methylhydantoin A imidazolidine-2,4-dione that is the N-methyl-derivative of hydantoin. cas:616-04-6|hmdb:HMDB0003646|kegg.compound:C02565|metacyc.compound:N-METHYLHYDANTOIN|pubmed:15533691|pubmed:3196760|pubmed:8287520|reaxys:112062 Graph 1-Methylhydantoin|1-methylimidazolidine-2,4-dione|Dioxy-creatinine|N-Methylhydantoin|N-Methylimidazolidine-2,4-dione|N-methylhydantoin 1-methylimidazolidine-2,4-dione 1-Methylhydantoin|1-methylimidazolidine-2,4-dione|Dioxy-creatinine|N-Methylhydantoin|N-Methylimidazolidine-2,4-dione|N-methylhydantoin http://purl.obolibrary.org/obo/CHEBI_16354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16355 biolink:ChemicalEntity 1-iodo-2-methoxybenzene An organoiodine compound that is iodobenzene substituted by methoxy group at psotion 2. cas:529-28-2|kegg.compound:C03575|pubmed:16323837|pubmed:24204408|reaxys:1860243 Graph 1-iodo-2-methoxybenzene|2-Iodophenol methyl ether|o-iodoanisole 1-iodo-2-methoxybenzene 1-iodo-2-methoxybenzene|2-Iodophenol methyl ether|o-iodoanisole http://purl.obolibrary.org/obo/CHEBI_16355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16356 biolink:ChemicalEntity 3',5'-cyclic GMP A 3',5'-cyclic purine nucleotide in which the purine nucleobase is specified as guanidine. cas:7665-99-8|drugbank:DB02315|hmdb:HMDB0001314|kegg.compound:C00942|knapsack:C00019673|pdb-ccd:35G|pdb-ccd:PCG|pubmed:24591051|pubmed:24705918|reaxys:586222 Graph 3',5'-Cyclic GMP|Cyclic GMP|Guanosine 3',5'-cyclic monophosphate|Guanosine 3',5'-cyclic phosphate|Guanosine cyclic monophosphate|cGMP|guanosine 3',5'-(hydrogen phosphate) guanosine 3',5'-(hydrogen phosphate) 3',5'-Cyclic GMP|Cyclic GMP|Guanosine 3',5'-cyclic monophosphate|Guanosine 3',5'-cyclic phosphate|Guanosine cyclic monophosphate|cGMP|guanosine 3',5'-(hydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16357 biolink:ChemicalEntity 3-(pyrazol-1-yl)-L-alanine cas:10162-27-3|kegg.compound:C01162|knapsack:C00001390 Graph 3-(1H-pyrazol-1-yl)-L-alanine|3-(Pyrazol-1-yl)-L-alanine|3-(pyrazol-1-yl)-L-alanine|beta-Pyrazol-1-ylalanine|beta-pyrazol-1-ylalanine 3-(1H-pyrazol-1-yl)-L-alanine 3-(1H-pyrazol-1-yl)-L-alanine|3-(Pyrazol-1-yl)-L-alanine|3-(pyrazol-1-yl)-L-alanine|beta-Pyrazol-1-ylalanine|beta-pyrazol-1-ylalanine http://purl.obolibrary.org/obo/CHEBI_16357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16358 biolink:ChemicalEntity (R)-vicianin cas:155-57-7|kegg.compound:C01870|knapsack:C00001458 Graph (2R)-[beta-L-arabinopyranosyl-(1->6)-beta-D-glucopyranosyloxy](phenyl)acetonitrile|(R)-Vicianin|(R)-vicianin (2R)-[beta-L-arabinopyranosyl-(1->6)-beta-D-glucopyranosyloxy](phenyl)acetonitrile (2R)-[beta-L-arabinopyranosyl-(1->6)-beta-D-glucopyranosyloxy](phenyl)acetonitrile|(R)-Vicianin|(R)-vicianin http://purl.obolibrary.org/obo/CHEBI_16358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16359 biolink:ChemicalEntity cholic acid A bile acid that is 5β-cholan-24-oic acid bearing three α-hydroxy substituents at position 3, 7 and 12. cas:81-25-4|drugbank:DB02659|drugcentral:3096|hmdb:HMDB0000619|kegg.compound:C00695|lincs.smallmolecule:LSM-5541|lipidmaps:LMST04010001|metacyc.compound:CHOLATE|pdb-ccd:CHD|pubmed:22770225|reaxys:2822009|wikipedia.en:Cholic_Acid Graph (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oic acid|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid|CHOLIC ACID|Cholic acid|Cholsaeure 3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oic acid|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid|CHOLIC ACID|Cholic acid|Cholsaeure http://purl.obolibrary.org/obo/CHEBI_16359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16362 biolink:ChemicalEntity D-aldose kegg.compound:C00737 Graph D-Aldose|D-aldoses D-Aldose|D-aldoses http://purl.obolibrary.org/obo/CHEBI_16362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16364 biolink:ChemicalEntity pyridine-2,5-diol A dihydroxypyridine that is pyridine substituted by hydroxy groups at positions 2 and 5. cas:5154-01-8|kegg.compound:C01059|reaxys:108753 Graph 2,5-Dihydroxypyridine|2,5-dihydroxypyridine|pyridine-2,5-diol pyridine-2,5-diol 2,5-Dihydroxypyridine|2,5-dihydroxypyridine|pyridine-2,5-diol http://purl.obolibrary.org/obo/CHEBI_16364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16365 biolink:ChemicalEntity quinolin-2-ol A monohydroxyquinoline carrying a hydroxy substituent at position 2. It is an intermediate metabolite produced duting the microbial degradation of quinoline. cas:59-31-4|kegg.compound:C06338|pdb-ccd:OCH|pubmed:15202860|pubmed:19856115|pubmed:21558655|reaxys:386285 Graph 2-Chinolinol|2-Hydroxyquinoline|2-Quinolinol|Quinolin-2-ol|quinolin-2-ol Quinolin-2-ol|quinolin-2-ol 2-Chinolinol|2-Hydroxyquinoline|2-Quinolinol|Quinolin-2-ol|quinolin-2-ol http://purl.obolibrary.org/obo/CHEBI_16365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16366 biolink:ChemicalEntity anthocyanidin cation Any organic cation that is an aglycon of anthocyanin cation; they are oxygenated derivatives of flavylium (2-phenylchromenylium). hmdb:HMDB0031460|kegg.compound:C02003|metacyc.compound:Anthocyanidins|wikipedia.en:Anthocyanidins Graph Anthocyanidin|anthocyanidin cations|anthocyanidins anthocyanidins Anthocyanidin|anthocyanidin cations|anthocyanidins http://purl.obolibrary.org/obo/CHEBI_16366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16367 biolink:ChemicalEntity N(tele)-methyl-L-histidine residue drugbank:DB04151|kegg.compound:C04087|pdb-ccd:HIC|resid:AA0317 Graph 1'-methyl-L-histidine|4-METHYL-HISTIDINE|N(tele)-methyl-L-histidine residue|Protein Ntau-methyl-L-histidine 1'-methyl-L-histidine|4-METHYL-HISTIDINE|N(tele)-methyl-L-histidine residue|Protein Ntau-methyl-L-histidine http://purl.obolibrary.org/obo/CHEBI_16367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16368 biolink:ChemicalEntity 6-hydroxymellein An isochromane that is mellein bearing an additional hydroxy substituent at the 6-position. cas:70901-60-9|kegg.compound:C02379|knapsack:C00000554|pubmed:7706125|reaxys:3544385 Graph (-)-6-hydroxymellein|(3R)-3,4-dihydro-6,8-dihydroxy-3-methyl-isocoumarin|(3R)-6,8-dihydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one|(R)-(-)-6-hydroxymellein|(R)-3,4-dihydro-6,8-dihydroxy-3-methyl-1H-2-benzopyran-1-one|(R)-6-hydroxymellein|3,4-Dihydro-6,8-dihydroxy-3-methylisocoumarin|6,8-Dihydroxy-3-methyl-3,4-dihydroisocoumarin|6-Hydroxymellein|6-hydroxymellein (3R)-6,8-dihydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one (-)-6-hydroxymellein|(3R)-3,4-dihydro-6,8-dihydroxy-3-methyl-isocoumarin|(3R)-6,8-dihydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one|(R)-(-)-6-hydroxymellein|(R)-3,4-dihydro-6,8-dihydroxy-3-methyl-1H-2-benzopyran-1-one|(R)-6-hydroxymellein|3,4-Dihydro-6,8-dihydroxy-3-methylisocoumarin|6,8-Dihydroxy-3-methyl-3,4-dihydroisocoumarin|6-Hydroxymellein|6-hydroxymellein http://purl.obolibrary.org/obo/CHEBI_16368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16369 biolink:ChemicalEntity 5-dehydro-4-deoxy-D-glucaric acid An oxo dicarboxylic acid that is derived from 4-deoxy-D-glucaric acid by oxidation of the hydroxy group at position 5 to give the corresponding ketone. kegg.compound:C00679|pdb-ccd:GLR|reaxys:7581871 Graph 3-deoxy-L-threo-hex-2-ulosaric acid|5-Dehydro-4-deoxy-D-glucarate 3-deoxy-L-threo-hex-2-ulosaric acid 3-deoxy-L-threo-hex-2-ulosaric acid|5-Dehydro-4-deoxy-D-glucarate http://purl.obolibrary.org/obo/CHEBI_16369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16370 biolink:ChemicalEntity dihydrophloroglucinol kegg.compound:C06719|umbbd.compound:c0027 Graph 3,5-dihydroxycyclohex-2-en-1-one|Dihydrophloroglucinol 3,5-dihydroxycyclohex-2-en-1-one 3,5-dihydroxycyclohex-2-en-1-one|Dihydrophloroglucinol http://purl.obolibrary.org/obo/CHEBI_16370 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16374 biolink:ChemicalEntity menaquinone Any member of the class of menaquinones that is 2-methyl-1,4-naphthoquinone with an unsaturated isoprenoid chain at the 3-position. cas:11032-49-8|kegg.compound:C00828|wikipedia.en:Vitamin_K2 Graph MK-n|Menaquinone|Menatetrenone|a menaquinone|menaquinone-n|vitamin K2 MK-n|Menaquinone|Menatetrenone|a menaquinone|menaquinone-n|vitamin K2 http://purl.obolibrary.org/obo/CHEBI_16374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16375 biolink:ChemicalEntity D-cysteine An optically active form of cysteine having D-configuration. cas:921-01-7|drugbank:DB03201|ecmdb:ECMDB03417|gmelin:363236|hmdb:HMDB0003417|kegg.compound:C00793|knapsack:C00007323|pdb-ccd:DCY|pubmed:13761469|pubmed:23340406|pubmed:24800864|reaxys:1721407|ymdb:YMDB00913 Graph (2S)-2-amino-3-mercaptopropanoic acid|(2S)-2-amino-3-sulfanylpropanoic acid|(S)-2-amino-3-mercaptopropanoic acid|D-Amino-3-mercaptopropionic acid|D-CYSTEINE|D-Cystein|D-Cysteine|D-Zystein|D-cysteine|DCY D-CYSTEINE|D-Cysteine|D-cysteine (2S)-2-amino-3-mercaptopropanoic acid|(2S)-2-amino-3-sulfanylpropanoic acid|(S)-2-amino-3-mercaptopropanoic acid|D-Amino-3-mercaptopropionic acid|D-CYSTEINE|D-Cystein|D-Cysteine|D-Zystein|D-cysteine|DCY http://purl.obolibrary.org/obo/CHEBI_16375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16377 biolink:ChemicalEntity sabinene hydrate cas:15537-55-0|cas:546-79-2|kegg.compound:C02462|knapsack:C00000830 Graph 5-isopropyl-2-methylbicyclo[3.1.0]hexan-2-ol|Sabinene hydrate|sabinene hydrate 5-isopropyl-2-methylbicyclo[3.1.0]hexan-2-ol 5-isopropyl-2-methylbicyclo[3.1.0]hexan-2-ol|Sabinene hydrate|sabinene hydrate http://purl.obolibrary.org/obo/CHEBI_16377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16378 biolink:ChemicalEntity threo-3-methyl-L-aspartate(2-) Graph (2S,3S)-2-amino-3-methylbutanedioate|(3S)-3-methyl-L-aspartate (2S,3S)-2-amino-3-methylbutanedioate|(3S)-3-methyl-L-aspartate (2S,3S)-2-amino-3-methylbutanedioate|(3S)-3-methyl-L-aspartate http://purl.obolibrary.org/obo/CHEBI_16378 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16379 biolink:ChemicalEntity Co-methyl-Co-5-hydroxybenzimidazolylcob(III)amide kegg.compound:C04665 Graph Co-methyl-Co-5-hydroxybenzimidazolylcob(III)amide Co-methyl-Co-5-hydroxybenzimidazolylcob(III)amide http://purl.obolibrary.org/obo/CHEBI_16379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16380 biolink:ChemicalEntity vindoline cas:2182-14-1|kegg.compound:C01626|knapsack:C00001784|knapsack:C00024613 Graph Vindoline|methyl 4beta-acetyloxy-3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate methyl 4beta-acetyloxy-3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate Vindoline|methyl 4beta-acetyloxy-3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate http://purl.obolibrary.org/obo/CHEBI_16380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16381 biolink:ChemicalEntity deoxynucleoside triphosphat kegg.compound:C00677 Graph 2'-deoxynucleoside 5'-(tetrahydrogen triphosphate)|2'-deoxyribonucleoside 5'-triphosphates|deoxynucleoside triphosphate 2'-deoxynucleoside 5'-(tetrahydrogen triphosphate) 2'-deoxynucleoside 5'-(tetrahydrogen triphosphate)|2'-deoxyribonucleoside 5'-triphosphates|deoxynucleoside triphosphate http://purl.obolibrary.org/obo/CHEBI_16381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16382 biolink:ChemicalEntity iodide beilstein:3587184|cas:20461-54-5|gmelin:14912|kegg.compound:C00708|pdb-ccd:IOD Graph I(-)|I-|IODIDE ION|Iodide|iodide|iodide(1-)|iodine anion Iodide|iodide|iodide(1-) I(-)|I-|IODIDE ION|Iodide|iodide|iodide(1-)|iodine anion http://purl.obolibrary.org/obo/CHEBI_16382 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16383 biolink:ChemicalEntity cis-aconitate(3-) An aconitate(3−) that is the conjugate base of cis-aconitic acid. gmelin:329168|kegg.compound:C00417|metacyc.compound:CIS-ACONITATE Graph (1Z)-prop-1-ene-1,2,3-tricarboxylate|Cis-aconitate (1Z)-prop-1-ene-1,2,3-tricarboxylate (1Z)-prop-1-ene-1,2,3-tricarboxylate|Cis-aconitate http://purl.obolibrary.org/obo/CHEBI_16383 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16384 biolink:ChemicalEntity trans-5-O-caffeoyl-D-quinic acid A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 5-hydroxy group of quinic acid. cas:202650-88-2|cas:906-33-2|kegg.compound:C17147|pubmed:19022950|pubmed:24079179|pubmed:24619353|pubmed:24842397|reaxys:3039251 Graph (1R,3R,4S,5R)-3-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|1D-[1(OH),3,4/5]-3-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|Caffeoyl quinic acid|Neochlorogenate|Neochlorogenic acid|trans-5-O-Caffeoyl-D-quinate|trans-Neochlorogenic acid 1D-[1(OH),3,4/5]-3-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid (1R,3R,4S,5R)-3-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|1D-[1(OH),3,4/5]-3-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexanecarboxylic acid|Caffeoyl quinic acid|Neochlorogenate|Neochlorogenic acid|trans-5-O-Caffeoyl-D-quinate|trans-Neochlorogenic acid http://purl.obolibrary.org/obo/CHEBI_16384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16385 biolink:ChemicalEntity organic sulfide Compounds having the structure RSR (R ≠ H). Such compounds were once called thioethers. kegg.compound:C00297 Graph RSR|Sulfide|Thioether|organic sulfides|sulfides|thioethers sulfides RSR|Sulfide|Thioether|organic sulfides|sulfides|thioethers http://purl.obolibrary.org/obo/CHEBI_16385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16387 biolink:ChemicalEntity (R)-N-methylcoclaurine The (R)-enantiomer of N-methylcoclaurine. cas:5096-70-8|kegg.compound:C05243|knapsack:C00025619 Graph (1R)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(R)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(R)-N-Methylcoclaurine|(R)-N-methylcoclaurine (1R)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (1R)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(R)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(R)-N-Methylcoclaurine|(R)-N-methylcoclaurine http://purl.obolibrary.org/obo/CHEBI_16387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16388 biolink:ChemicalEntity 4-hydroxymandelic acid A 2-hydroxy carboxylic acid that is mandelic acid bearing a phenolic hydroxy substituent at position 4. cas:1198-84-1|gmelin:486823|hmdb:HMDB0000822|kegg.compound:C11527|pubmed:22770225|reaxys:2365374 Graph 4-Hydroxymandelic acid|4-hydroxymandelic acid|4-hydroxyphenylglycolic acid|hydroxy(4-hydroxyphenyl)acetic acid hydroxy(4-hydroxyphenyl)acetic acid 4-Hydroxymandelic acid|4-hydroxymandelic acid|4-hydroxyphenylglycolic acid|hydroxy(4-hydroxyphenyl)acetic acid http://purl.obolibrary.org/obo/CHEBI_16388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16389 biolink:ChemicalEntity ubiquinones Any benzoquinone derived from 2,3-dimethoxy-5-methylbenzoquinone; one of a group of naturally occurring homologues. The redox-active quinoid moiety usually carries a polyprenoid side chain at position 6, the number of isoprenoid units in which is species-specific. Ubiquinones are involved in the control of mitochondrial electron transport, and are also potent anti-oxidants. cas:1339-63-5|kegg.compound:C00399|pubmed:15788391|pubmed:7599208 Graph CoQ|Coenzym Q|Coenzyme Q|Koenzym Q|Q|Ubichinon|Ubiquinone|Ubiquinones|a ubiquinone|coenzyme Q|coenzymes Q|mitochondrial ubiquinone|mitochondrial ubiquinones|mitoquinones CoQ|Coenzym Q|Coenzyme Q|Koenzym Q|Q|Ubichinon|Ubiquinone|Ubiquinones|a ubiquinone|coenzyme Q|coenzymes Q|mitochondrial ubiquinone|mitochondrial ubiquinones|mitoquinones http://purl.obolibrary.org/obo/CHEBI_16389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16390 biolink:ChemicalEntity 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholanic acid beilstein:3224679|cas:911-40-0|kegg.compound:C04643|lipidmaps:LMST04010184 Graph (3alpha,5beta,12alpha)-3,12-dihydroxy-7-oxocholan-24-oic acid|3alpha,12alpha-Dihydroxy-7-oxo-5beta-cholanate|3alpha,12alpha-dihydroxy-7-keto-5beta-cholanoic acid|3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oic acid|3alpha,12alpha-diol-7-one-5beta-cholanoic acid|7-ketodeoxycholic acid|7-oxodeoxycholic acid 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oic acid (3alpha,5beta,12alpha)-3,12-dihydroxy-7-oxocholan-24-oic acid|3alpha,12alpha-Dihydroxy-7-oxo-5beta-cholanate|3alpha,12alpha-dihydroxy-7-keto-5beta-cholanoic acid|3alpha,12alpha-dihydroxy-7-oxo-5beta-cholan-24-oic acid|3alpha,12alpha-diol-7-one-5beta-cholanoic acid|7-ketodeoxycholic acid|7-oxodeoxycholic acid http://purl.obolibrary.org/obo/CHEBI_16390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16392 biolink:ChemicalEntity D-xylono-1,4-lactone beilstein:82061|cas:15384-37-9 Graph (3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|D-Xylono-1,4-lactone|D-xylono-1,4-lactone (3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one (3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|D-Xylono-1,4-lactone|D-xylono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_16392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16393 biolink:ChemicalEntity sphingosine A sphing-4-enine in which the double bond is trans. beilstein:4676153|cas:123-78-4|drugbank:DB03203|hmdb:HMDB0000252|kegg.compound:C00319|lipidmaps:LMSP01010001|pdb-ccd:SQS|pubmed:10453988|pubmed:16341241|pubmed:24731183|pubmed:8482346|reaxys:1727294 Graph (2S,3R)-(E)-2-amino-1,3-dihydroxy-4-octadecene|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-ene-1-ol|(2S,3R,4E)-2-amino-4-octadecene-1,3-diol|(2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol|(2S,3R,E)-2-aminooctadec-4-ene-1,3-diol|(4E)-sphing-4-enine|(4E)-sphingenine|(E)-2-amino-4-octadecan-1,3-diol|(E)-D-erythro-4-octadecene-1,3-diol|2-amino-4-octadecene-1,3-diol|C18 sphingosine|D-(+)-erythro-1,3-dihydroxy-2-amino-4-trans-octadecene|D-erythro-sphingosine|Sph|Sphing-4-enine|Sphingenine|Sphingoid|Sphingosine|Sphingosine d18:1|sphingosin|trans-4-sphingenine|trans-D-erythro-2-amino-4-octadecene-1,3-diol (2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol (2S,3R)-(E)-2-amino-1,3-dihydroxy-4-octadecene|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-ene-1-ol|(2S,3R,4E)-2-amino-4-octadecene-1,3-diol|(2S,3R,4E)-2-aminooctadec-4-ene-1,3-diol|(2S,3R,E)-2-aminooctadec-4-ene-1,3-diol|(4E)-sphing-4-enine|(4E)-sphingenine|(E)-2-amino-4-octadecan-1,3-diol|(E)-D-erythro-4-octadecene-1,3-diol|2-amino-4-octadecene-1,3-diol|C18 sphingosine|D-(+)-erythro-1,3-dihydroxy-2-amino-4-trans-octadecene|D-erythro-sphingosine|Sph|Sphing-4-enine|Sphingenine|Sphingoid|Sphingosine|Sphingosine d18:1|sphingosin|trans-4-sphingenine|trans-D-erythro-2-amino-4-octadecene-1,3-diol http://purl.obolibrary.org/obo/CHEBI_16393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16394 biolink:ChemicalEntity N-methylanthranilic acid An aromatic amino acid that is anthranilic acid in which one of the hydrogens attached to the nitrogen is substituted by a methyl group. cas:119-68-6|hmdb:HMDB0032609|kegg.compound:C03005|lincs.smallmolecule:LSM-20003|pubmed:14267380|pubmed:17404973|pubmed:17404992|reaxys:2208135 Graph 2-(Methylamino)benzoic acid|2-(methylamino)benzoic acid|N-Methyl-2-aminobenzoic acid|N-Methyl-o-aminobenzoic acid|N-Methylanthranilic acid|o-(Methylamino)benzoic acid 2-(Methylamino)benzoic acid|2-(methylamino)benzoic acid 2-(Methylamino)benzoic acid|2-(methylamino)benzoic acid|N-Methyl-2-aminobenzoic acid|N-Methyl-o-aminobenzoic acid|N-Methylanthranilic acid|o-(Methylamino)benzoic acid http://purl.obolibrary.org/obo/CHEBI_16394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16395 biolink:ChemicalEntity N-acetoxy-1,1'-biphenyl-4-amine An N-acetoxyarylamine having 1,1'-biphenyl-4-amine as the arylamine component. cas:119273-47-1|kegg.compound:C03621|reaxys:3545465 Graph N-Acetoxy-4-aminobiphenyl|N-acetoxy-4-aminobiphenyl|N-acetyloxy-[1,1'-biphenyl]-4-amine|N-hydroxy-4-aminobiphenyl O-acetylated conjugate|O-acetyl-N-([1,1'-biphenyl]-4-yl)hydroxylamine N-acetyloxy-[1,1'-biphenyl]-4-amine|O-acetyl-N-([1,1'-biphenyl]-4-yl)hydroxylamine N-Acetoxy-4-aminobiphenyl|N-acetoxy-4-aminobiphenyl|N-acetyloxy-[1,1'-biphenyl]-4-amine|N-hydroxy-4-aminobiphenyl O-acetylated conjugate|O-acetyl-N-([1,1'-biphenyl]-4-yl)hydroxylamine http://purl.obolibrary.org/obo/CHEBI_16395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16397 biolink:ChemicalEntity formamide The simplest monocarboxylic acid amide, obtained by formal condensation of formic acid with ammonia. The parent of the class of formaldehydes. cas:75-12-7|gmelin:824|hmdb:HMDB0001536|kegg.compound:C00488|metacyc.compound:FORMAMIDE|pdb-ccd:ARF|pubmed:11282235|pubmed:11545392|pubmed:12115814|pubmed:14750843|pubmed:15082074|pubmed:17184725|pubmed:19334838|pubmed:21215846|pubmed:21229996|pubmed:21573300|pubmed:21647491|pubmed:21647492|pubmed:21769603|pubmed:21932847|reaxys:505995|umbbd.compound:c0796|wikipedia.en:Formamide Graph Ameisensaeureamid|FORMAMIDE|Formamid|Formamide|Methanamid|Methanamide|carbamaldehyde|formamide|formimidic acid FORMAMIDE|Formamide|formamide Ameisensaeureamid|FORMAMIDE|Formamid|Formamide|Methanamid|Methanamide|carbamaldehyde|formamide|formimidic acid http://purl.obolibrary.org/obo/CHEBI_16397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16398 biolink:ChemicalEntity D-threonine An optically active form of threonine having D-configuration. beilstein:4656043|cas:632-20-2|drugbank:DB03700|ecmdb:ECMDB21519|gmelin:874136|hmdb:HMDB0013775|kegg.compound:C00820|pdb-ccd:DTH|pubmed:15375647|pubmed:17081141|pubmed:22176976|reaxys:1721643|ymdb:YMDB00802 Graph (2R,3S)-2-amino-3-hydroxybutanoic acid|D-2-Amino-3-hydroxybutyric acid|D-THREONINE|D-Threonin|D-Threonine|D-threonine|DTH D-Threonine|D-threonine (2R,3S)-2-amino-3-hydroxybutanoic acid|D-2-Amino-3-hydroxybutyric acid|D-THREONINE|D-Threonin|D-Threonine|D-threonine|DTH http://purl.obolibrary.org/obo/CHEBI_16398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16399 biolink:ChemicalEntity N(3)-oxalyl-L-2,3-diaminopropionic acid An Nβ-acyl-L-2,3-diaminopropionic acid in which the acyl group is oxalyl. cas:5302-45-4|kegg.compound:C04209|knapsack:C00001339 Graph (2-Amino-2-carboxyethyl)-L-oxamic acid|(2S)-2-amino-3-[(carboxycarbonyl)amino]propanoic acid|3-N-Oxalyl-L-2,3-diaminopropanoic acid|3-[(carboxycarbonyl)amino]-L-alanine|L-Dencichin|L-alpha-Amino-beta-oxalylaminopropionic acid|N3-Oxalyl-L-2,3-diaminopropanoate|beta-N-Oxalyl-L-alpha,beta-diaminopropionic acid|beta-N-Oxalylamino-L-alanine (2S)-2-amino-3-[(carboxycarbonyl)amino]propanoic acid|3-[(carboxycarbonyl)amino]-L-alanine (2-Amino-2-carboxyethyl)-L-oxamic acid|(2S)-2-amino-3-[(carboxycarbonyl)amino]propanoic acid|3-N-Oxalyl-L-2,3-diaminopropanoic acid|3-[(carboxycarbonyl)amino]-L-alanine|L-Dencichin|L-alpha-Amino-beta-oxalylaminopropionic acid|N3-Oxalyl-L-2,3-diaminopropanoate|beta-N-Oxalyl-L-alpha,beta-diaminopropionic acid|beta-N-Oxalylamino-L-alanine http://purl.obolibrary.org/obo/CHEBI_16399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16400 biolink:ChemicalEntity gossypetin A hexahydroxyflavone having the hydroxy groups placed at the 3-, 3'-, 4'-, 5- 7- and 8-positions. cas:489-35-0|kegg.compound:C04109|knapsack:C00004721|lincs.smallmolecule:LSM-36971|lipidmaps:LMPK12113231|metacyc.compound:334578-HEXAHYDROXYFLAVONE|patent:JP55054883|patent:WO0103681|pubmed:19895818|pubmed:22953867|pubmed:2676226|pubmed:8424824|reaxys:332194|wikipedia.en:Gossypetin Graph 2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxy-4H-chromen-4-one|3,3',4',5,7,8-Hexahydroxyflavone|Articulatidin|Equisporol|Gossypetin 2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxy-4H-chromen-4-one|3,3',4',5,7,8-Hexahydroxyflavone|Articulatidin|Equisporol|Gossypetin http://purl.obolibrary.org/obo/CHEBI_16400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16404 biolink:ChemicalEntity 3-oxoglycyrrhetinic acid kegg.compound:C02943 Graph 3,11-dioxoolean-12-en-30-oic acid|3-Oxoglycyrrhetinate 3,11-dioxoolean-12-en-30-oic acid 3,11-dioxoolean-12-en-30-oic acid|3-Oxoglycyrrhetinate http://purl.obolibrary.org/obo/CHEBI_16404 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16405 biolink:ChemicalEntity beta-D-Xylp-(1->6)-beta-D-Glcp A β-D-Xylp-(1→6)-D-Glcp in which the carbon bearing the anomeric hydroxy group has β configuration. glygen:G74556OQ|glytoucan:G74556OQ|kegg.compound:C11535|kegg.glycan:G00322 Graph 6-O-(beta-D-Xylopyranosyl)-beta-D-glucopyranose|6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranose|a 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranose|beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranose|beta-Primeverose beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranose 6-O-(beta-D-Xylopyranosyl)-beta-D-glucopyranose|6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranose|a 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranose|beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranose|beta-Primeverose http://purl.obolibrary.org/obo/CHEBI_16405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16406 biolink:ChemicalEntity 5'-acylphosphoadenosin Graph 5'-acylphosphoadenosines 5'-acylphosphoadenosines http://purl.obolibrary.org/obo/CHEBI_16406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16408 biolink:ChemicalEntity vomilenine An indole alkaloid that is vinorine bearing a hydroxy substituent at position 21. cas:6880-50-8|kegg.compound:C01761|knapsack:C00024322|knapsack:C00024338|patent:US2007212745|pubmed:10234858|pubmed:11937349|pubmed:18205139|reaxys:53093|reaxys:6985044|reaxys:9588723 Graph 21alpha-hydroxy-22-norajmala-1,19-dien-17alpha-yl acetate|Vomilenine|vomilenine 21alpha-hydroxy-22-norajmala-1,19-dien-17alpha-yl acetate 21alpha-hydroxy-22-norajmala-1,19-dien-17alpha-yl acetate|Vomilenine|vomilenine http://purl.obolibrary.org/obo/CHEBI_16408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16409 biolink:ChemicalEntity 5-pyridoxic acid A pyridinemonocarboxylic acid that is pyridine-3-carboxylic acid substituted by a hydroxy group at position 5, hydroxy methyl group at position 4 and a methyl group at position 6. agr:FNI91003265|cas:524-07-2|kegg.compound:C04773|pubmed:13610871|reaxys:162958 Graph 5-Pyridoxic acid|5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinecarboxylic acid|5-hydroxy-4-(hydroxymethyl)-6-methylnicotinic acid|5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carboxylic acid|5-pyridoxic acid 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carboxylic acid 5-Pyridoxic acid|5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinecarboxylic acid|5-hydroxy-4-(hydroxymethyl)-6-methylnicotinic acid|5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carboxylic acid|5-pyridoxic acid http://purl.obolibrary.org/obo/CHEBI_16409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16410 biolink:ChemicalEntity pyridoxamine A monohydroxypyridine that is pyridine substituted by a hydroxy group at position 3, an aminomethyl group at position 4, a hydroxymethyl group at position 5 and a methyl group at position 2. The 4-aminomethyl form of vitamin B6, it is used (in the form of the hydrochloride salt) for treatment of diabetic nephropathy. cas:85-87-0|chemspider:1023|foodb.food:FDB021819|gmelin:774473|hmdb:HMDB0001431|kegg.compound:C00534|knapsack:C00007504|metacyc.compound:PYRIDOXAMINE|pdb-ccd:PXM|pubmed:1400785|pubmed:15369738|pubmed:18434162|pubmed:19212411|pubmed:23504149|pubmed:23841818|pubmed:24094054|pubmed:2580028|pubmed:33535220|pubmed:33665688|pubmed:7710125|pubmed:8054960|reaxys:6993|wikipedia.en:Pyridoxamine Graph 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)-2-METHYLPYRIDIN-3-OL|4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol|PM|Pyridoxamine 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)-2-METHYLPYRIDIN-3-OL|4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)-2-METHYLPYRIDIN-3-OL|4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol|PM|Pyridoxamine http://purl.obolibrary.org/obo/CHEBI_16410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16411 biolink:ChemicalEntity indole-3-acetic acid A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by a 1H-indol-3-yl group. bpdb:1106|cas:87-51-4|drugbank:DB07950|gmelin:143197|hmdb:HMDB0000197|kegg.compound:C00954|knapsack:C00000100|pdb-ccd:IAC|pubmed:13610897|pubmed:23545355|pubmed:24285754|reaxys:143358|wikipedia.en:Indole-3-acetic_acid Graph (Indol-3-yl)acetate|1H-indol-3-ylacetic acid|2-(indol-3-yl)ethanoic acid|3-Indolylessigsaeure|IAA|IES|Indole-3-acetic acid|Indoleacetic acid|heteroauxin 1H-indol-3-ylacetic acid (Indol-3-yl)acetate|1H-indol-3-ylacetic acid|2-(indol-3-yl)ethanoic acid|3-Indolylessigsaeure|IAA|IES|Indole-3-acetic acid|Indoleacetic acid|heteroauxin http://purl.obolibrary.org/obo/CHEBI_16411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16412 biolink:ChemicalEntity lipopolysaccharide Liposaccharide natural compounds consisting of a trisaccharide repeating unit (two heptose units and octulosonic acid) with oligosaccharide side chains and 3-hydroxytetradecanoic acid units (they are a major constituent of the cell walls of Gram-negative bacteria). kegg.compound:C00338|pubmed:15589368|pubmed:24186868|pubmed:24506665|pubmed:24642373|pubmed:24659348 Graph LPS|Lipopolysaccharide|lipopolysaccharides LPS|Lipopolysaccharide|lipopolysaccharides http://purl.obolibrary.org/obo/CHEBI_16412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16413 biolink:ChemicalEntity but-2-yne-1,4-diol A butynediol that is but-2-yne substituted by hydroxy groups at positions 1 and 4. cas:110-65-6|kegg.compound:C02497|reaxys:1071237 Graph 1,4-dihydroxy-2-butyne|1,4-dimethoxyacetylene|2-Butyne-1,4-diol|2-butyne-1,4-diol|bis(hydroxymethyl)acetylene|but-2-yne-1,4-diol but-2-yne-1,4-diol 1,4-dihydroxy-2-butyne|1,4-dimethoxyacetylene|2-Butyne-1,4-diol|2-butyne-1,4-diol|bis(hydroxymethyl)acetylene|but-2-yne-1,4-diol http://purl.obolibrary.org/obo/CHEBI_16413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16414 biolink:ChemicalEntity L-valine The L-enantiomer of valine. cas:72-18-4|drugbank:DB00161|drugcentral:4128|gmelin:2827|hmdb:HMDB0000883|kegg.compound:C00183|kegg.drug:D00039|knapsack:C00001398|metacyc.compound:VAL|pdb-ccd:VAL|pubmed:14608070|pubmed:17670823|pubmed:21706252|pubmed:22138982|pubmed:22287678|pubmed:22585822|reaxys:1721136|wikipedia.en:L-valine Graph (2S)-2-amino-3-methylbutanoic acid|(S)-valine|2-Amino-3-methylbutyric acid|L-(+)-alpha-Aminoisovaleric acid|L-Valin|L-Valine|L-alpha-Amino-beta-methylbutyric acid|L-valine|V|VALINE|Val L-Valine|L-valine|VALINE (2S)-2-amino-3-methylbutanoic acid|(S)-valine|2-Amino-3-methylbutyric acid|L-(+)-alpha-Aminoisovaleric acid|L-Valin|L-Valine|L-alpha-Amino-beta-methylbutyric acid|L-valine|V|VALINE|Val http://purl.obolibrary.org/obo/CHEBI_16414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16415 biolink:ChemicalEntity protopine A dibenzazecine alkaloid isolated from Fumaria vaillantii. cas:130-86-9|kegg.compound:C05189|knapsack:C00001906|lincs.smallmolecule:LSM-3874|pubmed:22029392 Graph 4,6,7,14-Tetrahydro-5-methyl-bis(1,3)benzodioxolo(4,5-c-5',6'-g)azecin-13(5H)-one|7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one|7-methyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one|Corydinine|Fumarine|Macleyine|Protopine|protopine 7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one 4,6,7,14-Tetrahydro-5-methyl-bis(1,3)benzodioxolo(4,5-c-5',6'-g)azecin-13(5H)-one|7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one|7-methyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one|Corydinine|Fumarine|Macleyine|Protopine|protopine http://purl.obolibrary.org/obo/CHEBI_16415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16419 biolink:ChemicalEntity limonoic acid kegg.compound:C01593 Graph (1S,3'S,3aR,5aR,6R,7S,9aR,9bR)-1-(carboxymethyl)-7-[(R)-3-furyl(hydroxy)methyl]-9b-(hydroxymethyl)-3,3,5a,7-tetramethyl-5-oxodecahydro-3H-spiro[naphtho[1,2-c]furan-6,2'-oxirane]-3'-carboxylic acid|Limonoate (1S,3'S,3aR,5aR,6R,7S,9aR,9bR)-1-(carboxymethyl)-7-[(R)-3-furyl(hydroxy)methyl]-9b-(hydroxymethyl)-3,3,5a,7-tetramethyl-5-oxodecahydro-3H-spiro[naphtho[1,2-c]furan-6,2'-oxirane]-3'-carboxylic acid (1S,3'S,3aR,5aR,6R,7S,9aR,9bR)-1-(carboxymethyl)-7-[(R)-3-furyl(hydroxy)methyl]-9b-(hydroxymethyl)-3,3,5a,7-tetramethyl-5-oxodecahydro-3H-spiro[naphtho[1,2-c]furan-6,2'-oxirane]-3'-carboxylic acid|Limonoate http://purl.obolibrary.org/obo/CHEBI_16419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:164200 biolink:ChemicalEntity triclosan An aromatic ether that is phenol which is substituted at C-5 by a chloro group and at C-2 by a 2,4-dichlorophenoxy group. It is widely used as a preservative and antimicrobial agent in personal care products such as soaps, skin creams, toothpaste and deodorants as well as in household items such as plastic chopping boards, sports equipment and shoes. cas:3380-34-5|drugbank:DB08604|drugcentral:3631|kegg.compound:C12059|kegg.drug:D06226|lincs.smallmolecule:LSM-2929|patent:NL6401526|patent:US3506720|patent:US3629477|pdb-ccd:TCL|pubmed:11175846|pubmed:11418506|pubmed:15269185|pubmed:17567585|pubmed:18837732|pubmed:18937596|pubmed:19388793|pubmed:21094257|pubmed:21166831|pubmed:21833630|pubmed:22105314|pubmed:22561896|pubmed:22746545|pubmed:23146048|pubmed:23161706|pubmed:23192912|pubmed:23282071|pubmed:23313217|pubmed:23320506|pubmed:23368947|pubmed:23435526|pubmed:23561013|pubmed:23592331|pubmed:23614034|pubmed:23648333|pubmed:23791346|pubmed:23831729|pubmed:23890965|pubmed:23927454|pubmed:24079913|pubmed:25179274|pubmed:28236114|pubmed:28339349|pubmed:28632490|pubmed:28741979|pubmed:29030459|pubmed:29067681|pubmed:29100157|pubmed:29109308|pubmed:29111213|pubmed:29111444|pubmed:29131715|pubmed:29150338|pubmed:29154092|pubmed:29172042|pubmed:29175687|pubmed:29197580|pubmed:29205483|pubmed:29214481|pubmed:29232866|pubmed:29277667|pubmed:29332277|pubmed:29340711|pubmed:29348637|reaxys:2057142|wikipedia.en:Triclosan Graph 2,4,4'-Trichloro-2'-hydroxydiphenyl ether|5-Chloro-2-(2,4-dichloro-phenoxy)-phenol|5-chloro-2-(2,4-dichlorophenoxy)phenol|Triclosan|triclosan|triclosanum 5-chloro-2-(2,4-dichlorophenoxy)phenol 2,4,4'-Trichloro-2'-hydroxydiphenyl ether|5-Chloro-2-(2,4-dichloro-phenoxy)-phenol|5-chloro-2-(2,4-dichlorophenoxy)phenol|Triclosan|triclosan|triclosanum http://purl.obolibrary.org/obo/CHEBI_164200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16421 biolink:ChemicalEntity 1-deoxy-D-altro-heptulose 7-phosphate kegg.compound:C04359 Graph 1-Deoxy-D-altro-heptulose 7-phosphate|1-deoxy-7-O-phosphono-D-altro-hept-2-ulose|1-deoxy-D-altro-heptulose 7-(dihydrogen phosphate)|1-deoxy-D-altro-heptulose 7-phosphate 1-Deoxy-D-altro-heptulose 7-phosphate|1-deoxy-D-altro-heptulose 7-(dihydrogen phosphate)|1-deoxy-D-altro-heptulose 7-phosphate 1-Deoxy-D-altro-heptulose 7-phosphate|1-deoxy-7-O-phosphono-D-altro-hept-2-ulose|1-deoxy-D-altro-heptulose 7-(dihydrogen phosphate)|1-deoxy-D-altro-heptulose 7-phosphate http://purl.obolibrary.org/obo/CHEBI_16421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16422 biolink:ChemicalEntity androst-4-ene-3,17-dione A 3-oxo Δ4-steroid that is androst-4-ene substituted by oxo groups at positions 3 and 17. It is a steroid hormone synthesized in the adrenal glands and gonads. cas:63-05-8|drugbank:DB01536|drugcentral:215|gmelin:961672|hmdb:HMDB0000053|kegg.compound:C00280|kegg.drug:D00051|knapsack:C00003644|lipidmaps:LMST02020007|metacyc.compound:ANDROST4ENE|pdb-ccd:ASD|pubmed:24423344|pubmed:24740546|reaxys:2059239|wikipedia.en:Androstenedione Graph 4-ANDROSTENE-3-17-DIONE|4-Androstene-3,17-dione|Androst-4-ene-3,17-dione|Androstenedione|Delta(4)-androsten-3,17-dione|Delta(4)-androstene-3,17-dione|androst-4-ene-3,17-dione Androst-4-ene-3,17-dione|androst-4-ene-3,17-dione 4-ANDROSTENE-3-17-DIONE|4-Androstene-3,17-dione|Androst-4-ene-3,17-dione|Androstenedione|Delta(4)-androsten-3,17-dione|Delta(4)-androstene-3,17-dione|androst-4-ene-3,17-dione http://purl.obolibrary.org/obo/CHEBI_16422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16423 biolink:ChemicalEntity (9Z)-octadec-9-en-12-ynoic acid An octadecenynoic acid having a cis-double bond at C-9 and a triple bond at position 12. cas:2277-31-8|kegg.compound:C07289|knapsack:C00001278|lipidmaps:LMFA01030742|pubmed:17329262|pubmed:17805875|pubmed:2822134|pubmed:4086624|pubmed:4676643|pubmed:5028298|reaxys:1911942 Graph (9Z)-octadec-9-en-12-ynoic acid|(Z)-9-Octadecen-12-ynoic acid|(Z)-octadec-9-en-12-ynoic acid|9c12a-18:2|Crepenynic acid|Crepenynsaeure|cis-9-Octadecen-12-ynoic acid|cis-Octadec-9-en-12-in-1-saeure (9Z)-octadec-9-en-12-ynoic acid (9Z)-octadec-9-en-12-ynoic acid|(Z)-9-Octadecen-12-ynoic acid|(Z)-octadec-9-en-12-ynoic acid|9c12a-18:2|Crepenynic acid|Crepenynsaeure|cis-9-Octadecen-12-ynoic acid|cis-Octadec-9-en-12-in-1-saeure http://purl.obolibrary.org/obo/CHEBI_16423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16424 biolink:ChemicalEntity phenylacetaldehyde An aldehyde that consists of acetaldehyde bearing a methyl substituent; the parent member of the phenylacetaldehyde class of compounds. cas:122-78-1|drugbank:DB02178|hmdb:HMDB0006236|kegg.compound:C00601|knapsack:C00007535|metacyc.compound:PHENYLACETALDEHYDE|pdb-ccd:HY1|pubmed:14698165|pubmed:16557466|pubmed:18954073|pubmed:21495722|pubmed:21627324|reaxys:385791|umbbd.compound:c0210|wikipedia.en:Phenylacetaldehyde Graph 1-Oxo-2-phenylethane|2-Phenylethanal|2-phenylacetaldehyde|Benzacetaldehyde|Benzeneacetaldehyde|Hyacinthin|PHENYLACETALDEHYDE|Phenacetaldehyde|Phenylacetaldehyde|Phenylacetic aldehyde|alpha-Tolualdehyde|alpha-phenylacetaldehyde|alpha-tolualdehyde|alpha-toluic aldehyde|phenylacetaldehyde PHENYLACETALDEHYDE|Phenylacetaldehyde|phenylacetaldehyde 1-Oxo-2-phenylethane|2-Phenylethanal|2-phenylacetaldehyde|Benzacetaldehyde|Benzeneacetaldehyde|Hyacinthin|PHENYLACETALDEHYDE|Phenacetaldehyde|Phenylacetaldehyde|Phenylacetic aldehyde|alpha-Tolualdehyde|alpha-phenylacetaldehyde|alpha-tolualdehyde|alpha-toluic aldehyde|phenylacetaldehyde http://purl.obolibrary.org/obo/CHEBI_16424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16425 biolink:ChemicalEntity 16-epivellosimine An indole alkaloid that is vellosimine in which the carbon bearing the aldehyde function has been epimerised. kegg.compound:C11633|metacyc.compound:16-EPIVELLOSIMINE|pdb-ccd:EVS|pubmed:17404987|pubmed:20392128|reaxys:6894765 Graph 16-Epivellosimine|16-episarpagan-17-al|16-epivellosimine 16-episarpagan-17-al 16-Epivellosimine|16-episarpagan-17-al|16-epivellosimine http://purl.obolibrary.org/obo/CHEBI_16425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16426 biolink:ChemicalEntity 3-(imidazol-4-yl)-2-oxopropyl dihydrogen phosphate kegg.compound:C01267|knapsack:C00007308 Graph 3-(1H-imidazol-4-yl)-2-oxopropyl dihydrogen phosphate|3-(Imidazol-4-yl)-2-oxopropyl phosphate|Imidazole-acetol phosphate 3-(1H-imidazol-4-yl)-2-oxopropyl dihydrogen phosphate 3-(1H-imidazol-4-yl)-2-oxopropyl dihydrogen phosphate|3-(Imidazol-4-yl)-2-oxopropyl phosphate|Imidazole-acetol phosphate http://purl.obolibrary.org/obo/CHEBI_16426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16427 biolink:ChemicalEntity mono(glucosyluronic acid)bilirubin cas:27071-67-6|kegg.compound:C03374 Graph 1-O-{3-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-dien-12-yl]propanoyl}-beta-D-glucopyranuronic acid|Bilirubin glucuronate|Bilirubin glucuronide|Bilirubin monoglucuronide|Bilirubin-glucuronoside 1-O-{3-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-dien-12-yl]propanoyl}-beta-D-glucopyranuronic acid 1-O-{3-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-dien-12-yl]propanoyl}-beta-D-glucopyranuronic acid|Bilirubin glucuronate|Bilirubin glucuronide|Bilirubin monoglucuronide|Bilirubin-glucuronoside http://purl.obolibrary.org/obo/CHEBI_16427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16428 biolink:ChemicalEntity 4-coumaroylshikimic acid kegg.compound:C02947 Graph (3R,4R,5R)-3,4-dihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohex-1-ene-1-carboxylic acid|4-Coumaroylshikimate|trans-5-O-(4-Coumaroyl)shikimate|trans-5-O-(4-coumaroyl)shikimate (3R,4R,5R)-3,4-dihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohex-1-ene-1-carboxylic acid (3R,4R,5R)-3,4-dihydroxy-5-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyloxy]cyclohex-1-ene-1-carboxylic acid|4-Coumaroylshikimate|trans-5-O-(4-Coumaroyl)shikimate|trans-5-O-(4-coumaroyl)shikimate http://purl.obolibrary.org/obo/CHEBI_16428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16430 biolink:ChemicalEntity precorrin-4 The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which four methyl groups have been introduced at positions 2, 7, 17 and 20 of the tetrapyrrole framework, together with ring contraction of the framework forming a bond between C-1 and C-19, leaving C-20 as part of an acetyl group bonded to C-1. beilstein:7070412|kegg.compound:C06407 Graph 3,3',3'',3'''-[(2S,3S,7S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|3-[(2S,3S,7S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 4 3,3',3'',3'''-[(2S,3S,7S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[(2S,3S,7S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|3-[(2S,3S,7S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,17-trimethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 4 http://purl.obolibrary.org/obo/CHEBI_16430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16431 biolink:ChemicalEntity limonene 1,2-epoxide An epoxide resulting from the formal epoxidation of the cyclic double bond of limonene. cas:1195-92-2|hmdb:HMDB0035158|pubmed:21925621|reaxys:111814 Graph 1,2-epoxy-p-menth-8-ene|1,2-epoxylimonene|1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane|4-isopropenyl-1-methyl-7-oxabicyclo[4.1.0]heptane|limonene 1,2-epoxide|limonene 1,2-oxide 1,2-epoxy-p-menth-8-ene|1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane 1,2-epoxy-p-menth-8-ene|1,2-epoxylimonene|1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane|4-isopropenyl-1-methyl-7-oxabicyclo[4.1.0]heptane|limonene 1,2-epoxide|limonene 1,2-oxide http://purl.obolibrary.org/obo/CHEBI_16431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16433 biolink:ChemicalEntity trans-caffeic acid The trans-isomer of caffeic acid. cas:331-39-5|cas:501-16-6|hmdb:HMDB0001964|kegg.compound:C01197|kegg.compound:C01481|knapsack:C00000615|pdb-ccd:DHC|pubmed:21503726|reaxys:1954563|wikipedia.en:Caffeic_acid Graph (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid|3,4-Dihydroxy-trans-cinnamate|3,4-Dihydroxycinnamic acid|3,4-dihydroxy-trans-cinnamate|CAFFEIC ACID|Caffeic acid|trans-Caffeate|trans-caffeate (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid|3,4-Dihydroxy-trans-cinnamate|3,4-Dihydroxycinnamic acid|3,4-dihydroxy-trans-cinnamate|CAFFEIC ACID|Caffeic acid|trans-Caffeate|trans-caffeate http://purl.obolibrary.org/obo/CHEBI_16433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16434 biolink:ChemicalEntity N-hydroxy-4-acetylaminobiphenyl A hydroxamic acid that is biphenyl-4-amine bearing N-hydroxy and N-acetyl substituents. beilstein:2807692|cas:4463-22-3|kegg.compound:C04081|pubmed:11473382|pubmed:4987694|pubmed:6644748|pubmed:6765899|pubmed:9586769|reaxys:2807692 Graph N-(4-biphenylyl)acetohydroxamic acid|N-([1,1'-biphenyl]-4-yl)-N-hydroxyacetamide|N-4-Biphenylylacetohydroxamic acid|N-Acetyl-4-biphenylhydroxylamine|N-Hydroxy-4-acetamidobiphenyl|N-Hydroxy-4-acetamidodiphenyl|N-Hydroxy-4-acetylaminobiphenyl|N-Hydroxy-N-4-biphenylacetamide|N-hydroxy-4-acetylaminobiphenyl N-([1,1'-biphenyl]-4-yl)-N-hydroxyacetamide N-(4-biphenylyl)acetohydroxamic acid|N-([1,1'-biphenyl]-4-yl)-N-hydroxyacetamide|N-4-Biphenylylacetohydroxamic acid|N-Acetyl-4-biphenylhydroxylamine|N-Hydroxy-4-acetamidobiphenyl|N-Hydroxy-4-acetamidodiphenyl|N-Hydroxy-4-acetylaminobiphenyl|N-Hydroxy-N-4-biphenylacetamide|N-hydroxy-4-acetylaminobiphenyl http://purl.obolibrary.org/obo/CHEBI_16434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16435 biolink:ChemicalEntity UDP-N-acetyl-3-O-(1-carboxyvinyl)-D-glucosamine A UDP-amino sugar having N-acetyl-3-O-(1-carboxyvinyl)-D-glucosamine as the sugar component. Graph UDP-N-acetylglucosamine enol-pyruvic acid|uridine 5'-{3-[2-acetamido-3-O-(1-carboxyethenyl)-2-deoxy-D-glucopyranosyl] dihydrogen diphosphate} uridine 5'-{3-[2-acetamido-3-O-(1-carboxyethenyl)-2-deoxy-D-glucopyranosyl] dihydrogen diphosphate} UDP-N-acetylglucosamine enol-pyruvic acid|uridine 5'-{3-[2-acetamido-3-O-(1-carboxyethenyl)-2-deoxy-D-glucopyranosyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_16435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16436 biolink:ChemicalEntity CDP-choline A member of the class of phosphocholines that is the choline ester of CDP. It is an intermediate obtained in the biosynthetic pathway of structural phospholipids in cell membranes. cas:987-78-0|drugbank:DB04290|drugcentral:664|hmdb:HMDB0001413|kegg.compound:C00307|kegg.drug:D00057|knapsack:C00007231|pdb-ccd:CDC|pubmed:10701532|pubmed:10796523|pubmed:36524681|pubmed:37196134|pubmed:37449595|pubmed:38478324|pubmed:38479101|pubmed:38484849|pubmed:38760804|pubmed:38776883|pubmed:8709678|reaxys:4170138|wikipedia.en:Citicoline Graph 5'-O-[hydroxy({[2-(trimethylammonio)ethoxy]phosphinato}oxy)phosphoryl]cytidine|CDP-colina|Citicoline|Cytidindiphosphocholin|Cytidine 5'-diphosphocholine|[2-CYTIDYLATE-O'-PHOSPHONYLOXYL]-ETHYL-TRIMETHYL-AMMONIUM|citicolina|citicolinum|citidin difosfato de colina|cyticholine|cytidine 5'-(choline diphosphate)|cytidine 5'-(cholinyl pyrophosphate)|cytidine 5'-diphosphoric choline 5'-O-[hydroxy({[2-(trimethylammonio)ethoxy]phosphinato}oxy)phosphoryl]cytidine 5'-O-[hydroxy({[2-(trimethylammonio)ethoxy]phosphinato}oxy)phosphoryl]cytidine|CDP-colina|Citicoline|Cytidindiphosphocholin|Cytidine 5'-diphosphocholine|[2-CYTIDYLATE-O'-PHOSPHONYLOXYL]-ETHYL-TRIMETHYL-AMMONIUM|citicolina|citicolinum|citidin difosfato de colina|cyticholine|cytidine 5'-(choline diphosphate)|cytidine 5'-(cholinyl pyrophosphate)|cytidine 5'-diphosphoric choline http://purl.obolibrary.org/obo/CHEBI_16436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16437 biolink:ChemicalEntity N-acetyl-L-histidine A histidine derivative that is L-histidine having an acetyl substituent on the α-nitrogen. cas:2497-02-1|hmdb:HMDB0032055|kegg.compound:C02997|metacyc.compound:CPD-424|pubmed:26800898|pubmed:5949241|pubmed:7357028|pubmed:9084403|pubmed:9770642|reaxys:748618 Graph N(2)-acetyl-L-histidine|N-Acetyl-L-histidine|N-Acetylhistidine|N-Hydroxy-aabp|N-acetyl histidine|N-alpha-L-histidine N(2)-acetyl-L-histidine N(2)-acetyl-L-histidine|N-Acetyl-L-histidine|N-Acetylhistidine|N-Hydroxy-aabp|N-acetyl histidine|N-alpha-L-histidine http://purl.obolibrary.org/obo/CHEBI_16437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16439 biolink:ChemicalEntity N-(carboxymethyl)-D-alanine A derivative of D-alanine having a carboxymethyl substituent on the α-nitrogen. kegg.compound:C03790 Graph N-(Carboxymethyl)-D-alanine|N-(carboxymethyl)-D-alanine|Strombine N-(Carboxymethyl)-D-alanine|N-(carboxymethyl)-D-alanine N-(Carboxymethyl)-D-alanine|N-(carboxymethyl)-D-alanine|Strombine http://purl.obolibrary.org/obo/CHEBI_16439 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16440 biolink:ChemicalEntity N-methyl-L-glutamic acid A N-methyl-L-α-amino acid with L-glutamic acid as the amino acid component. cas:35989-16-3|kegg.compound:C01046|pubmed:5905132|reaxys:2357675|wikipedia.en:N-Methyl-L-glutamic_acid Graph (2S)-2-(methylamino)pentanedioic acid|N-Methyl-L-glutamic acid|N-methyl-L-glutamic acid|N-methylglutamic acid N-Methyl-L-glutamic acid|N-methyl-L-glutamic acid (2S)-2-(methylamino)pentanedioic acid|N-Methyl-L-glutamic acid|N-methyl-L-glutamic acid|N-methylglutamic acid http://purl.obolibrary.org/obo/CHEBI_16440 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16441 biolink:ChemicalEntity linamarin cas:554-35-8|kegg.compound:C01594|knapsack:C00001446 Graph 1-cyano-1-methylethyl beta-D-glucoside|2-(beta-D-glucopyranosyloxy)-2-methylpropanenitrile|Linamarin|Phaseolunatin|linamarin 2-(beta-D-glucopyranosyloxy)-2-methylpropanenitrile 1-cyano-1-methylethyl beta-D-glucoside|2-(beta-D-glucopyranosyloxy)-2-methylpropanenitrile|Linamarin|Phaseolunatin|linamarin http://purl.obolibrary.org/obo/CHEBI_16441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16443 biolink:ChemicalEntity D-tagatose The D-enantiomer of tagatose. hmdb:HMDB0003418|pubmed:17492284|pubmed:24419630|pubmed:24979201|pubmed:9465271|reaxys:1724555 Graph D-Tag|D-lyxo-hex-2-ulose|D-tagatose D-lyxo-hex-2-ulose|D-tagatose D-Tag|D-lyxo-hex-2-ulose|D-tagatose http://purl.obolibrary.org/obo/CHEBI_16443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16444 biolink:ChemicalEntity 2-acetyllactic acid A derivative of butyric acid having methyl, hydroxy and oxo substituents at the 2-, 2- and 3-positions respectively. kegg.compound:C00900|knapsack:C00019658 Graph 2-Acetolactate|2-hydroxy-2-methyl-3-oxobutanoic acid 2-hydroxy-2-methyl-3-oxobutanoic acid 2-Acetolactate|2-hydroxy-2-methyl-3-oxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_16444 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16445 biolink:ChemicalEntity stipitatonic acid cas:606-39-3|kegg.compound:C02080 Graph 3,6-dihydroxy-5-oxo-1,3,6-cycloheptatriene-1,2-dicarboxylic anhydride|3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1,2-dicarboxylic anhydride|4,7-dihydroxy-1H-cyclohepta[c]furan-1,3,6-trione|Stipitatonate|stipitatonic acid 4,7-dihydroxy-1H-cyclohepta[c]furan-1,3,6-trione 3,6-dihydroxy-5-oxo-1,3,6-cycloheptatriene-1,2-dicarboxylic anhydride|3,6-dihydroxy-5-oxocyclohepta-1,3,6-triene-1,2-dicarboxylic anhydride|4,7-dihydroxy-1H-cyclohepta[c]furan-1,3,6-trione|Stipitatonate|stipitatonic acid http://purl.obolibrary.org/obo/CHEBI_16445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16446 biolink:ChemicalEntity N-acetyl-alpha-D-glucosamine 1-phosphate A 2-acetamido-2-deoxy-D-glucopyranose 1-phosphate having α-configuration at the anomeric centre. beilstein:39843|hmdb:HMDB0001367|kegg.compound:C04501|pdb-ccd:GN1|pubmed:12626405|pubmed:18048019|reaxys:39843 Graph 1-(N-acetyl-alpha-D-glucosamine) phosphate|2-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE|2-N-acetylglucosamine 1-phosphate|2-acetamido-2-deoxy-1-O-phosphono-alpha-D-glucopyranose|2-acetamido-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate)|GlcNAc1alpha-phosphate|N-Acetyl-alpha-D-glucosamine 1-phosphate|N-acetyl-alpha-D-glucosamine 1-(dihydrogen phosphate)|N-acetyl-alpha-D-glucosamine 1-phosphate|N-acetylglucosamine-1-phosphate|alpha-GlcNAc-(1->O)PO3H2|alpha-GlcNAc-1-P 2-acetamido-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate) 1-(N-acetyl-alpha-D-glucosamine) phosphate|2-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE|2-N-acetylglucosamine 1-phosphate|2-acetamido-2-deoxy-1-O-phosphono-alpha-D-glucopyranose|2-acetamido-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate)|GlcNAc1alpha-phosphate|N-Acetyl-alpha-D-glucosamine 1-phosphate|N-acetyl-alpha-D-glucosamine 1-(dihydrogen phosphate)|N-acetyl-alpha-D-glucosamine 1-phosphate|N-acetylglucosamine-1-phosphate|alpha-GlcNAc-(1->O)PO3H2|alpha-GlcNAc-1-P http://purl.obolibrary.org/obo/CHEBI_16446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16449 biolink:ChemicalEntity alanine An α-amino acid that consists of propionic acid bearing an amino substituent at position 2. cas:302-72-7|drugcentral:4306|gmelin:2449|kegg.compound:C01401|pubmed:17439666|pubmed:22264337|reaxys:635807|wikipedia.en:Alanine Graph 2-Aminopropanoic acid|2-Aminopropionic acid|2-aminopropanoic acid|A|ALA|Alanin|Alanine|alanina|alanine 2-Aminopropanoic acid|2-aminopropanoic acid|Alanine|alanine 2-Aminopropanoic acid|2-Aminopropionic acid|2-aminopropanoic acid|A|ALA|Alanin|Alanine|alanina|alanine http://purl.obolibrary.org/obo/CHEBI_16449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16450 biolink:ChemicalEntity 2'-deoxyuridine A pyrimidine 2'-deoxyribonucleoside having uracil as the nucleobase. cas:951-78-0|drugbank:DB02256|hmdb:HMDB0000012|kegg.compound:C00526|knapsack:C00019697|metacyc.compound:DEOXYURIDINE|pdb-ccd:DUR|pubmed:24463401|reaxys:24433|wikipedia.en:Deoxyuridine Graph 1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil|2'-Deoxyuridine|2'-deoxyuridine|2-Deoxyuridine|Deoxyuridine|dU 1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil 1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil|2'-Deoxyuridine|2'-deoxyuridine|2-Deoxyuridine|Deoxyuridine|dU http://purl.obolibrary.org/obo/CHEBI_16450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16452 biolink:ChemicalEntity oxaloacetate(2-) A C4-dicarboxylate resuting from deprotonation of both carboxy groups of oxaloacetic acid. cas:149-63-3|gmelin:1242579|kegg.compound:C00036|metacyc.compound:OXALACETIC_ACID|pubmed:19793063|pubmed:21098488|pubmed:21175886|pubmed:21178163|pubmed:21185899|pubmed:21434608|pubmed:21495723|pubmed:21745184|reaxys:3605372 Graph 2-oxobutanedioate|oxalacetate|oxaloacetate|oxaloacetate dianion|oxobutanedioate|oxobutanedioic acid, ion(2-)|oxosuccinate 2-oxobutanedioate 2-oxobutanedioate|oxalacetate|oxaloacetate|oxaloacetate dianion|oxobutanedioate|oxobutanedioic acid, ion(2-)|oxosuccinate http://purl.obolibrary.org/obo/CHEBI_16452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16453 biolink:ChemicalEntity 1,4,5,6-tetrahydro-6-oxonicotinic acid beilstein:472164|cas:5155-13-5|kegg.compound:C04226 Graph 1,4,5,6-Tetrahydro-6-oxonicotinate|1,4,5,6-Tetrahydro-6-oxonicotinic acid|6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylic acid 6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylic acid 1,4,5,6-Tetrahydro-6-oxonicotinate|1,4,5,6-Tetrahydro-6-oxonicotinic acid|6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16454 biolink:ChemicalEntity pantothenate A monocarboxylic acid anion that is the conjugate base of pantothenic acid, obtained by deprotonation of the carboxy group. pubmed:21463532 Graph 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate|N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-beta-alaninate|pantothenate 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate|N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-beta-alaninate|pantothenate http://purl.obolibrary.org/obo/CHEBI_16454 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16455 biolink:ChemicalEntity 4,4-dimethyl-5alpha-cholest-7-en-3beta-ol A cholestanoid that is 5α-cholest-7-ene substituted by a β-hydroxy group at position 3 and two methyl groups at position 4. kegg.compound:C04530 Graph 4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol|4,4-dimethyl-5-alpha-cholest-7-en-3-beta-ol|4,4-dimethyl-5alpha-cholest-7-en-3beta-ol 4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol|4,4-dimethyl-5alpha-cholest-7-en-3beta-ol 4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol|4,4-dimethyl-5-alpha-cholest-7-en-3-beta-ol|4,4-dimethyl-5alpha-cholest-7-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_16455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16457 biolink:ChemicalEntity S,S-dimethyl-beta-propiothetin A sulfonium betaine obtained by deprotonation of the carboxy group of 3-dimethylsulfoniopropionic acid. cas:7314-30-9|cba:374871|kegg.compound:C04022|knapsack:C00001355|metacyc.compound:SS-DIMETHYL-BETA-PROPIOTHETIN|pubmed:10889264|pubmed:12223879|pubmed:1295491|pubmed:13901535|pubmed:14004329|pubmed:16349544|pubmed:18914096|pubmed:1919809|pubmed:2090842|pubmed:5961650|pubmed:7659747|pubmed:8029347|pubmed:8990271|pubmed:9449841|pubmed:9576797|reaxys:3934014 Graph 3-(dimethylsulfonio)propanoate|3-dimethylsulfoniopropionate|DMPT|DMSP|Dimethylpropiothetin|Dimethylsulfoniopropionate|S,S-Dimethyl-beta-propiothetin|S,S-dimethyl-beta-propiothetin|S-Dimethylsulfonium propionic acid|beta-dimethylsulfoniopropionate|dimethyl-beta-propiothetin 3-(dimethylsulfonio)propanoate 3-(dimethylsulfonio)propanoate|3-dimethylsulfoniopropionate|DMPT|DMSP|Dimethylpropiothetin|Dimethylsulfoniopropionate|S,S-Dimethyl-beta-propiothetin|S,S-dimethyl-beta-propiothetin|S-Dimethylsulfonium propionic acid|beta-dimethylsulfoniopropionate|dimethyl-beta-propiothetin http://purl.obolibrary.org/obo/CHEBI_16457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16458 biolink:ChemicalEntity triacetate lactone cas:675-10-5|kegg.compound:C02752 Graph 4-Hydroxy-6-methyl-2-pyrone|4-hydroxy-6-methyl-2-pyrone|4-hydroxy-6-methyl-2H-pyran-2-one|Triacetate lactone|triacetate lactone 4-hydroxy-6-methyl-2H-pyran-2-one 4-Hydroxy-6-methyl-2-pyrone|4-hydroxy-6-methyl-2-pyrone|4-hydroxy-6-methyl-2H-pyran-2-one|Triacetate lactone|triacetate lactone http://purl.obolibrary.org/obo/CHEBI_16458 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16459 biolink:ChemicalEntity pentanamide A monocarboxylic acid amide obtained by the formal condensation of valeric acid with ammonia. cas:626-97-1|kegg.compound:C01842|lipidmaps:LMFA08010002|metacyc.compound:CPD-586|pubmed:24938779|reaxys:1740792 Graph Pentanamide|Valeramide|n-valeramide|pentanamide Pentanamide|pentanamide Pentanamide|Valeramide|n-valeramide|pentanamide http://purl.obolibrary.org/obo/CHEBI_16459 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16460 biolink:ChemicalEntity polyprenol phosphate A prenol phosphate resulting from the formal condensation of the terminal allylic hydroxy group of a polyprenol with 1 mol eq. of phosphoric acid. kegg.compound:C01048 Graph Polyprenyl phosphate|polyprenol phosphates Polyprenyl phosphate|polyprenol phosphates http://purl.obolibrary.org/obo/CHEBI_16460 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16461 biolink:ChemicalEntity tauropine A derivative of L-alanine having a 2-sulfoethyl group attached to the α-nitrogen. cas:33497-79-9|kegg.compound:C01616 Graph N(2)-(D-1-carboxyethyl)-2-aminoethanesulfonate|N-(1-carboxyethyl)taurine|N-(2-sulfoethyl)-D-alanine|N2-(D-1-Carboxyethyl)taurine|Tauropine|rhodoic acid N-(2-sulfoethyl)-D-alanine N(2)-(D-1-carboxyethyl)-2-aminoethanesulfonate|N-(1-carboxyethyl)taurine|N-(2-sulfoethyl)-D-alanine|N2-(D-1-Carboxyethyl)taurine|Tauropine|rhodoic acid http://purl.obolibrary.org/obo/CHEBI_16461 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16463 biolink:ChemicalEntity N-methylethanolamine phosphate The O-phospho derivative of N-methylethanolamine. kegg.compound:C01210 Graph 2-(methylamino)ethyl dihydrogen phosphate|N-Methylethanolamine phosphate 2-(methylamino)ethyl dihydrogen phosphate 2-(methylamino)ethyl dihydrogen phosphate|N-Methylethanolamine phosphate http://purl.obolibrary.org/obo/CHEBI_16463 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16464 biolink:ChemicalEntity salicyl alcohol A hydroxybenzyl alcohol that is phenol substituted by a hydroxymethyl group at C-2. cas:90-01-7|kegg.compound:C02323|kegg.drug:D05790|lincs.smallmolecule:LSM-20004|pdb-ccd:SA9|pubmed:22770225|pubmed:25010147|reaxys:1907195 Graph 2-(Hydroxymethyl)phenol|2-(hydroxymethyl)phenol|2-Hydroxybenzyl alcohol|Salicyl alcohol|Saligenin|salicyl alcohol 2-(Hydroxymethyl)phenol|2-(hydroxymethyl)phenol 2-(Hydroxymethyl)phenol|2-(hydroxymethyl)phenol|2-Hydroxybenzyl alcohol|Salicyl alcohol|Saligenin|salicyl alcohol http://purl.obolibrary.org/obo/CHEBI_16464 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16466 biolink:ChemicalEntity 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al A cholestanoid that is 5β-cholestan-26-al substituted by hydroxy groups at positions 3, 7 and 12 respectively. cas:3836-01-9|kegg.compound:C01301|lipidmaps:LMST04030164 Graph (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-al|3,7,12-trihydroxycholestan-26-al|3-alpha,7-alpha,12-alpha-trihydroxy-5-beta-cholestan-26-al|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-al|3,7,12-trihydroxycholestan-26-al|3-alpha,7-alpha,12-alpha-trihydroxy-5-beta-cholestan-26-al|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-al|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al http://purl.obolibrary.org/obo/CHEBI_16466 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16467 biolink:ChemicalEntity L-arginine An L-α-amino acid that is the L-isomer of arginine. cas:74-79-3|drugbank:DB00125|drugcentral:1549|ecmdb:ECMDB00517|gmelin:83283|hmdb:HMDB0000517|kegg.compound:C00062|kegg.drug:D02982|knapsack:C00001340|metacyc.compound:ARG|pdb-ccd:ARG|pdb-ccd:GND|pubmed:10848923|pubmed:11139824|pubmed:11300497|pubmed:11898853|pubmed:12812828|pubmed:15016745|pubmed:15465805|pubmed:16056256|pubmed:16416365|pubmed:17168727|pubmed:17439666|pubmed:19030957|pubmed:21600268|pubmed:21814794|pubmed:22179117|pubmed:22243793|pubmed:22251130|pubmed:22361732|pubmed:22425811|pubmed:22428068|pubmed:22439203|pubmed:22553931|pubmed:22619480|pubmed:22626826|pubmed:22652429|pubmed:22667467|pubmed:22709481|pubmed:8070089|reaxys:1725413|wikipedia.en:L-arginine|ymdb:YMDB00592 Graph (2S)-2-amino-5-(carbamimidamido)pentanoic acid|(2S)-2-amino-5-guanidinopentanoic acid|(S)-2-Amino-5-guanidinovaleric acid|(S)-2-amino-5-guanidinopentanoic acid|Arg|L-(+)-arginine|L-Arg|L-Arginin|L-Arginine|L-arginine|R|arginine L-Arginine|L-arginine (2S)-2-amino-5-(carbamimidamido)pentanoic acid|(2S)-2-amino-5-guanidinopentanoic acid|(S)-2-Amino-5-guanidinovaleric acid|(S)-2-amino-5-guanidinopentanoic acid|Arg|L-(+)-arginine|L-Arg|L-Arginin|L-Arginine|L-arginine|R|arginine http://purl.obolibrary.org/obo/CHEBI_16467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16468 biolink:ChemicalEntity maleylacetate A 4-oxohex-2-enedioate that is the conjugate base of maleylacetic acid. kegg.compound:C02222 Graph (2Z)-4-oxohex-2-enedioate|maleylacetate (2Z)-4-oxohex-2-enedioate (2Z)-4-oxohex-2-enedioate|maleylacetate http://purl.obolibrary.org/obo/CHEBI_16468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16469 biolink:ChemicalEntity 17beta-estradiol The 17β-isomer of estradiol. cas:50-28-2|chemspider:5554|drugbank:DB00783|drugcentral:1057|gmelin:290805|hmdb:HMDB0000151|kegg.compound:C00951|kegg.drug:D00105|lincs.smallmolecule:LSM-2421|lipidmaps:LMST02010001|pdb-ccd:EST|pubmed:10438974|pubmed:10585175|pubmed:10843196|pubmed:11703424|pubmed:14681337|pubmed:16313478|pubmed:17124377|pubmed:1777462|pubmed:23901460|pubmed:24134630|pubmed:24449492|pubmed:3621671|pubmed:8098802|pubmed:8567793|reaxys:1914275|wikipedia.en:Estradiol Graph (17beta)-estra-1,3,5(10)-triene-3,17-diol|17-beta-estradiol|17beta oestradiol|17beta-estra-1,3,5(10)-triene-3,17-diol|17beta-estradiol|17beta-oestradiol|ESTRADIOL|Estradiol|Estradiol-17beta|beta-Estradiol|cis-estradiol|estra-1,3,5(10)-triene-3,17beta-diol estra-1,3,5(10)-triene-3,17beta-diol (17beta)-estra-1,3,5(10)-triene-3,17-diol|17-beta-estradiol|17beta oestradiol|17beta-estra-1,3,5(10)-triene-3,17-diol|17beta-estradiol|17beta-oestradiol|ESTRADIOL|Estradiol|Estradiol-17beta|beta-Estradiol|cis-estradiol|estra-1,3,5(10)-triene-3,17beta-diol http://purl.obolibrary.org/obo/CHEBI_16469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16471 biolink:ChemicalEntity (dimethylsulfonio)acetate beilstein:1905971|cas:4727-41-7 Graph (dimethylsulfonio)acetate|dimethylsulfonioacetate|sulfobetaine (dimethylsulfonio)acetate (dimethylsulfonio)acetate|dimethylsulfonioacetate|sulfobetaine http://purl.obolibrary.org/obo/CHEBI_16471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16472 biolink:ChemicalEntity pentan-2-one A pentanone carrying an oxo substituent at position 2. agr:IND500714276|cas:107-87-9|hmdb:HMDB0034235|kegg.compound:C01949|lipidmaps:LMFA12000003|metacyc.compound:PENTAN-2-ONE|pdb-ccd:PNH|pubmed:22364569|reaxys:506058|wikipedia.en:Pentan-2-one Graph 2-Pentanone|2-pentanone|Methyl propyl ketone|Pentan-2-one|pentan-2-one Pentan-2-one|pentan-2-one 2-Pentanone|2-pentanone|Methyl propyl ketone|Pentan-2-one|pentan-2-one http://purl.obolibrary.org/obo/CHEBI_16472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16473 biolink:ChemicalEntity cortisol 21-sulfate A steroid sulfate obtained by the formal condensation of hydroxy group at position 21 of cortisol with sulfuric acid. cas:1253-43-6|kegg.compound:C02822|pubmed:2152866|pubmed:24392764|pubmed:5012753|pubmed:5857563|pubmed:8650705|reaxys:2404797 Graph (11beta)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione|11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulfate|11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate|Cortisol 21-sulfate|Cortisol-21-sulfate 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate (11beta)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione|11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulfate|11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate|Cortisol 21-sulfate|Cortisol-21-sulfate http://purl.obolibrary.org/obo/CHEBI_16473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16474 biolink:ChemicalEntity NADPH The reduced form of NADP+; used in anabolic reactions, such as lipid and nucleic acid synthesis, which require NADPH as a reducing agent. beilstein:77911|cas:53-57-6|ecmdb:ECMDB04111|hmdb:HMDB0000221|kegg.compound:C00005|knapsack:C00019545|pdb-ccd:NDP|pubmed:16884311|pubmed:17371809|pubmed:8627598|ymdb:YMDB00426 Graph 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|NADPH|NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE|Reduced nicotinamide adenine dinucleotide phosphate|TPNH|dihydronicotinamide-adenine dinucleotide phosphate|reduced nicotinamide-adenine dinucleotide phosphate 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate} 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|NADPH|NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE|Reduced nicotinamide adenine dinucleotide phosphate|TPNH|dihydronicotinamide-adenine dinucleotide phosphate|reduced nicotinamide-adenine dinucleotide phosphate http://purl.obolibrary.org/obo/CHEBI_16474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16479 biolink:ChemicalEntity streptomycin 6-phosphate kegg.compound:C01138 Graph Streptomycin 6-phosphate|[2-deoxy-2-(dimethylamino)-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5-trihydroxy-6-(phosphonooxy)cyclohexane-1,3-diyl]diguanidine} [2-deoxy-2-(dimethylamino)-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5-trihydroxy-6-(phosphonooxy)cyclohexane-1,3-diyl]diguanidine} Streptomycin 6-phosphate|[2-deoxy-2-(dimethylamino)-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5-trihydroxy-6-(phosphonooxy)cyclohexane-1,3-diyl]diguanidine} http://purl.obolibrary.org/obo/CHEBI_16479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16480 biolink:ChemicalEntity nitric oxide A nitrogen oxide which is a free radical, each molecule of which consists of one nitrogen and one oxygen atom. cas:10102-43-9|drugbank:DB00435|gmelin:451|kegg.compound:C00533|kegg.drug:D00074|molbase:943|pdb-ccd:NO|reaxys:3587257|wikipedia.en:Nitric_oxide Graph (.)NO|(NO)(.)|EDRF|NO|NO(.)|Nitric oxide|Nitrogen monoxide|Stickstoff(II)-oxid|Stickstoffmonoxid|[NO]|endothelium-derived relaxing factor|mononitrogen monoxide|monoxido de nitrogeno|monoxyde d'azote|nitric oxide|nitrogen monooxide|nitrogen monoxide|nitrosyl|oxido de nitrogeno(II)|oxido nitrico|oxidonitrogen(.)|oxoazanyl|oxyde azotique|oxyde nitrique oxidonitrogen(.)|oxoazanyl (.)NO|(NO)(.)|EDRF|NO|NO(.)|Nitric oxide|Nitrogen monoxide|Stickstoff(II)-oxid|Stickstoffmonoxid|[NO]|endothelium-derived relaxing factor|mononitrogen monoxide|monoxido de nitrogeno|monoxyde d'azote|nitric oxide|nitrogen monooxide|nitrogen monoxide|nitrosyl|oxido de nitrogeno(II)|oxido nitrico|oxidonitrogen(.)|oxoazanyl|oxyde azotique|oxyde nitrique http://purl.obolibrary.org/obo/CHEBI_16480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16481 biolink:ChemicalEntity N-(hydroxymethyl)urea A member of the class of ureas that is urea in which one of the amino hydrogens is replaced by a hydroxymethyl group. cas:1000-82-4|gmelin:693876|kegg.compound:C06384|patent:US3976465|patent:US4318729|patent:US4599102|reaxys:1743129 Graph (hydroxymethyl)urea|1-(hydroxymethyl)urea|N-(Hydroxymethyl)urea|N-(hydroxymethyl)urea|methylol urea|methylolurea|mono(hydroxymethyl)urea|monomethylolurea (hydroxymethyl)urea (hydroxymethyl)urea|1-(hydroxymethyl)urea|N-(Hydroxymethyl)urea|N-(hydroxymethyl)urea|methylol urea|methylolurea|mono(hydroxymethyl)urea|monomethylolurea http://purl.obolibrary.org/obo/CHEBI_16481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16482 biolink:ChemicalEntity naphthalene An aromatic hydrocarbon comprising two fused benzene rings. It occurs in the essential oils of numerous plant species e.g. magnolia. cas:91-20-3|gmelin:3347|hmdb:HMDB0029751|kegg.compound:C00829|knapsack:C00001259|metacyc.compound:NAPHTHALENE|pdb-ccd:NPY|ppdb:1312|pubmed:10814889|pubmed:11202734|pubmed:16220979|pubmed:16699520|pubmed:17850896|pubmed:26875834|pubmed:26895256|pubmed:27439360|reaxys:1421310|umbbd.compound:c0333|wikipedia.en:Naphthalene Graph NAPHTHALENE|Naphthalen|Naphthalene|Naphthalin|naftaleno|naftalina|naphtalene|naphtaline|naphthalene NAPHTHALENE|Naphthalene|naphthalene NAPHTHALENE|Naphthalen|Naphthalene|Naphthalin|naftaleno|naftalina|naphtalene|naphtaline|naphthalene http://purl.obolibrary.org/obo/CHEBI_16482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16483 biolink:ChemicalEntity isonocardicin A A nocardicin in which the β-lactam moiety is substituted at position 1 by a carboxy(4-hydroxyphenyl)methyl group and at position 3 by a [(2Z)-2-(hydroxyimino)-2-(4-hydroxyphenyl)acetyl]nitrilo group in which the phenolic hydroxy group is substituted by a (3S)-3-amino-3-carboxypropyl group. kegg.compound:C00927|pubmed:15252031|reaxys:5324091 Graph 1-azetidineacetic acid|O-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-L-homoserine|isonocardicin A O-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-L-homoserine 1-azetidineacetic acid|O-{4-[(1Z)-2-({(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-L-homoserine|isonocardicin A http://purl.obolibrary.org/obo/CHEBI_16483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16485 biolink:ChemicalEntity 18-hydroxycorticosterone A 18-hydroxy steroid that is corticosterone substituted by a hydroxy group at position 18. cas:561-65-9|hmdb:HMDB0000319|kegg.compound:C01124|lipidmaps:LMST02030091|metacyc.compound:18-HYDROXYCORTICOSTERONE|pubmed:12505784|pubmed:22238407|reaxys:5621578|wikipedia.en:18-Hydroxycorticosterone Graph 11beta,18,21-trihydroxypregn-4-ene-3,20-dione|18-Hydroxycorticosterone|18-hydroxycorticosterone 11beta,18,21-trihydroxypregn-4-ene-3,20-dione 11beta,18,21-trihydroxypregn-4-ene-3,20-dione|18-Hydroxycorticosterone|18-hydroxycorticosterone http://purl.obolibrary.org/obo/CHEBI_16485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16486 biolink:ChemicalEntity cyclopentanone A cyclic ketone that consists of cyclopentane bearing a single oxo substituent. cas:120-92-3|foodb.food:FDB003481|gmelin:82201|hmdb:HMDB0031407|kegg.compound:C00557|metacyc.compound:CYCLOPENTANONE|pubmed:21368407|pubmed:24404564|reaxys:605573|wikipedia.en:Cyclopentanone Graph Cyclopentanone|cyclopentanone|ketocyclopentane|ketopentamethylene|oxocyclopentane Cyclopentanone|cyclopentanone Cyclopentanone|cyclopentanone|ketocyclopentane|ketopentamethylene|oxocyclopentane http://purl.obolibrary.org/obo/CHEBI_16486 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16487 biolink:ChemicalEntity benzyl cetraxate The benzyl ester of cetraxate. beilstein:2789690|kegg.compound:C03256 Graph 4-(3-benzyloxy-3-oxopropyl)phenyl (1r,4r)-4-(aminomethyl)cyclohexanecarboxylate|Cetraxate benzyl ester 4-(3-benzyloxy-3-oxopropyl)phenyl (1r,4r)-4-(aminomethyl)cyclohexanecarboxylate 4-(3-benzyloxy-3-oxopropyl)phenyl (1r,4r)-4-(aminomethyl)cyclohexanecarboxylate|Cetraxate benzyl ester http://purl.obolibrary.org/obo/CHEBI_16487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16488 biolink:ChemicalEntity meso-2,6-diaminopimelic acid The meso-isomer of 2,6-diaminopimelic acid. It is a key constituent of bacterial peptidoglycan and is often found in human urine due to the breakdown of the gut microbes. cas:922-54-3|kegg.compound:C00680|knapsack:C00007595|pdb-ccd:API|pubmed:11262151|pubmed:20803494|pubmed:22339732|pubmed:23325104|reaxys:8218693|wikipedia.en:Diaminopimelic_acid Graph (2R*,6S*)-2,6-diaminoheptanedioic acid|meso-2,6-Diaminopimelic acid|meso-diaminoheptanedioic acid (2R*,6S*)-2,6-diaminoheptanedioic acid (2R*,6S*)-2,6-diaminoheptanedioic acid|meso-2,6-Diaminopimelic acid|meso-diaminoheptanedioic acid http://purl.obolibrary.org/obo/CHEBI_16488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16489 biolink:ChemicalEntity lumazine A 2,4-dihydroxypteridine. cas:487-21-8|kegg.compound:C03212|metacyc.compound:CPD-15309|pdb-ccd:LUZ|pubmed:12043000|pubmed:23501728|reaxys:610331 Graph 1H,3H-pteridine-2,4-dione|2,4(3H,8H)-Pteridinedione|2,4-Dihydroxypteridine|2,4-dihydroxypteridine|Lumazine|Pteridine-2,4-dione|pteridine-2,4-diol pteridine-2,4-diol 1H,3H-pteridine-2,4-dione|2,4(3H,8H)-Pteridinedione|2,4-Dihydroxypteridine|2,4-dihydroxypteridine|Lumazine|Pteridine-2,4-dione|pteridine-2,4-diol http://purl.obolibrary.org/obo/CHEBI_16489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16490 biolink:ChemicalEntity S-adenosyl-4-methylthio-2-oxobutanoate A sulfonium betaine that is the conjugate base of S-adenosyl-4-methylthio-2-oxobutanoic acid, arising from deprotonation of the carboxy group. beilstein:9665212|metacyc.compound:S-ADENOSYL-4-METHYLTHIO-2-OXOBUTANOATE|reaxys:9665212 Graph 4-[(5'-adenosyl)(methyl)sulfonio]-2-oxobutanoate|4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfaniumyl]-2-oxobutanoate|4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfonio]-2-oxobutanoate|4-[{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}(methyl)sulfonio]-2-oxobutanoate|S-adenosyl-4-methylsulfanyl-2-oxobutanoate|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl][(3S)-3-carboxylato-3-oxopropyl](methyl)sulfonium 4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfaniumyl]-2-oxobutanoate 4-[(5'-adenosyl)(methyl)sulfonio]-2-oxobutanoate|4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfaniumyl]-2-oxobutanoate|4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfonio]-2-oxobutanoate|4-[{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}(methyl)sulfonio]-2-oxobutanoate|S-adenosyl-4-methylsulfanyl-2-oxobutanoate|[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl][(3S)-3-carboxylato-3-oxopropyl](methyl)sulfonium http://purl.obolibrary.org/obo/CHEBI_16490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16492 biolink:ChemicalEntity nucleoside 3'-phosphate Graph nucleoside 3'-phosphates nucleoside 3'-phosphates http://purl.obolibrary.org/obo/CHEBI_16492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16493 biolink:ChemicalEntity 1-deoxy-D-xylulose 5-phosphate The 5-phospho derivative of 1-deoxy-D-xylulose. drugbank:DB02496|kegg.compound:C11437|knapsack:C00007292|pdb-ccd:DXP Graph (2R,3S)-2,3-dihydroxy-4-oxopentyl dihydrogen phosphate|1-Deoxy-D-xylulose 5-phosphate (2R,3S)-2,3-dihydroxy-4-oxopentyl dihydrogen phosphate|1-Deoxy-D-xylulose 5-phosphate (2R,3S)-2,3-dihydroxy-4-oxopentyl dihydrogen phosphate|1-Deoxy-D-xylulose 5-phosphate http://purl.obolibrary.org/obo/CHEBI_16493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16494 biolink:ChemicalEntity lipoic acid A heterocyclic thia fatty acid comprising pentanoic acid with a 1,2-dithiolan-3-yl group at the 5-position. beilstein:122410|cas:62-46-4|drugbank:DB00166|drugcentral:4732|ecmdb:ECMDB01451|gmelin:720915|kegg.compound:C00725|kegg.drug:D00086|pubmed:15328413|pubmed:7519986|pubmed:7548757|reaxys:81853|wikipedia.en:Lipoic_acid|ymdb:YMDB00334 Graph 1,2-dithiolane-3-pentanoic acid|1,2-dithiolane-3-valeric acid|5-(1,2-dithiolan-3-yl)pentanoic acid|5-(1,2-dithiolan-3-yl)valeric acid|5-(dithiolan-3-yl)valeric acid|5-[3-(1,2-dithiolanyl)]pentanoic acid|6,8-thioctic acid|6,8-thiotic acid|6-thioctic acid|6-thiotic acid|Acetate-replacing factor|Biletan|Lipoic acid|Thioctansaeure|Thioctic acid|Thioctsaeure|Thioktsaeure|alpha-Lipoic acid|alpha-Liponsaeure|alpha-lipoic acid|liponic acid 5-(1,2-dithiolan-3-yl)pentanoic acid 1,2-dithiolane-3-pentanoic acid|1,2-dithiolane-3-valeric acid|5-(1,2-dithiolan-3-yl)pentanoic acid|5-(1,2-dithiolan-3-yl)valeric acid|5-(dithiolan-3-yl)valeric acid|5-[3-(1,2-dithiolanyl)]pentanoic acid|6,8-thioctic acid|6,8-thiotic acid|6-thioctic acid|6-thiotic acid|Acetate-replacing factor|Biletan|Lipoic acid|Thioctansaeure|Thioctic acid|Thioctsaeure|Thioktsaeure|alpha-Lipoic acid|alpha-Liponsaeure|alpha-lipoic acid|liponic acid http://purl.obolibrary.org/obo/CHEBI_16494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16496 biolink:ChemicalEntity 5beta-cholestane-3alpha,7alpha,12alpha-triol cas:547-96-6|kegg.compound:C05454|lipidmaps:LMST04030035 Graph 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestane|3alpha,7alpha,12alpha-Trihydroxycoprostane|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestane|3alpha,7alpha,12alpha-trihydroxycoprostane|5-beta-cholestane-3-alpha,7-alpha,12-alpha-triol|5beta-Cholestane-3alpha,7alpha,12alpha-triol|5beta-cholestane-3alpha,7alpha,12alpha-triol 5beta-Cholestane-3alpha,7alpha,12alpha-triol|5beta-cholestane-3alpha,7alpha,12alpha-triol 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestane|3alpha,7alpha,12alpha-Trihydroxycoprostane|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestane|3alpha,7alpha,12alpha-trihydroxycoprostane|5-beta-cholestane-3-alpha,7-alpha,12-alpha-triol|5beta-Cholestane-3alpha,7alpha,12alpha-triol|5beta-cholestane-3alpha,7alpha,12alpha-triol http://purl.obolibrary.org/obo/CHEBI_16496 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16497 biolink:ChemicalEntity dGTP A purine 2'-deoxyribonucleoside 5'-triphosphate having guanine as the nucleobase. cas:2564-35-4|chemspider:58613|drugbank:DB02181|ecmdb:ECMDB01440|foodb.food:FDB022623|hmdb:HMDB0001440|kegg.compound:C00286|knapsack:C00019346|pdb-ccd:DGT|pubmed:11096070|pubmed:15708794|pubmed:17354649|pubmed:22844265|pubmed:24141705|pubmed:28373271|pubmed:31019074|pubmed:32402273|pubmed:33405358|pubmed:6783298|pubmed:7929110|reaxys:73481|wikipedia.en:Deoxyguanosine_triphosphate|ymdb:YMDB00744 Graph 2'-deoxy-GTP|2'-deoxyguanosine 5'-(tetrahydrogen triphosphate)|2'-deoxyguanosine 5'-triphosphate|2'-deoxyguanosine triphosphate|dGTP|deoxy-GTP|deoxyguanosine 5'-triphosphate|deoxyguanosine triphosphate 2'-deoxyguanosine 5'-(tetrahydrogen triphosphate) 2'-deoxy-GTP|2'-deoxyguanosine 5'-(tetrahydrogen triphosphate)|2'-deoxyguanosine 5'-triphosphate|2'-deoxyguanosine triphosphate|dGTP|deoxy-GTP|deoxyguanosine 5'-triphosphate|deoxyguanosine triphosphate http://purl.obolibrary.org/obo/CHEBI_16497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16498 biolink:ChemicalEntity N-acylneuraminic acid Any neuraminic acid carrying an N-acyl substituent. kegg.compound:C00591 Graph 5-alkanamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|N-Acylneuraminate|N-acylneuraminic acids 5-alkanamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid 5-alkanamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|N-Acylneuraminate|N-acylneuraminic acids http://purl.obolibrary.org/obo/CHEBI_16498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16500 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 5-phosphate A phosphatidylinositol 5-phosphate in which the inositol moiety has configuration 1D-myo. kegg.compound:C11557|pubmed:6095072 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-5'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 5-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 5-phosphate|PIP|PtdIns-5-P|PtdIns5P 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 5-(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-5'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 5-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 5-phosphate|PIP|PtdIns-5-P|PtdIns5P http://purl.obolibrary.org/obo/CHEBI_16500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16501 biolink:ChemicalEntity L-arabinonate Conjugate base of L-arabinonic acid. beilstein:5512976|cas:608-53-7|kegg.compound:C00545 Graph L-Arabinonate|L-arabinonate L-Arabinonate|L-arabinonate L-Arabinonate|L-arabinonate http://purl.obolibrary.org/obo/CHEBI_16501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16503 biolink:ChemicalEntity selane cas:7783-07-5|kegg.compound:C01528|umbbd.compound:c0745 Graph H2Se|Hydrogen selenide|[SeH2]|dihydridoselenium|dihydrogen selenide|hydrogen selenide|hydroselenic acid|selane Hydrogen selenide|dihydridoselenium|dihydrogen selenide|hydrogen selenide|selane H2Se|Hydrogen selenide|[SeH2]|dihydridoselenium|dihydrogen selenide|hydrogen selenide|hydroselenic acid|selane http://purl.obolibrary.org/obo/CHEBI_16503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16504 biolink:ChemicalEntity monodehydro-L-ascorbic acid kegg.compound:C01041 Graph Ascorbate radical|Monodehydroascorbate|Monodehydroascorbate radical|Semidehydroascorbic acid|[(2R)-2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-yl]oxidanyl [(2R)-2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-yl]oxidanyl Ascorbate radical|Monodehydroascorbate|Monodehydroascorbate radical|Semidehydroascorbic acid|[(2R)-2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2,5-dihydrofuran-3-yl]oxidanyl http://purl.obolibrary.org/obo/CHEBI_16504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16505 biolink:ChemicalEntity dihydrostreptomycin 6-phosphate The 6-O-phospho derivative of dihydrostreptomycin. cas:33014-54-9|kegg.compound:C01221 Graph (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-5-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyloxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate|Dihydrostreptomycin 6-phosphate|O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1-2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1-4)-N,N'-bis(aminoiminomethyl)-D-streptamine-6-(dihydrogen phosphate) (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-5-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyloxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-5-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyloxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate|Dihydrostreptomycin 6-phosphate|O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1-2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1-4)-N,N'-bis(aminoiminomethyl)-D-streptamine-6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16507 biolink:ChemicalEntity 1D-myo-inositol 1,2,4,5,6-pentakisphosphate A myo-inositol pentakisphosphate comprising 1D-myo-inositol having the five phosphate groups placed in the 1-' 2-' 4-, 5- and 6-positions. beilstein:10136263|beilstein:7792694|beilstein:9534448|cas:20298-95-7|kegg.compound:C04563 Graph 1D-myo-Inositol 1,2,4,5,6-pentakisphosphate|1D-myo-inositol 1,2,4,5,6-pentakis(dihydrogen phosphate)|D-myo-Inositol 1,2,4,5,6-pentakisphosphate|Inositol 1,2,4,5,6-pentakisphosphate|myo-Inositol 1,2,4,5,6-pentakisphosphate 1D-myo-inositol 1,2,4,5,6-pentakis(dihydrogen phosphate) 1D-myo-Inositol 1,2,4,5,6-pentakisphosphate|1D-myo-inositol 1,2,4,5,6-pentakis(dihydrogen phosphate)|D-myo-Inositol 1,2,4,5,6-pentakisphosphate|Inositol 1,2,4,5,6-pentakisphosphate|myo-Inositol 1,2,4,5,6-pentakisphosphate http://purl.obolibrary.org/obo/CHEBI_16507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16508 biolink:ChemicalEntity cis,cis-muconic acid The cis,cis-isomer of muconic acid. It is produced during the degradation of chlorobenzene by bacteria like Bacillus. beilstein:1722246|cas:1119-72-8|kegg.compound:C02480|knapsack:C00007490|pdb-ccd:CCU|pubmed:23720149|pubmed:24320235 Graph (2Z,4Z)-HEXA-2,4-DIENEDIOIC ACID|(2Z,4Z)-hexa-2,4-dienedioic acid|(Z,Z)-2,4-hexadienedioic acid|cis,cis-2,4-Hexadienedioic acid (2Z,4Z)-HEXA-2,4-DIENEDIOIC ACID|(2Z,4Z)-hexa-2,4-dienedioic acid (2Z,4Z)-HEXA-2,4-DIENEDIOIC ACID|(2Z,4Z)-hexa-2,4-dienedioic acid|(Z,Z)-2,4-hexadienedioic acid|cis,cis-2,4-Hexadienedioic acid http://purl.obolibrary.org/obo/CHEBI_16508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16509 biolink:ChemicalEntity 1,4-benzoquinone The simplest member of the class of 1,4-benzoquinones, obtained by the formal oxidation of hydroquinone to the corresponding diketone. It is a metabolite of benzene. cas:106-51-4|gmelin:2741|hmdb:HMDB0003364|kegg.compound:C00472|kegg.compound:C15602|metacyc.compound:P-BENZOQUINONE|pdb-ccd:PLQ|pubmed:10462055|pubmed:11304127|pubmed:1395635|pubmed:15182198|pubmed:15618234|pubmed:15920754|pubmed:16484134|pubmed:24023812|pubmed:25057895|pubmed:9118901|reaxys:773967|umbbd.compound:c0261|wikipedia.en:1,4-Benzoquinone Graph 1,4-Benzochinon|1,4-Benzoquinone|1,4-benzoquinone|2,5-Cyclohexadiene-1,4-dione|Quinone|benzo-1,4-quinone|benzoquinone|cyclohexa-2,5-diene-1,4-dione|p-Benzoquinone|p-Chinon|p-quinone|para-benzoquinone cyclohexa-2,5-diene-1,4-dione 1,4-Benzochinon|1,4-Benzoquinone|1,4-benzoquinone|2,5-Cyclohexadiene-1,4-dione|Quinone|benzo-1,4-quinone|benzoquinone|cyclohexa-2,5-diene-1,4-dione|p-Benzoquinone|p-Chinon|p-quinone|para-benzoquinone http://purl.obolibrary.org/obo/CHEBI_16509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16510 biolink:ChemicalEntity 3-hydroxypropionate A hydroxy monocarboxylic acid anion that is the conjugate base of 3-hydroxypropionic acid. gmelin:324424|kegg.compound:C01013|reaxys:3903725 Graph 3-Hydroxypropionate|3-hydroxypropanoate|beta-hydroxypropionate 3-hydroxypropanoate 3-Hydroxypropionate|3-hydroxypropanoate|beta-hydroxypropionate http://purl.obolibrary.org/obo/CHEBI_16510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16511 biolink:ChemicalEntity N-acetyl-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol A polyprenyl glycosyl diphosphate having N-acetyl-D-glucosamine as the glycosyl fragment. beilstein:1419042|kegg.compound:C01289 Graph 2-(acetylamino)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose|N-Acetyl-D-glucosaminyldiphosphoundecaprenol|N-acetyl-D-glucosaminyl undecaprenyl diphosphate 2-(acetylamino)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose 2-(acetylamino)-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-D-glucopyranose|N-Acetyl-D-glucosaminyldiphosphoundecaprenol|N-acetyl-D-glucosaminyl undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_16511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16512 biolink:ChemicalEntity (S)-N-methylcanadine A quaternary ammonium ion that is (S)-canadine bearing an N-methyl substituent. beilstein:4160644|kegg.compound:C02915|knapsack:C00026136|pubmed:12357384|reaxys:4160644 Graph (13aS)-9,10-dimethoxy-7-methyl-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium|(S)-N-Methylcanadine|(S)-N-methylcanadine (13aS)-9,10-dimethoxy-7-methyl-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium (13aS)-9,10-dimethoxy-7-methyl-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolinium|(S)-N-Methylcanadine|(S)-N-methylcanadine http://purl.obolibrary.org/obo/CHEBI_16512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16513 biolink:ChemicalEntity hydroxymalonic acid A dicarboxylic acid that is malonic acid substituted by a hydroxy group at position 2. cas:80-69-3|foodb.food:FDB013880|gmelin:82430|hmdb:HMDB0035227|kegg.compound:C02287|pubmed:13823333|pubmed:14039995|pubmed:14389236|pubmed:14793491|pubmed:14843105|pubmed:17889996|pubmed:20342048|pubmed:24135913|pubmed:30724285|pubmed:32781072|pubmed:3676421|pubmed:38647258|reaxys:1209791|wikipedia.en:Tartronic_acid Graph 2-hydroxymalonic acid|2-hydroxypropanedioic acid|2-tartronic acid|alpha-hydroxymalonic acid|hydroxymalonic acid|hydroxypropanedioic acid|tartronic acid hydroxypropanedioic acid 2-hydroxymalonic acid|2-hydroxypropanedioic acid|2-tartronic acid|alpha-hydroxymalonic acid|hydroxymalonic acid|hydroxypropanedioic acid|tartronic acid http://purl.obolibrary.org/obo/CHEBI_16513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16514 biolink:ChemicalEntity 4',5,7-trihydroxy-3'-methoxyflavone The 3'-O-methyl derivative of luteolin. cas:491-71-4|kegg.compound:C04293|knapsack:C00001029|lipidmaps:LMPK12110799|metacyc.compound:574-TRIHYDROXY-3-METHOXYFLAVONE|pubmed:22438130|pubmed:22577954|pubmed:23017389|pubmed:23052184|pubmed:23122135|reaxys:295004 Graph 3'-Methoxyapigenin|3'-O-Methylluteolin|5,7,4'-Trihydroxy-3'-methoxyflavone|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-benzopyrone|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one|Chryseriol|Chrysoeriol|Luteolin 3'-methyl ether 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one 3'-Methoxyapigenin|3'-O-Methylluteolin|5,7,4'-Trihydroxy-3'-methoxyflavone|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-benzopyrone|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one|Chryseriol|Chrysoeriol|Luteolin 3'-methyl ether http://purl.obolibrary.org/obo/CHEBI_16514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16515 biolink:ChemicalEntity 3-ADP-glyceric acid kegg.compound:C02509 Graph 3-(ADP)-glycerate|3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-hydroxypropanoic acid|adenosine 5'-[3-(2-carboxy-2-hydroxyethyl) dihydrogen diphosphate] 3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-hydroxypropanoic acid|adenosine 5'-[3-(2-carboxy-2-hydroxyethyl) dihydrogen diphosphate] 3-(ADP)-glycerate|3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-hydroxypropanoic acid|adenosine 5'-[3-(2-carboxy-2-hydroxyethyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16516 biolink:ChemicalEntity 2'-deoxyribonucleoside triphosphate kegg.compound:C04283 Graph 2'-Deoxyribonucleoside triphosphate|2'-deoxyribonucleoside triphosphates 2'-Deoxyribonucleoside triphosphate|2'-deoxyribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_16516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16517 biolink:ChemicalEntity cyclotriphosphoric acid The cyclic anhydride of triphosphoric acid. cas:13566-25-1|kegg.compound:C02466 Graph 1,3,5,2,4,6-trioxatriphosphinane-2,4,6-triol 2,4,6-trioxide|2,4,6-trihydroxido-2,4,6-trioxido-1,3,5-trioxy-2,4,6-triphosphy-[6]cycle|H3P3O9|Trimetaphosphate|cyclo-Triphosphoric acid|cyclo-triphosphoric acid|tri-mu-oxido-tris(hydroxidooxidophosphorus)|trimetaphosphoric acid 1,3,5,2,4,6-trioxatriphosphinane-2,4,6-triol 2,4,6-trioxide|2,4,6-trihydroxido-2,4,6-trioxido-1,3,5-trioxy-2,4,6-triphosphy-[6]cycle|tri-mu-oxido-tris(hydroxidooxidophosphorus) 1,3,5,2,4,6-trioxatriphosphinane-2,4,6-triol 2,4,6-trioxide|2,4,6-trihydroxido-2,4,6-trioxido-1,3,5-trioxy-2,4,6-triphosphy-[6]cycle|H3P3O9|Trimetaphosphate|cyclo-Triphosphoric acid|cyclo-triphosphoric acid|tri-mu-oxido-tris(hydroxidooxidophosphorus)|trimetaphosphoric acid http://purl.obolibrary.org/obo/CHEBI_16517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16518 biolink:ChemicalEntity ferrocytochrome b5 Graph Ferrocytochrome b5 Ferrocytochrome b5 http://purl.obolibrary.org/obo/CHEBI_16518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16520 biolink:ChemicalEntity R'C(R)SH Any organosulfur compound with structure R'C(R)SH in which R and R' can be =S or =O, or a variety of other groups. kegg.compound:C01525 Graph R'C(R)SH R'C(R)SH http://purl.obolibrary.org/obo/CHEBI_16520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16521 biolink:ChemicalEntity lanosterol A tetracyclic triterpenoid that is lanosta-8,24-diene substituted by a β-hydroxy group at the 3β position. It is the compound from which all steroids are derived. cas:79-63-0|drugbank:DB03696|hmdb:HMDB0001251|kegg.compound:C01724|knapsack:C00003657|lipidmaps:LMST01010017|metacyc.compound:LANOSTEROL|pdb-ccd:LAN|pubmed:14660793|pubmed:16445886|pubmed:21818119|pubmed:21838962|pubmed:22824432|pubmed:22933236|pubmed:22988818|pubmed:24525128|pubmed:26069216|pubmed:26200341|reaxys:2226449|wikipedia.en:Lanosterol Graph (3beta)-lanosta-8,24-dien-3-ol|(3beta,5alpha)-4,4,14-trimethylcholesta-8,24-dien-3-ol|4,4',14alpha-Trimethyl-5alpha-cholesta-8,24-dien-3beta-ol|LANOSTEROL|Lanosterin|Lanosterol|lanosta-8,24-dien-3beta-ol|lanosterol lanosta-8,24-dien-3beta-ol (3beta)-lanosta-8,24-dien-3-ol|(3beta,5alpha)-4,4,14-trimethylcholesta-8,24-dien-3-ol|4,4',14alpha-Trimethyl-5alpha-cholesta-8,24-dien-3beta-ol|LANOSTEROL|Lanosterin|Lanosterol|lanosta-8,24-dien-3beta-ol|lanosterol http://purl.obolibrary.org/obo/CHEBI_16521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16522 biolink:ChemicalEntity trans-zeatin The trans-isomer of zeatin. agr:IND605478333|bpdb:1629|cas:1637-39-4|cas:32771-64-5|kegg.compound:C00371|knapsack:C00000091|metacyc.compound:CPD-4210|pdb-ccd:ZEA|pubmed:12595714|pubmed:15321719|pubmed:16998071|pubmed:18718563|pubmed:21964459|pubmed:23187681|pubmed:23280040|pubmed:23656869|pubmed:24311578|pubmed:27613625|pubmed:28737742|pubmed:29630775|pubmed:29764985|pubmed:31682013|pubmed:33178280|pubmed:33999454|reaxys:616241|wikipedia.en:Zeatin Graph (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol|(E)-2-Methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol|(E)-2-methyl-4-(1H-purin-6-ylamino)-2-buten-1-ol|(E)-2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol|(E)-2-methyl-4-(purin-6-ylamino)-2-buten-1-ol|(E)-zeatin|N6-(4-Hydroxyisopentenyl)adenine|Zeatin|trans-Zeatin|trans-zeatin (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol|(E)-2-Methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol|(E)-2-methyl-4-(1H-purin-6-ylamino)-2-buten-1-ol|(E)-2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol|(E)-2-methyl-4-(purin-6-ylamino)-2-buten-1-ol|(E)-zeatin|N6-(4-Hydroxyisopentenyl)adenine|Zeatin|trans-Zeatin|trans-zeatin http://purl.obolibrary.org/obo/CHEBI_16522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:165223 biolink:ChemicalEntity Adriamycinone cas:24385-10-2|chemspider:65332 Graph (7S,9S)-6,7,9,11-tetrahydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione (7S,9S)-6,7,9,11-tetrahydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione (7S,9S)-6,7,9,11-tetrahydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione http://purl.obolibrary.org/obo/CHEBI_165223 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16523 biolink:ChemicalEntity D-serine The R-enantiomer of serine. cas:312-84-5|drugbank:DB03929|ecmdb:ECMDB03406|gmelin:1041392|hmdb:HMDB0003406|kegg.compound:C00740|metacyc.compound:D-SERINE|pdb-ccd:DSN|pubmed:11864625|pubmed:12850593|pubmed:19212759|pubmed:19217074|pubmed:21295046|pubmed:21914633|pubmed:21956571|pubmed:22117694|pubmed:22128843|pubmed:22266400|pubmed:22280157|pubmed:22362148|pubmed:22369458|pubmed:22445805|pubmed:22465696|pubmed:22486999|reaxys:1721403|ymdb:YMDB00284 Graph (2R)-2-amino-3-hydroxypropanoic acid|(R)-2-Amino-3-hydroxy-propionic acid|(R)-2-amino-3-hydroxypropanoic acid|D-SERINE|D-Serin|D-Serine|D-serine|DSN D-SERINE|D-Serine|D-serine (2R)-2-amino-3-hydroxypropanoic acid|(R)-2-Amino-3-hydroxy-propionic acid|(R)-2-amino-3-hydroxypropanoic acid|D-SERINE|D-Serin|D-Serine|D-serine|DSN http://purl.obolibrary.org/obo/CHEBI_16523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16524 biolink:ChemicalEntity testosterone acetate An androstanoid that is the acetate derivative of testosterone. cas:1045-69-8|gmelin:969611|kegg.compound:C03027|lipidmaps:LMST02020057|metacyc.compound:CPD-271|pubmed:15625768|pubmed:21742131|pubmed:24713476|reaxys:2062555 Graph 17beta-acetoxy-4-androsten-3-one|17beta-acetoxy-Delta(4)-androstan-3-one|17beta-hydroxyandrost-4-en-3-one acetate|3-oxoandrost-4-en-17beta-yl acetate|Testosterone acetate|testosterone 17-acetate|testosterone acetate 3-oxoandrost-4-en-17beta-yl acetate 17beta-acetoxy-4-androsten-3-one|17beta-acetoxy-Delta(4)-androstan-3-one|17beta-hydroxyandrost-4-en-3-one acetate|3-oxoandrost-4-en-17beta-yl acetate|Testosterone acetate|testosterone 17-acetate|testosterone acetate http://purl.obolibrary.org/obo/CHEBI_16524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16525 biolink:ChemicalEntity taurochenodeoxycholic acid A bile acid taurine conjugate of chenodeoxycholic acid. cas:516-35-8|hmdb:HMDB0000951|kegg.compound:C05465|lipidmaps:LMST05040005|pdb-ccd:TUD|pubmed:12065295|pubmed:21983642|pubmed:23510744|pubmed:23562588|pubmed:23811455|reaxys:3228311 Graph 2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid|Chenodeoxycholoyltaurine|Taurochenodeoxycholic acid|taurine chenodeoxycholate|taurochenodeoxycholate|taurochenodeoxycholic acid 2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid 2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid|Chenodeoxycholoyltaurine|Taurochenodeoxycholic acid|taurine chenodeoxycholate|taurochenodeoxycholate|taurochenodeoxycholic acid http://purl.obolibrary.org/obo/CHEBI_16525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16526 biolink:ChemicalEntity carbon dioxide A one-carbon compound with formula CO2 in which the carbon is attached to each oxygen atom by a double bond. A colourless, odourless gas under normal conditions, it is produced during respiration by all animals, fungi and microorganisms that depend directly or indirectly on living or decaying plants for food. cas:124-38-9|drugcentral:4256|gmelin:989|hmdb:HMDB0001967|kegg.compound:C00011|kegg.drug:D00004|metacyc.compound:CARBON-DIOXIDE|molbase:752|pdb-ccd:CO2|ppdb:119|pubmed:10826146|pubmed:11094503|pubmed:11584085|pubmed:11802652|pubmed:14639145|pubmed:15050588|pubmed:16591971|pubmed:16656478|pubmed:16659660|pubmed:17190796|pubmed:17448243|pubmed:17878298|pubmed:17884085|pubmed:19043767|pubmed:19259576|pubmed:19854893|pubmed:23384758|pubmed:23828359|pubmed:24258718|pubmed:8482095|pubmed:8818713|pubmed:8869828|pubmed:9611769|pubmed:9730350|reaxys:1900390|umbbd.compound:c0131|wikipedia.en:Carbon_dioxide Graph CARBON DIOXIDE|CO(2)|CO2|Carbon dioxide|E 290|E-290|E290|R-744|[CO2]|carbon dioxide|carbonic anhydride|dioxidocarbon|methanedione CARBON DIOXIDE|Carbon dioxide|carbon dioxide|dioxidocarbon|methanedione CARBON DIOXIDE|CO(2)|CO2|Carbon dioxide|E 290|E-290|E290|R-744|[CO2]|carbon dioxide|carbonic anhydride|dioxidocarbon|methanedione http://purl.obolibrary.org/obo/CHEBI_16526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16530 biolink:ChemicalEntity 3-methyl-2-oxobutanoic acid A 2-oxo monocarboxylic acid that is the 2-oxo derivative of isovaleric acid. cas:759-05-7|drugbank:DB04074|hmdb:HMDB0000019|kegg.compound:C00141|knapsack:C00007623|lipidmaps:LMFA01020274|metacyc.compound:2-KETO-ISOVALERATE|pdb-ccd:KIV|pubmed:17190852|pubmed:192504|pubmed:7021997|reaxys:1744951 Graph 2-Keto-3-methylbutyric acid|2-Ketoisovaleric acid|2-Ketovaline|2-Oxo-3-methylbutanoic acid|2-Oxo-3-methylbutyric acid|2-Oxoisovaleric acid|3-METHYL-2-OXOBUTANOIC ACID|3-Methyl-2-oxobutanoate|3-Methyl-2-oxobutanoic acid|3-Methyl-2-oxobutyric acid|3-methyl-2-oxobutanoic acid|Dimethylpyruvic acid|Isopropylglyoxylic acid|alpha-Ketovaline|alpha-keto-isovaleric acid|alpha-oxo-beta-methylbutyricacid|alpha-oxoisovaleric acid 3-METHYL-2-OXOBUTANOIC ACID|3-Methyl-2-oxobutanoic acid|3-methyl-2-oxobutanoic acid 2-Keto-3-methylbutyric acid|2-Ketoisovaleric acid|2-Ketovaline|2-Oxo-3-methylbutanoic acid|2-Oxo-3-methylbutyric acid|2-Oxoisovaleric acid|3-METHYL-2-OXOBUTANOIC ACID|3-Methyl-2-oxobutanoate|3-Methyl-2-oxobutanoic acid|3-Methyl-2-oxobutyric acid|3-methyl-2-oxobutanoic acid|Dimethylpyruvic acid|Isopropylglyoxylic acid|alpha-Ketovaline|alpha-keto-isovaleric acid|alpha-oxo-beta-methylbutyricacid|alpha-oxoisovaleric acid http://purl.obolibrary.org/obo/CHEBI_16530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16531 biolink:ChemicalEntity Renilla luciferin beilstein:768360|cas:50909-86-9|kegg.compound:C00982|metacyc.compound:RENILLA-LUCIFERIN|pubmed:1259766|pubmed:237531 Graph 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one|2-deoxycoelenterazine|Renilla luciferin|coelenterazine h|renillluciferin 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one|2-deoxycoelenterazine|Renilla luciferin|coelenterazine h|renillluciferin http://purl.obolibrary.org/obo/CHEBI_16531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16532 biolink:ChemicalEntity N-benzyloxycarbonylglycine A derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen. cas:1138-80-3|kegg.compound:C03710 Graph (Cbz)gly|Benzyloxycarbonylglycine|Carbobenzoxyglycine|Carbobenzoxyl glycine|Carbobenzyloxyglycine|N-(benzyloxycarbonyl)glycine|N-Benzyloxycarbonylglycine|N-CBZ-glycine|N-Carbobenzoxyglycine|N-Carbobenzyloxyglycine|N-Carboxyglycine N-benzyl ester|Z-Gly N-(benzyloxycarbonyl)glycine (Cbz)gly|Benzyloxycarbonylglycine|Carbobenzoxyglycine|Carbobenzoxyl glycine|Carbobenzyloxyglycine|N-(benzyloxycarbonyl)glycine|N-Benzyloxycarbonylglycine|N-CBZ-glycine|N-Carbobenzoxyglycine|N-Carbobenzyloxyglycine|N-Carboxyglycine N-benzyl ester|Z-Gly http://purl.obolibrary.org/obo/CHEBI_16532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16533 biolink:ChemicalEntity L-tryptophanamide An amino acid amide that is the carboxamide of L-tryptophan. cas:20696-57-5|drugbank:DB04537|hmdb:HMDB0013318|kegg.compound:C00977|metacyc.compound:CPD-584|pdb-ccd:LTN|pubmed:19309105 Graph (2S)-2-amino-3-(1H-indol-3-yl)propanamide|(S)-alpha-Amino-1H-indole-3-propionamide|L-Tryptophanamide|L-tryptophan amide (2S)-2-amino-3-(1H-indol-3-yl)propanamide (2S)-2-amino-3-(1H-indol-3-yl)propanamide|(S)-alpha-Amino-1H-indole-3-propionamide|L-Tryptophanamide|L-tryptophan amide http://purl.obolibrary.org/obo/CHEBI_16533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16534 biolink:ChemicalEntity D-galactonic acid A galactonic acid compound having D-configuration. cas:576-36-3|hmdb:HMDB0000565|kegg.compound:C00880|reaxys:1726059 Graph D-Galactonic acid|D-galactonic acid D-Galactonic acid|D-galactonic acid D-Galactonic acid|D-galactonic acid http://purl.obolibrary.org/obo/CHEBI_16534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16535 biolink:ChemicalEntity piperazine-2,5-dione A cyclic peptide that is piperazine in which the hydrogens at positions 2 and 5 are replaced by oxo groups. cas:106-57-0|gmelin:217756|kegg.compound:C02777|knapsack:C00014894|pubmed:12587880|pubmed:24618890|pubmed:24917118|reaxys:112112|wikipedia.en:Diketopiperazine Graph 2,5-Diazacyclohexane-1,4-dione|2,5-Dioxopiperazine|2,5-Piperazinedione|2,5-dioxopiperazine|Diketopiperazine|Glycine anhydride|cyclo-(Gly-Gly)|piperazine-2,5-dione piperazine-2,5-dione 2,5-Diazacyclohexane-1,4-dione|2,5-Dioxopiperazine|2,5-Piperazinedione|2,5-dioxopiperazine|Diketopiperazine|Glycine anhydride|cyclo-(Gly-Gly)|piperazine-2,5-dione http://purl.obolibrary.org/obo/CHEBI_16535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16536 biolink:ChemicalEntity orcinol A 5-alkylresorcinol in which the alkyl group is specified as methyl. cas:504-15-4|kegg.compound:C00727|knapsack:C00002661|metacyc.compound:ORCINOL-CPD|pubmed:20630753|pubmed:21108141|pubmed:21718031|pubmed:22196542|pubmed:25537370|pubmed:2719988|pubmed:3742332|reaxys:1071903|umbbd.compound:c0155|wikipedia.en:Orcinol Graph 1,3-Dihydroxy-5-methylbenzene|3,5-Dihydroxytoluene|3,5-Toluenediol|3-Hydroxy-5-methylphenol|5-Methyl-1,3-benzenediol|5-Methyl-1,3-dihydroxybenzene|5-Methylresorcinol|5-methylbenzene-1,3-diol|Orcin|Orcinol|orcinol 5-methylbenzene-1,3-diol 1,3-Dihydroxy-5-methylbenzene|3,5-Dihydroxytoluene|3,5-Toluenediol|3-Hydroxy-5-methylphenol|5-Methyl-1,3-benzenediol|5-Methyl-1,3-dihydroxybenzene|5-Methylresorcinol|5-methylbenzene-1,3-diol|Orcin|Orcinol|orcinol http://purl.obolibrary.org/obo/CHEBI_16536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16537 biolink:ChemicalEntity galactarate(2-) A dicarboxylic acid dianion that is the conjugate base of galactarate(1−). gmelin:1065131|metacyc.compound:D-GALACTARATE|reaxys:3909240 Graph (2R,3S,4R,5S)-2,3,4,5-tetrahydroxyhexanedioate|galactarate|meso-galactarate (2R,3S,4R,5S)-2,3,4,5-tetrahydroxyhexanedioate|meso-galactarate (2R,3S,4R,5S)-2,3,4,5-tetrahydroxyhexanedioate|galactarate|meso-galactarate http://purl.obolibrary.org/obo/CHEBI_16537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16540 biolink:ChemicalEntity pyridin-2-ol A monohydroxypyridine that is pyridine substituted by a hydroxy group at position 2. cas:142-08-5|hmdb:HMDB0013751|kegg.compound:C02502|knapsack:C00007405|pubmed:10952545|reaxys:105786 Graph 2-Hydroxypyridine|2-Pyridinol|2-Pyridone|2-hydroxypyridine|2-pyridinol|2-pyridone|pyridin-2-ol pyridin-2-ol 2-Hydroxypyridine|2-Pyridinol|2-Pyridone|2-hydroxypyridine|2-pyridinol|2-pyridone|pyridin-2-ol http://purl.obolibrary.org/obo/CHEBI_16540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16541 biolink:ChemicalEntity protein polypeptide chain A naturally occurring polypeptide synthesized at the ribosome. kegg.compound:C00017 Graph Protein|a protein|polypeptide chain|protein polypeptide chains Protein|a protein|polypeptide chain|protein polypeptide chains http://purl.obolibrary.org/obo/CHEBI_16541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16542 biolink:ChemicalEntity L-serine phosphoethanolamine The L-enantiomer of serine phosphoethanolamine. cas:1186-34-1|foodb.food:FDB008641|hmdb:HMDB0031950|kegg.compound:C03872|pubmed:5936240|pubmed:5972200 Graph L-serine 3-(2-aminoethyl hydrogen phosphate)|L-serine ethanolamine phosphate|L-serine ethanolamine phosphodiester|L-serine, 2-aminoethyl hydrogen phosphate (ester)|L-serine-phosphoethanolamine|O-[(2-aminoethoxy)(hydroxy)phosphoryl]-L-serine|serine phosphoethanolamine L-serine 3-(2-aminoethyl hydrogen phosphate) L-serine 3-(2-aminoethyl hydrogen phosphate)|L-serine ethanolamine phosphate|L-serine ethanolamine phosphodiester|L-serine, 2-aminoethyl hydrogen phosphate (ester)|L-serine-phosphoethanolamine|O-[(2-aminoethoxy)(hydroxy)phosphoryl]-L-serine|serine phosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_16542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16543 biolink:ChemicalEntity N(2)-acetyl-L-ornithine An N2-acyl-L-ornithine where the acyl group is specified to be acetyl. cas:6205-08-9|ecmdb:ECMDB03357|hmdb:HMDB0003357|kegg.compound:C00437|pdb-ccd:AOR|pubmed:19561621|pubmed:21890434|pubmed:22016985|reaxys:1725555 Graph (2S)-2-acetamido-5-aminopentanoic acid|N(2)-acetyl-L-ornithine|N-Acetylornithine|N2-Acetyl-L-ornithine (2S)-2-acetamido-5-aminopentanoic acid|N(2)-acetyl-L-ornithine (2S)-2-acetamido-5-aminopentanoic acid|N(2)-acetyl-L-ornithine|N-Acetylornithine|N2-Acetyl-L-ornithine http://purl.obolibrary.org/obo/CHEBI_16543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16544 biolink:ChemicalEntity UDP-N-acetyl-D-galactosamine 4,6-bissulfate Graph uridine 5'-[3-(2-acetamido-2-deoxy-4,6-di-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-4,6-di-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-4,6-di-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16545 biolink:ChemicalEntity 5-valerolactone The simplest member of the class of δ-lactone that is tetrahydro-2H-pyran substituted by an oxo group at position 2. cas:542-28-9|kegg.compound:C02240|metacyc.compound:5-VALEROLACTONE|patent:US2011237806|pubmed:16134088|pubmed:18324833|reaxys:106436|wikipedia.en:Delta-Valerolactone Graph 5-Valerolactone|5-valerolactone|delta-Valerolactone|tetrahydro-2H-pyran-2-one tetrahydro-2H-pyran-2-one 5-Valerolactone|5-valerolactone|delta-Valerolactone|tetrahydro-2H-pyran-2-one http://purl.obolibrary.org/obo/CHEBI_16545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16546 biolink:ChemicalEntity 1-O-sinapoyl-beta-D-glucose A glucosyl hydroxycinnamic acid that is the cinnamate ester obtained by the formal condensation of the carboxy group of trans-sinapic acid with the anomeric hydroxy group of β-D-glucose. kegg.compound:C01175|knapsack:C00013592|pdb-ccd:SGS|pubmed:24241853|pubmed:24271623|reaxys:4272186 Graph (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl beta-D-glucopyranoside|(E)-(2S,3R,4S,5S,6R)-TETRAHYDRO-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)-2H-PYRAN-2-YL 3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)ACRYLATE|1-O-(trans-sinapoyl)-beta-D-glucose|1-O-Sinapoyl beta-D-glucoside|1-O-Sinapoyl-beta-D-glucose|1-O-[(2E)-sinapoyl]-beta-D-glucopyranose|1-O-[(2E)-sinapoyl]-beta-D-glucose|1-O-[(E)-sinapoyl]-beta-D-glucopyranose (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl beta-D-glucopyranoside (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl beta-D-glucopyranoside|(E)-(2S,3R,4S,5S,6R)-TETRAHYDRO-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)-2H-PYRAN-2-YL 3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)ACRYLATE|1-O-(trans-sinapoyl)-beta-D-glucose|1-O-Sinapoyl beta-D-glucoside|1-O-Sinapoyl-beta-D-glucose|1-O-[(2E)-sinapoyl]-beta-D-glucopyranose|1-O-[(2E)-sinapoyl]-beta-D-glucose|1-O-[(E)-sinapoyl]-beta-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_16546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16547 biolink:ChemicalEntity coniferyl aldehyde A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and a methoxy group at position 3. cas:458-36-6|kegg.compound:C02666|knapsack:C00002728|metacyc.compound:CONIFERYL-ALDEHYDE|pubmed:22034160|pubmed:22466741|pubmed:23302528|pubmed:23725839|pubmed:24010325|reaxys:2048208|wikipedia.en:Coniferyl_aldehyde Graph (E)-coniferaldehyde|3-(4-hydroxy-3-methoxyphenyl)prop-2-enal|4-Hydroxy-3-methoxycinnamaldehyde|4-hydroxy-3-methoxycinnamaldehyde|Coniferaldehyde|Coniferyl aldehyde|Ferulaldehyde 3-(4-hydroxy-3-methoxyphenyl)prop-2-enal (E)-coniferaldehyde|3-(4-hydroxy-3-methoxyphenyl)prop-2-enal|4-Hydroxy-3-methoxycinnamaldehyde|4-hydroxy-3-methoxycinnamaldehyde|Coniferaldehyde|Coniferyl aldehyde|Ferulaldehyde http://purl.obolibrary.org/obo/CHEBI_16547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16548 biolink:ChemicalEntity chlordecone An organochlorine compound with insecticidal activity. agr:IND44714295|cas:143-50-0|hmdb:HMDB0059603|kegg.compound:C01792|lincs.smallmolecule:LSM-36918|patent:US2616825|patent:US2616928|ppdb:1293|pubmed:19167793|pubmed:20566993|pubmed:21852857|pubmed:22683396|pubmed:23706897|pubmed:23827360|pubmed:24401561|reaxys:1894593|wikipedia.en:Kepone Graph 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-one|1,2,3,4,6,7,8,9,10,10-decachloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-one|Chlordecone|GC 1189|Kepone|chlordecone|decachloropentacyclo[5.2.1.0(2,6).0(3,9).0(5,8)]decan-4-one|perchloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-one 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-one 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-one|1,2,3,4,6,7,8,9,10,10-decachloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-one|Chlordecone|GC 1189|Kepone|chlordecone|decachloropentacyclo[5.2.1.0(2,6).0(3,9).0(5,8)]decan-4-one|perchloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-one http://purl.obolibrary.org/obo/CHEBI_16548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16549 biolink:ChemicalEntity UDP-2-acetamido-4-amino-2,4,6-trideoxy-D-glucose A UDP-amino sugar having 2-acetamido-4-amino-2,4,6-trideoxy-D-glucose as the sugar component. Graph UDP-2-acetamido-4-amino-2,4,6-trideoxyglucose|uridine 5'-[3-(2-acetamido-4-amino-2,4,6-trideoxy-D-glucopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-4-amino-2,4,6-trideoxy-D-glucopyranosyl) dihydrogen diphosphate] UDP-2-acetamido-4-amino-2,4,6-trideoxyglucose|uridine 5'-[3-(2-acetamido-4-amino-2,4,6-trideoxy-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:165498 biolink:ChemicalEntity 1-O-alpha-D-Glucopyranosyl-1,2-nonadecandiol chemspider:24822115|lipidmaps:LMFA13010006 Graph (3S,5S,6S)-2-(hydroxymethyl)-6-(2-hydroxynonadecoxy)oxane-3,4,5-triol (3S,5S,6S)-2-(hydroxymethyl)-6-(2-hydroxynonadecoxy)oxane-3,4,5-triol (3S,5S,6S)-2-(hydroxymethyl)-6-(2-hydroxynonadecoxy)oxane-3,4,5-triol http://purl.obolibrary.org/obo/CHEBI_165498 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16550 biolink:ChemicalEntity xanthommatin An ommochrome that consists of a pyrido[3,2-a]phenoxazine ring system bearing hydroxy, carboxy, oxo and 3-amino-3-carboxypropanoyl substituents at positions 1, 3, 5 and 11 respectively. The parent of the class of xanthommatins. cas:521-58-4|kegg.compound:C01969|pubmed:3092804|pubmed:4631600|pubmed:5798588|pubmed:6662501|pubmed:6802132|pubmed:7470018|pubmed:751645|pubmed:828051|reaxys:633700 Graph 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid|Xanthommatin 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid 11-(3-amino-3-carboxypropanoyl)-1-hydroxy-5-oxo-5H-pyrido[3,2-a]phenoxazine-3-carboxylic acid|Xanthommatin http://purl.obolibrary.org/obo/CHEBI_16550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16551 biolink:ChemicalEntity alpha,alpha-trehalose A trehalose in which both glucose residues have α-configuration at the anomeric carbon. cas:99-20-7|gmelin:2145829|hmdb:HMDB0000975|kegg.compound:C01083|kegg.glycan:G00293|knapsack:C00001152|lincs.smallmolecule:LSM-37121|metacyc.compound:TREHALOSE|pdb-ccd:TRE|pubmed:17439666|pubmed:20477758|reaxys:1292766|wikipedia.en:Trehalose Graph (Glc)2|D-(+)-trehalose|TREHALOSE|Trehalose|alpha,alpha'-Trehalose|alpha,alpha-Trehalose|alpha,alpha-trehalose|alpha-D-Glcp-(1<->1)-alpha-D-Glcp|alpha-D-Trehalose|alpha-D-glucopyranosyl alpha-D-glucopyranoside|alpha-D-glucopyranosyl-alpha-D-glucopyranoside|alpha-trehalose|ergot sugar|mycose alpha-D-glucopyranosyl alpha-D-glucopyranoside (Glc)2|D-(+)-trehalose|TREHALOSE|Trehalose|alpha,alpha'-Trehalose|alpha,alpha-Trehalose|alpha,alpha-trehalose|alpha-D-Glcp-(1<->1)-alpha-D-Glcp|alpha-D-Trehalose|alpha-D-glucopyranosyl alpha-D-glucopyranoside|alpha-D-glucopyranosyl-alpha-D-glucopyranoside|alpha-trehalose|ergot sugar|mycose http://purl.obolibrary.org/obo/CHEBI_16551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16552 biolink:ChemicalEntity N-formyl-L-methionine A L-methionine derivative in which one of the hydrogens attached to the nitrogen is replaced by a formyl group. cas:4289-98-9|drugbank:DB04464|hmdb:HMDB0001015|kegg.compound:C03145|metacyc.compound:N-FORMYLMETHIONINE|pdb-ccd:FME|pubmed:22770225|reaxys:1725218|wikipedia.en:Formylmethionine Graph (2S)-2-(formylamino)-4-(methylthio)butanoic acid|(2S)-2-formamido-4-(methylsulfanyl)butanoic acid|Formyl-methionine|N-Formyl-L-methionine|N-formyl-L-methionine|N-formylmethionine (2S)-2-formamido-4-(methylsulfanyl)butanoic acid|N-Formyl-L-methionine|N-formyl-L-methionine (2S)-2-(formylamino)-4-(methylthio)butanoic acid|(2S)-2-formamido-4-(methylsulfanyl)butanoic acid|Formyl-methionine|N-Formyl-L-methionine|N-formyl-L-methionine|N-formylmethionine http://purl.obolibrary.org/obo/CHEBI_16552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16553 biolink:ChemicalEntity UDP-4-dehydro-6-deoxy-D-glucose Graph uridine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose ) dihydrogen diphosphate] uridine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose ) dihydrogen diphosphate] uridine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose ) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16554 biolink:ChemicalEntity sym-homospermidine A polyazaalkane comprising undecane with three aza groups placed at the 1-, 6- and 11-positions. beilstein:1739673|cas:4427-76-3|kegg.compound:C06366 Graph 1,6,11-triazaundecane|Homospermidine|N-(4-aminobutyl)-1,4-butanediamine|N-(4-aminobutyl)butane-1,4-diamine|bis(4-aminobutyl)amine|sym-Homospermidine N-(4-aminobutyl)butane-1,4-diamine 1,6,11-triazaundecane|Homospermidine|N-(4-aminobutyl)-1,4-butanediamine|N-(4-aminobutyl)butane-1,4-diamine|bis(4-aminobutyl)amine|sym-Homospermidine http://purl.obolibrary.org/obo/CHEBI_16554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16555 biolink:ChemicalEntity ethanethioic S-acid A thioacetic acid that is acetic acid in which the oxygen atom of the hydroxy group has been replaced by a sulfur atom. cas:507-09-5|gmelin:49262|kegg.compound:C01857|pubmed:23298036|reaxys:773684 Graph CH3COSH|Thioacetic acid|acetyl mercaptan|ethanethioic S-acid|thioacetic S-acid ethanethioic S-acid CH3COSH|Thioacetic acid|acetyl mercaptan|ethanethioic S-acid|thioacetic S-acid http://purl.obolibrary.org/obo/CHEBI_16555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16556 biolink:ChemicalEntity CMP-N-acetyl-beta-neuraminic acid A nucleotide sugar used as a donor by glycosyltransferases for the synthesis of sugar chains cas:3063-71-6|drugbank:DB02485|kegg.compound:C00128|kegg.glycan:G10616|pdb-ccd:NCC|pubmed:27373998|reaxys:4224251 Graph CMP acetylneuraminic acid|CMP-N-acetylneuraminate|CMP-Neu5Ac|CMP-NeuNAc|CMP-beta-Neu5Ac|CMP-sialic acid|CYTIDINE-5'-MONOPHOSPHATE-5-N-ACETYLNEURAMINIC ACID|Cmp-nana|cytidine 5'-(5-acetamido-3,5-dideoxy-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate)|cytidine monophosphate N-acetylneuraminic acid|cytidine-5'-monophospho-N-acetylneuraminic acid|cytidine-5'-monophosphono-N-acetylneuraminic acid cytidine 5'-(5-acetamido-3,5-dideoxy-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate) CMP acetylneuraminic acid|CMP-N-acetylneuraminate|CMP-Neu5Ac|CMP-NeuNAc|CMP-beta-Neu5Ac|CMP-sialic acid|CYTIDINE-5'-MONOPHOSPHATE-5-N-ACETYLNEURAMINIC ACID|Cmp-nana|cytidine 5'-(5-acetamido-3,5-dideoxy-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate)|cytidine monophosphate N-acetylneuraminic acid|cytidine-5'-monophospho-N-acetylneuraminic acid|cytidine-5'-monophosphono-N-acetylneuraminic acid http://purl.obolibrary.org/obo/CHEBI_16556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16557 biolink:ChemicalEntity quercetin 3,3',7-trissulfate A quercetin trissulfate having the three sulfo groups placed at the 3-, 3'- and 7-positions. kegg.compound:C03897|knapsack:C00004962|metacyc.compound:QUERCETIN-337-TRISSULFATE|reaxys:3642435 Graph 5-hydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromene-3,7-diyl bis(hydrogen sulfate)|Quercetin 3,3',7-trissulfate 5-hydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromene-3,7-diyl bis(hydrogen sulfate) 5-hydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromene-3,7-diyl bis(hydrogen sulfate)|Quercetin 3,3',7-trissulfate http://purl.obolibrary.org/obo/CHEBI_16557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16558 biolink:ChemicalEntity triacetic acid A dioxo monocarboxylic acid comprising hexanoic acid with the two oxo groups placed at the 3- and 5-positions. beilstein:1761209|cas:2140-49-0|kegg.compound:C01757 Graph 3,5-dioxohexanoic acid|Triacetate 3,5-dioxohexanoic acid 3,5-dioxohexanoic acid|Triacetate http://purl.obolibrary.org/obo/CHEBI_16558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:165587 biolink:ChemicalEntity Margaroyl-EA cas:53832-59-0|chemspider:21467441|lipidmaps:LMFA08040049 Graph N-(2-hydroxyethyl)heptadecanamide N-(2-hydroxyethyl)heptadecanamide N-(2-hydroxyethyl)heptadecanamide http://purl.obolibrary.org/obo/CHEBI_165587 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16562 biolink:ChemicalEntity 2-phenylacetamide A monocarboxylic acid amide that is acetamide substituted by a phenyl group at position 2. cas:103-81-1|gmelin:101820|hmdb:HMDB0010715|kegg.compound:C02505|metacyc.compound:CPD-238|pubmed:22548364|reaxys:507886|umbbd.compound:c0648 Graph 2-Phenylacetamide|2-phenylacetamide|alpha-phenylacetamide|alpha-toluamide|benzeneacetamide|phenyl-beta-acetylamine|phenylacetamide|phenylacetic acid amide 2-Phenylacetamide|2-phenylacetamide 2-Phenylacetamide|2-phenylacetamide|alpha-phenylacetamide|alpha-toluamide|benzeneacetamide|phenyl-beta-acetylamine|phenylacetamide|phenylacetic acid amide http://purl.obolibrary.org/obo/CHEBI_16562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16563 biolink:ChemicalEntity tetrahydropalmatine A berberine alkaloid obtained by formal addition of two molecules of hydrogen to the pyridine ring of palmatine. cas:483-14-7|kegg.compound:C02890|knapsack:C00025252|metacyc.compound:TETRAHYDROPALMATINE|pubmed:10680579|pubmed:11488467|pubmed:12709895|pubmed:17260290|pubmed:19544352|pubmed:19927376|pubmed:20083181|pubmed:20109541|pubmed:20234973|pubmed:20349723|pubmed:20828314|pubmed:20884991|pubmed:21196089|pubmed:21319371|pubmed:21493954|pubmed:21633914|pubmed:21678521|pubmed:21733652|reaxys:96288|wikipedia.en:Tetrahydropalmatine Graph (-)-tetrahydropalmatine|(13aS)-2,3,9,10-tetramethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline|(S)-(-)-tetrahydropalmatine|(S)-Tetrahydropalmatine|(S)-tetrahydropalmatine|2,3,9,10-tetramethoxy-13aalpha-berbine|L-tetrahydropalmatine|Tetrahydropalmatine (13aS)-2,3,9,10-tetramethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline (-)-tetrahydropalmatine|(13aS)-2,3,9,10-tetramethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline|(S)-(-)-tetrahydropalmatine|(S)-Tetrahydropalmatine|(S)-tetrahydropalmatine|2,3,9,10-tetramethoxy-13aalpha-berbine|L-tetrahydropalmatine|Tetrahydropalmatine http://purl.obolibrary.org/obo/CHEBI_16563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16566 biolink:ChemicalEntity sphinganine A 2-aminooctadecane-1,3-diol having (2S,3R)-configuration. cas:764-22-7|hmdb:HMDB0000269|kegg.compound:C00836|knapsack:C00007540|lipidmaps:LMSP01020001|metacyc.compound:CPD-13612|pubmed:17085324|pubmed:1817037|pubmed:7654391|pubmed:7819132|reaxys:1724230 Graph (2S,3R)-2-amino-1,3-octadecanediol|(2S,3R)-2-aminooctadecane-1,3-diol|(R-(R*,S*))-2-aminooctadecane-1,3-diol|2-Amino-1,3-dihydroxyoctadecane|C18-dihydrosphingosine|C18-sphinganine|D-erythro-1,3-dihydroxy-2-aminooctadecane|D-erythro-2-amino-1,3-octadecanediol|D-erythro-C18-dihydrosphingosine|Dihydrosphingosine|Safingol|Sphinganine|d18:0|octadecasphinganine|sphinganine Sphinganine|sphinganine (2S,3R)-2-amino-1,3-octadecanediol|(2S,3R)-2-aminooctadecane-1,3-diol|(R-(R*,S*))-2-aminooctadecane-1,3-diol|2-Amino-1,3-dihydroxyoctadecane|C18-dihydrosphingosine|C18-sphinganine|D-erythro-1,3-dihydroxy-2-aminooctadecane|D-erythro-2-amino-1,3-octadecanediol|D-erythro-C18-dihydrosphingosine|Dihydrosphingosine|Safingol|Sphinganine|d18:0|octadecasphinganine|sphinganine http://purl.obolibrary.org/obo/CHEBI_16566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16567 biolink:ChemicalEntity anthranilate An aminobenzoate that is the conjugate base of anthranilic acid, obtained by deprotonation of the carboxy group. gmelin:131077|hmdb:HMDB0001123|kegg.compound:C00108|metacyc.compound:ANTHRANILATE|reaxys:3904977|umbbd.compound:c0345 Graph 2-aminobenzoate|anthranilate 2-aminobenzoate 2-aminobenzoate|anthranilate http://purl.obolibrary.org/obo/CHEBI_16567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16568 biolink:ChemicalEntity 5,10-methylenetetrahydromethanopterin kegg.compound:C04377|umbbd.compound:c0350 Graph 1-{4-[(6S,6aR,7R)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]phenyl}-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|5,10-Methylenetetrahydromethanopterin|N5,N10-Methylenetetrahydromethanopterin 1-{4-[(6S,6aR,7R)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]phenyl}-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol 1-{4-[(6S,6aR,7R)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]phenyl}-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|5,10-Methylenetetrahydromethanopterin|N5,N10-Methylenetetrahydromethanopterin http://purl.obolibrary.org/obo/CHEBI_16568 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16569 biolink:ChemicalEntity 3-hydroxyquinolin-4(1H)-one A quinoline having the keto group at the 4-position and an additional hydroxy substituent at the 3-position. beilstein:1526157|kegg.compound:C11503 Graph 3-Hydroxy-1H-quinolin-4-one|3-hydroxy-1H-quinolin-4-one|3-hydroxyquinolin-4(1H)-one 3-hydroxyquinolin-4(1H)-one 3-Hydroxy-1H-quinolin-4-one|3-hydroxy-1H-quinolin-4-one|3-hydroxyquinolin-4(1H)-one http://purl.obolibrary.org/obo/CHEBI_16569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16570 biolink:ChemicalEntity N(6)-hydroxy-L-lysine The N6-hydroxy derivative of L-lysine. beilstein:1706600|kegg.compound:C01028 Graph (2S)-2-amino-6-(hydroxyamino)hexanoic acid|N(6)-hydroxy-L-lysine|N6-Hydroxy-L-lysine (2S)-2-amino-6-(hydroxyamino)hexanoic acid|N(6)-hydroxy-L-lysine (2S)-2-amino-6-(hydroxyamino)hexanoic acid|N(6)-hydroxy-L-lysine|N6-Hydroxy-L-lysine http://purl.obolibrary.org/obo/CHEBI_16570 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16571 biolink:ChemicalEntity oxidised poly(vinyl alcohol) A homopolymer macromolecule obtained by oxidiation of poly(vinyl alcohol). For the sake of convenience, a representative structure of the repeating unit is depicted; the extent of oxidation is variable. kegg.compound:C01166 Graph Oxidized polyvinyl alcohol|an oxidized polyvinyl alcohol Oxidized polyvinyl alcohol|an oxidized polyvinyl alcohol http://purl.obolibrary.org/obo/CHEBI_16571 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16572 biolink:ChemicalEntity 3-ethylcatechol The simplest member of the class of 3-ethylcatechols that is catechol bearing an ethyl substituent at position 3. cas:933-99-3|kegg.compound:C06728|reaxys:2326443|umbbd.compound:c0274 Graph 2,3-Dihydroxyethylbenzene|2,3-dihydroxyethylbenzene|3-Ethyl-benzene-1,2-diol|3-Ethylcatechol|3-ethyl-benzene-1,2-diol|3-ethylbenzene-1,2-diol|3-ethylcatechol 3-ethylbenzene-1,2-diol 2,3-Dihydroxyethylbenzene|2,3-dihydroxyethylbenzene|3-Ethyl-benzene-1,2-diol|3-Ethylcatechol|3-ethyl-benzene-1,2-diol|3-ethylbenzene-1,2-diol|3-ethylcatechol http://purl.obolibrary.org/obo/CHEBI_16572 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16573 biolink:ChemicalEntity carbonyl sulfide A one-carbon compound in which the carbon atom is attached to an oxygen and a sulfur atom via double bonds. cas:463-58-1|kegg.compound:C07331|reaxys:1697284|umbbd.compound:c0562|wikipedia.en:Carbonyl_sulfide Graph C(O)S|Carbonyl sulfide|O=C=S|carbon oxide sulfide|carbonyl sulfide|carbonyl sulphide|oxidosulfidocarbon Carbonyl sulfide|carbonyl sulfide|oxidosulfidocarbon C(O)S|Carbonyl sulfide|O=C=S|carbon oxide sulfide|carbonyl sulfide|carbonyl sulphide|oxidosulfidocarbon http://purl.obolibrary.org/obo/CHEBI_16573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16576 biolink:ChemicalEntity D-alanyl-D-alanine A dipeptide comprising D-alanine with a D-alanyl residue attached to the α-nitrogen. It is a component of bacterial peptidoglycan and forms an important target for development of antibacterial drugs . cas:923-16-0|hmdb:HMDB0003459|kegg.compound:C00993|knapsack:C00019576|pubmed:16030213|pubmed:19053785|pubmed:24440607|pubmed:61706|reaxys:1724814 Graph (D-Ala)2|D-Ala-D-Ala|D-Alanyl-D-alanine|H-D-Ala-D-Ala-OH (D-Ala)2|D-Ala-D-Ala|D-Alanyl-D-alanine|H-D-Ala-D-Ala-OH http://purl.obolibrary.org/obo/CHEBI_16576 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16577 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid A cholestanoid that is 5β-cholestan-26-oic acid substituted by α-hydroxy groups at positions 3 and 7 respectively. kegg.compound:C04554|lipidmaps:LMST04030066|reaxys:5384167 Graph 3alpha,7alpha-Dihydroxy-5beta-cholestanate|3alpha,7alpha-Dihydroxy-5beta-cholestanoate|3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid|3alpha,7alpha-dihydroxy-5beta-cholestanic acid 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid 3alpha,7alpha-Dihydroxy-5beta-cholestanate|3alpha,7alpha-Dihydroxy-5beta-cholestanoate|3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid|3alpha,7alpha-dihydroxy-5beta-cholestanic acid http://purl.obolibrary.org/obo/CHEBI_16577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16578 biolink:ChemicalEntity 4-CDP-2-C-methyl-D-erythritol kegg.compound:C11435|knapsack:C00007620|pdb-ccd:CDM Graph 4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol|cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] dihydrogen diphosphate} cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] dihydrogen diphosphate} 4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol|cytidine 5'-{3-[(2R,3S)-2,3,4-trihydroxy-3-methylbutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_16578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16579 biolink:ChemicalEntity anisole A monomethoxybenzene that is benzene substituted by a methoxy group. cas:100-66-3|gmelin:2964|hmdb:HMDB0033895|kegg.compound:C01403|metacyc.compound:CPD-395|pubmed:11944828|pubmed:24814399|reaxys:506892|wikipedia.en:Anisole Graph Anisol|Anisole|Methoxybenzene|Methyl phenyl ether|Phenol methyl ether|anisole Anisole|anisole Anisol|Anisole|Methoxybenzene|Methyl phenyl ether|Phenol methyl ether|anisole http://purl.obolibrary.org/obo/CHEBI_16579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16580 biolink:ChemicalEntity N-hydroxy-4-aminobiphenyl A N-substituted amine that is 4-aminobiphenyl substituted by a hydroxy group at the nitrogen atom. cas:6810-26-0|kegg.compound:C03622|pubmed:1600616|pubmed:16970317|pubmed:24881456|pubmed:647655|reaxys:2639597 Graph 4-biphenylhydroxylamine|4-hydroxyaminobiphenyl|4-hydroxylaminobiphenyl|N-1,1'-biphenyl-4-ylhydroxylamine|N-4-biphenylylhydroxylamine|N-Hydroxy-4-aminobiphenyl|N-hydroxy-[1,1'-biphenyl]-4-amine N-hydroxy-[1,1'-biphenyl]-4-amine 4-biphenylhydroxylamine|4-hydroxyaminobiphenyl|4-hydroxylaminobiphenyl|N-1,1'-biphenyl-4-ylhydroxylamine|N-4-biphenylylhydroxylamine|N-Hydroxy-4-aminobiphenyl|N-hydroxy-[1,1'-biphenyl]-4-amine http://purl.obolibrary.org/obo/CHEBI_16580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16581 biolink:ChemicalEntity pregnenolone A 20-oxo steroid that is pregn-5-ene substituted by a β-hydroxy group at position 3 and an oxo group at position 20. beilstein:2059026|cas:145-13-1|drugbank:DB02789|hmdb:HMDB0000253|kegg.compound:C01953|kegg.drug:D00143|lincs.smallmolecule:LSM-5550|lipidmaps:LMST02030088|pdb-ccd:PLO|pubmed:23572091|pubmed:24385629|reaxys:2059026|wikipedia.en:Pregnenolone Graph (3BETA)-3-HYDROXYPREGN-5-EN-20-ONE|3beta-Hydroxypregn-5-en-20-one|3beta-hydroxypregn-5-en-20-one|5-Pregnen-3beta-ol-20-one|Pregnenolone|pregnenolone 3beta-Hydroxypregn-5-en-20-one|3beta-hydroxypregn-5-en-20-one (3BETA)-3-HYDROXYPREGN-5-EN-20-ONE|3beta-Hydroxypregn-5-en-20-one|3beta-hydroxypregn-5-en-20-one|5-Pregnen-3beta-ol-20-one|Pregnenolone|pregnenolone http://purl.obolibrary.org/obo/CHEBI_16581 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16582 biolink:ChemicalEntity oxaluric acid A 2-oxo monocarboxylic acid that is amino(oxo)acetic acid substituted by a carbamoylamino group at the nitrogen atom. cas:585-05-7|ecmdb:ECMDB20181|kegg.compound:C00802|knapsack:C00007463|metacyc.compound:CPD-389|pubmed:22583701|pubmed:23284870|reaxys:1769145 Graph (carbamoylamino)(oxo)acetic acid|Monooxalylurea|Oxalurate|Oxalureate|Oxaluric acid|onooxalylurea|oxal|ureido(oxo)acetic acid (carbamoylamino)(oxo)acetic acid (carbamoylamino)(oxo)acetic acid|Monooxalylurea|Oxalurate|Oxalureate|Oxaluric acid|onooxalylurea|oxal|ureido(oxo)acetic acid http://purl.obolibrary.org/obo/CHEBI_16582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16583 biolink:ChemicalEntity butane-2,3-dione An α-diketone that is butane substituted by oxo groups at positions 2 and 3. It is a metabolite produced during the malolactic fermentation. cas:431-03-8|hmdb:HMDB0003407|kegg.compound:C00741|pubmed:15654607|pubmed:24614328|reaxys:605398 Graph 2,3-Butadione|2,3-Butanedione|2,3-Diketobutane|2,3-Dioxobutane|2,3-butandione|Biacetyl|Diacetyl|Dimethyl glyoxal|Dimethylglyoxal|butane-2,3-dione|diacetyl butane-2,3-dione 2,3-Butadione|2,3-Butanedione|2,3-Diketobutane|2,3-Dioxobutane|2,3-butandione|Biacetyl|Diacetyl|Dimethyl glyoxal|Dimethylglyoxal|butane-2,3-dione|diacetyl http://purl.obolibrary.org/obo/CHEBI_16583 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16584 biolink:ChemicalEntity isopentenyl diphosphate A prenol phosphate comprising 3-methylbut-3-en-1-ol having an O-diphosphate substituent. cas:358-71-4|drugbank:DB04714|kegg.compound:C00129|knapsack:C00000848|lipidmaps:LMPR01010008|pdb-ccd:IPE|pubmed:11278429|pubmed:15450402|pubmed:23000003|pubmed:23543734|pubmed:23747531|pubmed:23872678|pubmed:7584140|pubmed:7753173|reaxys:1713792|wikipedia.en:Isopentenyl_pyrophosphate Graph 3-Methyl-3-butenyl pyrophosphate|3-methylbut-3-en-1-yl trihydrogen diphosphate|3-methylbut-3-enyl phosphono hydrogen phosphate|Diphosphoric acid mono(3-methyl-3-butenyl) ester|IPP|IPPP|Isopentenyl diphosphate|Isopentenyl pyrophosphate|Mono(3-methyl-3-butenyl) diphosphate|delta-3-Isopentenyl pyrophosphate|delta3-Isopentenyl diphosphate|delta3-Methyl-3-butenyl diphosphate|delta3-isopentenyl diphosphate 3-methylbut-3-en-1-yl trihydrogen diphosphate 3-Methyl-3-butenyl pyrophosphate|3-methylbut-3-en-1-yl trihydrogen diphosphate|3-methylbut-3-enyl phosphono hydrogen phosphate|Diphosphoric acid mono(3-methyl-3-butenyl) ester|IPP|IPPP|Isopentenyl diphosphate|Isopentenyl pyrophosphate|Mono(3-methyl-3-butenyl) diphosphate|delta-3-Isopentenyl pyrophosphate|delta3-Isopentenyl diphosphate|delta3-Methyl-3-butenyl diphosphate|delta3-isopentenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_16584 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16585 biolink:ChemicalEntity L-lombricine The L-enantiomer of lombricine. cas:18416-85-8|kegg.compound:C14177|pubmed:13632802|reaxys:1729501 Graph L-Lombricine|L-Serine, 2-((aminoiminomethyl)amino)ethyl hydrogen phosphate (ester)|Lombricine|O(3)-([2-guanidinoethoxy]phosphono)-L-serine|O-{[2-(carbamimidamido)ethoxy](hydroxy)phosphoryl}-L-serine O-{[2-(carbamimidamido)ethoxy](hydroxy)phosphoryl}-L-serine L-Lombricine|L-Serine, 2-((aminoiminomethyl)amino)ethyl hydrogen phosphate (ester)|Lombricine|O(3)-([2-guanidinoethoxy]phosphono)-L-serine|O-{[2-(carbamimidamido)ethoxy](hydroxy)phosphoryl}-L-serine http://purl.obolibrary.org/obo/CHEBI_16585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16586 biolink:ChemicalEntity 6-aminohexanoic acid An ε-amino acid comprising hexanoic acid carrying an amino substituent at position C-6. Used to control postoperative bleeding, and to treat overdose effects of the thrombolytic agents streptokinase and tissue plasminogen activator. cas:1319-82-0|cas:60-32-2|drugbank:DB00513|drugcentral:163|gmelin:101724|hmdb:HMDB0001901|kegg.compound:C02378|kegg.drug:D00160|lincs.smallmolecule:LSM-5733|lipidmaps:LMFA01100035|metacyc.compound:CPD-884|pdb-ccd:ACA|pubmed:10930630|pubmed:12141409|pubmed:14050038|pubmed:19086806|pubmed:21904257|pubmed:22339947|pubmed:22770225|pubmed:22847395|pubmed:22995453|pubmed:23187124|pubmed:23213034|pubmed:23353035|pubmed:23434921|pubmed:23921838|reaxys:906872|wikipedia.en:Aminocaproic_acid Graph 6-AMINOHEXANOIC ACID|6-Aminocaproic acid|6-Aminohexanoic acid|6-aminohexanoic acid|AMINOCAPROIC|Ahx|Amicar|Amikar|Capralense|Capramol|Caproamin|Caprocid|Caprolisin|EACA|Epsamon|Epsicaprom|Epsicapron|Epsikapron|Epsilcapramin|Epsilcapramine|Epsilon S|Respramin|Z|acide aminocaproque|acido aminocaproico|acidum aminocaproicum|aminocaproic acid|aminohexanoic acid|epsilon-Ahx|epsilon-amino-n-hexanoic acid|epsilon-aminocaproic acid|epsilon-aminohexanoic acid|epsilon-leucine|epsilon-norleucine|omega-aminocaproic acid|omega-aminohexanoic acid 6-AMINOHEXANOIC ACID|6-Aminohexanoic acid|6-aminohexanoic acid 6-AMINOHEXANOIC ACID|6-Aminocaproic acid|6-Aminohexanoic acid|6-aminohexanoic acid|AMINOCAPROIC|Ahx|Amicar|Amikar|Capralense|Capramol|Caproamin|Caprocid|Caprolisin|EACA|Epsamon|Epsicaprom|Epsicapron|Epsikapron|Epsilcapramin|Epsilcapramine|Epsilon S|Respramin|Z|acide aminocaproque|acido aminocaproico|acidum aminocaproicum|aminocaproic acid|aminohexanoic acid|epsilon-Ahx|epsilon-amino-n-hexanoic acid|epsilon-aminocaproic acid|epsilon-aminohexanoic acid|epsilon-leucine|epsilon-norleucine|omega-aminocaproic acid|omega-aminohexanoic acid http://purl.obolibrary.org/obo/CHEBI_16586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16587 biolink:ChemicalEntity 20-hydroxyecdysone An ecdysteroid that is ecdysone substituted by a hydroxy group at position 20. cas:5289-74-7|hmdb:HMDB0030180|kegg.compound:C02633|knapsack:C00003654|lipidmaps:LMST01010209|metacyc.compound:CPD-276|pdb-ccd:20E|pubmed:15609826|pubmed:25593010|pubmed:8748375|reaxys:1917578|wikipedia.en:20-Hydroxyecdysone Graph (22R)-2beta,3beta,14alpha,20,22,25-hexahydroxy-5beta-cholest-7-en-6-one|20-Hydroxyecdysone|20-OH ecdysone|20-hydroxyecdysone|Crustecdysone|Ecdysterone|beta-Ecdysone|beta-Ecdysterone (22R)-2beta,3beta,14alpha,20,22,25-hexahydroxy-5beta-cholest-7-en-6-one (22R)-2beta,3beta,14alpha,20,22,25-hexahydroxy-5beta-cholest-7-en-6-one|20-Hydroxyecdysone|20-OH ecdysone|20-hydroxyecdysone|Crustecdysone|Ecdysterone|beta-Ecdysone|beta-Ecdysterone http://purl.obolibrary.org/obo/CHEBI_16587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16588 biolink:ChemicalEntity D-hamamelose 2(1)-(dihydrogen phosphate) The 21-phospho derivative of D-hamamelose. kegg.compound:C03606 Graph 2-C-[(phosphonooxy)methyl]-D-ribose|D-Hamamelose 2(1)-phosphate 2-C-[(phosphonooxy)methyl]-D-ribose 2-C-[(phosphonooxy)methyl]-D-ribose|D-Hamamelose 2(1)-phosphate http://purl.obolibrary.org/obo/CHEBI_16588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16590 biolink:ChemicalEntity O-feruloylgalactaric acid Galactaric acid in which the hydrogen of one of the alcoholic hydroxy groups has been replaced by a feruloyl group. kegg.compound:C03156 Graph O-Feruloylgalactarate|O-feruloyl-D-galactaric acid O-Feruloylgalactarate|O-feruloyl-D-galactaric acid http://purl.obolibrary.org/obo/CHEBI_16590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16591 biolink:ChemicalEntity all-trans-undecaprenol A long-chain primary fatty alcohol that is the all-trans-isomer of undecaprenol. cas:15575-14-1|kegg.compound:C01968|lipidmaps:LMPR03010007|pubmed:24990652 Graph (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-ol|Undecaprenol|all-trans-undecaprenol (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-ol (2E,6E,10E,14E,18E,22E,26E,30E,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-ol|Undecaprenol|all-trans-undecaprenol http://purl.obolibrary.org/obo/CHEBI_16591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16592 biolink:ChemicalEntity (S)-canadine The (S)-enantiomer of canadine. cas:5096-57-1|kegg.compound:C03329|knapsack:C00028005|pubmed:21661731|reaxys:96684 Graph (13aS)-5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine|(13aS)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|(S)-Canadine|(S)-Tetrahydroberberine|(S)-canadine|canadine l-form (13aS)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline (13aS)-5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine|(13aS)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|(S)-Canadine|(S)-Tetrahydroberberine|(S)-canadine|canadine l-form http://purl.obolibrary.org/obo/CHEBI_16592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16593 biolink:ChemicalEntity L-xylulose 5-phosphate The 5-O-phospho derivative of L-xylulose. drugbank:DB01923|kegg.compound:C03291|knapsack:C00019544|reaxys:21938913 Graph 5-O-phosphono-L-threo-pentos-2-ulose|5-O-phosphono-L-xylulose|L-Xylulose 5-phosphate|L-threo-pentos-2-ulose 5-(dihydrogen phosphate)|L-xylulose 5-(dihydrogen phosphate) L-Xylulose 5-phosphate|L-threo-pentos-2-ulose 5-(dihydrogen phosphate)|L-xylulose 5-(dihydrogen phosphate) 5-O-phosphono-L-threo-pentos-2-ulose|5-O-phosphono-L-xylulose|L-Xylulose 5-phosphate|L-threo-pentos-2-ulose 5-(dihydrogen phosphate)|L-xylulose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16594 biolink:ChemicalEntity 2,4-diaminopentanoate An α-amino-acid anion that is the conjugate base of 2,4-diaminopentanoic acid. Graph 2,4-diaminopentanoate 2,4-diaminopentanoate 2,4-diaminopentanoate http://purl.obolibrary.org/obo/CHEBI_16594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16595 biolink:ChemicalEntity 1D-myo-inositol 1,4,5-trisphosphate beilstein:3658346|cas:85166-31-0|drugbank:DB03401|kegg.compound:C01245|knapsack:C00007460|pdb-ccd:I3P Graph 1,4,5-Insp3|1D-myo-Inositol 1,4,5-trisphosphate|1D-myo-inositol 1,4,5-tris(dihydrogen phosphate)|D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE|D-myo-Inositol 1,4,5-trisphosphate|IP3|Inositol 1,4,5-trisphosphate|Ins(1,4,5)P3|InsP3 1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) 1,4,5-Insp3|1D-myo-Inositol 1,4,5-trisphosphate|1D-myo-inositol 1,4,5-tris(dihydrogen phosphate)|D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE|D-myo-Inositol 1,4,5-trisphosphate|IP3|Inositol 1,4,5-trisphosphate|Ins(1,4,5)P3|InsP3 http://purl.obolibrary.org/obo/CHEBI_16595 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16596 biolink:ChemicalEntity cyanidin 3-O-rutinoside 5-O-beta-D-glucoside An anthocyanin cation that is cyanidin in which the hydroxyl hydrogens at positions 3 and 5 are replaced by rutinosyl and glucosyl residues respectively. cas:135558-26-8|cas:62024-14-0|kegg.compound:C12646|metacyc.compound:CPD-15002 Graph 3-[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside|3-[6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside|Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside 3-[6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside 3-[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside|3-[6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyloxy]-2-(3,4-dihydroxyphenyl)-7-hydroxychromenium-5-yl beta-D-glucopyranoside|Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16597 biolink:ChemicalEntity glycerol 1,2-cyclic phosphate The 1,2-cyclic phosphate derived from glycerol. kegg.compound:C03947 Graph 1,3,2-Dioxaphospholane-4-methanol|4-(hydroxymethyl)-1,3,2-dioxaphospholan-2-ol 2-oxide|Glycerol 1,2-cyclic phosphate 4-(hydroxymethyl)-1,3,2-dioxaphospholan-2-ol 2-oxide 1,3,2-Dioxaphospholane-4-methanol|4-(hydroxymethyl)-1,3,2-dioxaphospholan-2-ol 2-oxide|Glycerol 1,2-cyclic phosphate http://purl.obolibrary.org/obo/CHEBI_16597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16598 biolink:ChemicalEntity DDE A chlorophenylethylene that is ethylene substituted by two 4-chlorophenyl groups at position 1 and two chlorine atoms at position 2. cas:72-55-9|foodb.food:FDB097419|hmdb:HMDB0304759|kegg.compound:C04596|metacyc.compound:DICHLOROBIS-CPD|pdb-ccd:6WS|pmc:PMC7208238|pubmed:11513126|pubmed:15070871|pubmed:15710169|pubmed:20368122|pubmed:22142728|pubmed:23415487|pubmed:24328540|pubmed:28042045|pubmed:31792309|pubmed:32393266|pubmed:33287856|pubmed:33756427|pubmed:35623197|pubmed:37236336|reaxys:1913355|umbbd.compound:c0406|wikipedia.en:Dichlorodiphenyldichloroethylene Graph 1,1'-(2,2-dichloroethene-1,1-diyl)bis(4-chlorobenzene)|1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethylene|1,1-Dichloro-2,2-bis(4-chlorophenyl)ethylene|1,1-bis-(4-chlorophenyl)-2,2-dichloroethene|1,1-dichloro-2,2-bis(4'-chlorophenyl)ethylene|1,1-dichloro-2,2-bis(4-chlorophenyl)ethylene|1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene|2,2'-bis(4-chlorophenyl)-1,1-dichloroethylene|4,4'-DDE|DDE|p,p'-(Dichlorodiphenyl)-2,2-dichloroethylene|p,p'-DDE 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene 1,1'-(2,2-dichloroethene-1,1-diyl)bis(4-chlorobenzene)|1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethylene|1,1-Dichloro-2,2-bis(4-chlorophenyl)ethylene|1,1-bis-(4-chlorophenyl)-2,2-dichloroethene|1,1-dichloro-2,2-bis(4'-chlorophenyl)ethylene|1,1-dichloro-2,2-bis(4-chlorophenyl)ethylene|1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene|2,2'-bis(4-chlorophenyl)-1,1-dichloroethylene|4,4'-DDE|DDE|p,p'-(Dichlorodiphenyl)-2,2-dichloroethylene|p,p'-DDE http://purl.obolibrary.org/obo/CHEBI_16598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16599 biolink:ChemicalEntity 1,2-diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol kegg.compound:C04872 Graph 1,2-Diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol 1,2-Diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_16599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16600 biolink:ChemicalEntity mesaconic acid A dicarboxylic acid consisting of fumaric acid having a methyl substituent at the 2-position. cas:498-24-8|hmdb:HMDB0000749|kegg.compound:C01732|pdb-ccd:MEZ|pubmed:16744171|pubmed:6452974|pubmed:6778884|reaxys:1722680|wikipedia.en:Mesaconic_acid Graph (2E)-2-methylbut-2-enedioic acid|(E)-2-Methyl-2-butenedioic acid|(E)-Citraconic acid|2-methylfumaric acid|Citronic acid|Mesaconic acid|Methylfumaric acid|trans-1-Propene-1,2-dicarboxylic acid|trans-2-Methyl-2-butenedioic acid (2E)-2-methylbut-2-enedioic acid (2E)-2-methylbut-2-enedioic acid|(E)-2-Methyl-2-butenedioic acid|(E)-Citraconic acid|2-methylfumaric acid|Citronic acid|Mesaconic acid|Methylfumaric acid|trans-1-Propene-1,2-dicarboxylic acid|trans-2-Methyl-2-butenedioic acid http://purl.obolibrary.org/obo/CHEBI_16600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16602 biolink:ChemicalEntity trichloroethene A member of the class of chloroethenes that is ethene substituted by chloro groups at positions 1, 1 and 2. cas:79-01-6|drugcentral:3628|gmelin:184631|hmdb:HMDB0029593|kegg.compound:C06790|lincs.smallmolecule:LSM-37096|pdb-ccd:TCV|pubmed:10459493|pubmed:11280697|pubmed:14780843|pubmed:15019957|pubmed:16641322|pubmed:24517489|pubmed:25278505|pubmed:33930529|pubmed:8319644|reaxys:1736782|umbbd.compound:c0009|wikipedia.en:Trichloroethylene Graph 1,1,2-trichloroethene|1,1-dichloro-2-chloroethylene|Narcogen|TCE|Trichloraethen|Trichloraethylen|Trichloroethene|Trichloroethylene|acetylene trichloride|ethinyl trichloride|ethylene trichloride|trichlor|trichloraethylenum pro narcosi|trichlorethylene|trichloroethene|trichloroethylene|trichloroethylenum|triciene 1,1,2-trichloroethene 1,1,2-trichloroethene|1,1-dichloro-2-chloroethylene|Narcogen|TCE|Trichloraethen|Trichloraethylen|Trichloroethene|Trichloroethylene|acetylene trichloride|ethinyl trichloride|ethylene trichloride|trichlor|trichloraethylenum pro narcosi|trichlorethylene|trichloroethene|trichloroethylene|trichloroethylenum|triciene http://purl.obolibrary.org/obo/CHEBI_16602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16603 biolink:ChemicalEntity DIMBOA glucoside A cyclic hydroxamic acid that is DIMBOA attached to a β-D-glucopyranosyl residue at position 2 via a glycosidic linkage. cas:18607-79-9|hmdb:HMDB0029710|kegg.compound:C04831|knapsack:C00001538|pubmed:20218532|pubmed:24254087|reaxys:1230506 Graph 2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one glucoside|2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 2-D-glucoside|4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside|DIMBOA glucoside 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside 2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one glucoside|2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 2-D-glucoside|4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside|DIMBOA glucoside http://purl.obolibrary.org/obo/CHEBI_16603 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16605 biolink:ChemicalEntity allyl alcohol A propenol in which the C=C bond connects C-2 and C-3. It is has been found in garlic (Allium sativum). Formerly used as a herbicide for the control of various grass and weed seeds. cas:107-18-6|hmdb:HMDB0031652|kegg.compound:C02001|metacyc.compound:ALLYL-ALCOHOL|ppdb:2698|pubmed:18383315|pubmed:24594943|reaxys:605307|wikipedia.en:Allyl_alcohol Graph 2-Propen-1-ol|2-Propenol|2-Propenyl alcohol|3-Hydroxypropene|Allyl alcohol|Vinyl carbinol|Vinylcarbinol|allyl alcohol|prop-2-en-1-ol prop-2-en-1-ol 2-Propen-1-ol|2-Propenol|2-Propenyl alcohol|3-Hydroxypropene|Allyl alcohol|Vinyl carbinol|Vinylcarbinol|allyl alcohol|prop-2-en-1-ol http://purl.obolibrary.org/obo/CHEBI_16605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16606 biolink:ChemicalEntity N-benzoyl-4-hydroxyanthranilic acid The N-benzoyl-4-hydroxy derivative of anthranilic acid. beilstein:3354920|cas:85915-70-4|kegg.compound:C04207 Graph 2-(benzoylamino)-4-hydroxybenzoic acid|2-benzamido-4-hydroxybenzoic acid|N-Benzoyl-4-hydroxyanthranilate 2-benzamido-4-hydroxybenzoic acid 2-(benzoylamino)-4-hydroxybenzoic acid|2-benzamido-4-hydroxybenzoic acid|N-Benzoyl-4-hydroxyanthranilate http://purl.obolibrary.org/obo/CHEBI_16606 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16607 biolink:ChemicalEntity 4-aminoimidazole An aminoimidazole that is 1H-imidazole substituted by an amino group at position 4. cas:4919-03-3|hmdb:HMDB0003929|kegg.compound:C05239|metacyc.compound:CPD-54|reaxys:1617 Graph 1H-imidazol-4-amine|4-Aminoimidazole|4-aminoimidazole|5-Aminoimidazole 1H-imidazol-4-amine 1H-imidazol-4-amine|4-Aminoimidazole|4-aminoimidazole|5-Aminoimidazole http://purl.obolibrary.org/obo/CHEBI_16607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16608 biolink:ChemicalEntity 5alpha-cholest-8-en-3beta-ol A cholestanoid that is 5α-cholestane substituted by a β-hydroxy group at position 3. cas:566-97-2|hmdb:HMDB0006841|kegg.compound:C03845|lipidmaps:LMST01010096|metacyc.compound:CPD-8621|pubmed:5642322|reaxys:2337227 Graph (5alpha)-cholest-8-en-3beta-ol|5-alpha-cholest-8-en-3-beta-ol|5alpha-Cholest-8-en-3beta-ol|5alpha-cholest-8-en-3beta-ol|Cholestenol|Zymostenol (5alpha)-cholest-8-en-3beta-ol (5alpha)-cholest-8-en-3beta-ol|5-alpha-cholest-8-en-3-beta-ol|5alpha-Cholest-8-en-3beta-ol|5alpha-cholest-8-en-3beta-ol|Cholestenol|Zymostenol http://purl.obolibrary.org/obo/CHEBI_16608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16609 biolink:ChemicalEntity 2-dehydro-D-glucopyranose The 2-dehydro derivative of D-glucose. kegg.compound:C02779 Graph 2-Dehydro-D-glucose|2-dehydro-D-glucose|D-arabino-hexopyranos-2-ulose D-arabino-hexopyranos-2-ulose 2-Dehydro-D-glucose|2-dehydro-D-glucose|D-arabino-hexopyranos-2-ulose http://purl.obolibrary.org/obo/CHEBI_16609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16610 biolink:ChemicalEntity spermidine A triamine that is the 1,5,10-triaza derivative of decane. cas:124-20-9|drugbank:DB03566|gmelin:454510|hmdb:HMDB0001257|kegg.compound:C00315|knapsack:C00001431|lincs.smallmolecule:LSM-37075|metacyc.compound:SPERMIDINE|pdb-ccd:SPD|pubmed:1176793|pubmed:19801973|pubmed:22770225|pubmed:30306826|pubmed:516181|pubmed:6156039|pubmed:7350997|reaxys:1698591|wikipedia.en:Spermidine Graph 1,5,10-triazadecane|4-azaoctamethylenediamine|4-azaoctane-1,8-diamine|N-(3-Aminopropyl)-1,4-butane-diamine|N-(3-aminopropyl)butane-1,4-diamine|SPERMIDINE|Spermidin|Spermidine N-(3-aminopropyl)butane-1,4-diamine 1,5,10-triazadecane|4-azaoctamethylenediamine|4-azaoctane-1,8-diamine|N-(3-Aminopropyl)-1,4-butane-diamine|N-(3-aminopropyl)butane-1,4-diamine|SPERMIDINE|Spermidin|Spermidine http://purl.obolibrary.org/obo/CHEBI_16610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16613 biolink:ChemicalEntity glutathionylspermidine The spermidine amide of glutathione. beilstein:6540906|cas:33932-35-3|drugbank:DB03295|kegg.compound:C05730 Graph Glutathionylspermidine|L-gamma-glutamyl-L-cysteinyl-N-{3-[(4-aminobutyl)amino]propyl}glycinamide|N1-(gamma-L-Glutamyl-L-cysteinyl-glycyl)-spermidine L-gamma-glutamyl-L-cysteinyl-N-{3-[(4-aminobutyl)amino]propyl}glycinamide Glutathionylspermidine|L-gamma-glutamyl-L-cysteinyl-N-{3-[(4-aminobutyl)amino]propyl}glycinamide|N1-(gamma-L-Glutamyl-L-cysteinyl-glycyl)-spermidine http://purl.obolibrary.org/obo/CHEBI_16613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16615 biolink:ChemicalEntity biotin amide A monocarboxylic acid amide derived from biotin. cas:6929-42-6|hmdb:HMDB0001458|kegg.compound:C01893|metacyc.compound:CPD-574|pubmed:25185752|pubmed:25380190|reaxys:86836 Graph 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide|Biotin amide|biotin amide|biotinamide 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide|Biotin amide|biotin amide|biotinamide http://purl.obolibrary.org/obo/CHEBI_16615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16616 biolink:ChemicalEntity 2-methylpropanal O-methyloxime An oxime O-ether that is 2-methylpropan-1-imine substituted by a methoxy group at the nitrogen atom. cas:72705-01-2|kegg.compound:C03982|metacyc.compound:2-METHYLPROPANAL-O-METHYLOXIME|reaxys:8477792 Graph 2-Methylpropanal O-methyloxime|2-methylpropanal O-methyloxime|Isobutyraldoxime O-methyl ether|N-methoxy-2-methylpropan-1-imine N-methoxy-2-methylpropan-1-imine 2-Methylpropanal O-methyloxime|2-methylpropanal O-methyloxime|Isobutyraldoxime O-methyl ether|N-methoxy-2-methylpropan-1-imine http://purl.obolibrary.org/obo/CHEBI_16616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16617 biolink:ChemicalEntity 1-acylglycerophosphoinositol A glycerophosphoinositol acylated at O1 of the glycerol moiety. Graph 1-acylglycerophosphoinositols 1-acylglycerophosphoinositols http://purl.obolibrary.org/obo/CHEBI_16617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16618 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate kegg.compound:C05981|metacyc.compound:PHOSPHATIDYLINOSITOL-345-TRIPHOSPHATE Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4,5-tris(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate|PIP3|Phosphatidylinositol-3,4,5-trisphosphate|PtsIns(3,4,5)P3|PtsIns-3,4,5-P3 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4,5-tris(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',4',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,4,5-tris(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate|PIP3|Phosphatidylinositol-3,4,5-trisphosphate|PtsIns(3,4,5)P3|PtsIns-3,4,5-P3 http://purl.obolibrary.org/obo/CHEBI_16618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16619 biolink:ChemicalEntity (2-trans,6-trans)-farnesol The (2-trans,6-trans)-stereoisomer of farnesol. bpdb:2113|cas:106-28-5|gmelin:2210148|hmdb:HMDB0004305|kegg.compound:C01126|knapsack:C00003132|lipidmaps:LMPR0103010001|metacyc.compound:2-TRANS6-TRANS-FARNESOL|reaxys:1723039 Graph (2-trans,6-trans)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2E,6E)-Farnesol|(2E,6E)-farnesol|(E)-farnesol|(E,E)-farnesol|2-trans,6-trans-Farnesol|all-trans-farnesol|trans,trans-alpha-farnesol|trans,trans-farnesol|trans-Farnesol|trans-farnesol (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol (2-trans,6-trans)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2E,6E)-Farnesol|(2E,6E)-farnesol|(E)-farnesol|(E,E)-farnesol|2-trans,6-trans-Farnesol|all-trans-farnesol|trans,trans-alpha-farnesol|trans,trans-farnesol|trans-Farnesol|trans-farnesol http://purl.obolibrary.org/obo/CHEBI_16619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16621 biolink:ChemicalEntity N-phosphotaurocyamine The N-phospho derivative of taurocyamine. beilstein:1802377|cas:4189-99-5|kegg.compound:C03149 Graph 2-{[imino(phosphonoamino)methyl]amino}ethanesulfonic acid|N(omega)-Phosphotaurocyamine|N-Phosphotaurocyamine|Phosphotaurocyamine|Taurocyamine phosphate|Taurocyaminphosphate 2-{[imino(phosphonoamino)methyl]amino}ethanesulfonic acid 2-{[imino(phosphonoamino)methyl]amino}ethanesulfonic acid|N(omega)-Phosphotaurocyamine|N-Phosphotaurocyamine|Phosphotaurocyamine|Taurocyamine phosphate|Taurocyaminphosphate http://purl.obolibrary.org/obo/CHEBI_16621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16622 biolink:ChemicalEntity 3-dehydro-2-deoxy-D-gluconic acid The 3-dehydro-2-deoxy derivative of D-gluconic acid. kegg.compound:C03926 Graph 2-deoxy-D-erythro-hex-3-ulosonic acid|3-Dehydro-2-deoxy-D-gluconate|3-dehydro-2-deoxy-D-gluconate 2-deoxy-D-erythro-hex-3-ulosonic acid 2-deoxy-D-erythro-hex-3-ulosonic acid|3-Dehydro-2-deoxy-D-gluconate|3-dehydro-2-deoxy-D-gluconate http://purl.obolibrary.org/obo/CHEBI_16622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16624 biolink:ChemicalEntity Leu-tRNA(Leu) kegg.compound:C02047 Graph L-Leucyl-tRNA|L-Leucyl-tRNA(Leu)|Leu-tRNA(Leu) L-Leucyl-tRNA|L-Leucyl-tRNA(Leu)|Leu-tRNA(Leu) http://purl.obolibrary.org/obo/CHEBI_16624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16625 biolink:ChemicalEntity methylmalonyl-CoA A member of the class of malonyl-CoAs that is malonyl-CoA carrying a methyl group on the malony side chain. cas:1264-45-5|hmdb:HMDB0001269|kegg.compound:C02557|metacyc.compound:Methylmalonyl-CoA|pdb-ccd:MCA|pubmed:24329397|pubmed:24568291|reaxys:78364|wikipedia.en:Methylmalonyl-CoA Graph 2-Methylmalonyl-CoA|2-methyl-3-oxopropanoyl-CoAs|2-methylmalonyl-CoA|3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate]|Methylmalonyl coemzyme A|Methylmalonyl coenzyme A|Methylmalonyl-CoA|methylmalonyl coenzyme A 3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate] 2-Methylmalonyl-CoA|2-methyl-3-oxopropanoyl-CoAs|2-methylmalonyl-CoA|3'-phosphoadenosine 5'-[3-(3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxopropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl) dihydrogen diphosphate]|Methylmalonyl coemzyme A|Methylmalonyl coenzyme A|Methylmalonyl-CoA|methylmalonyl coenzyme A http://purl.obolibrary.org/obo/CHEBI_16625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16628 biolink:ChemicalEntity methylguanidine A guanidine in which one of the amino hydrogens of guanidine itself is substituted by a methyl group. cas:471-29-4|gmelin:323399|hmdb:HMDB0001522|kegg.compound:C02294|metacyc.compound:CPD-593|patent:PL391702|pdb-ccd:MGX|pubmed:14744621|pubmed:17190852|pubmed:17409514|pubmed:19286340|pubmed:21090628|pubmed:22342614|reaxys:1738993 Graph 1-METHYLGUANIDINE|1-methylguanidine|MGX|Methylguanidin|Methylguanidine|Monomethyl guanidin|N-methylguanidine|N1-Methylguanidine|monomethylguanidine 1-METHYLGUANIDINE|1-methylguanidine 1-METHYLGUANIDINE|1-methylguanidine|MGX|Methylguanidin|Methylguanidine|Monomethyl guanidin|N-methylguanidine|N1-Methylguanidine|monomethylguanidine http://purl.obolibrary.org/obo/CHEBI_16628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16629 biolink:ChemicalEntity 4-amino-2-methyl-5-diphosphooxymethylpyrimidine An aminopyrimidine that is pyrimidin-4-amine substituted by a methyl group at position 2 and a diphosphooxymethyl group at position 5. kegg.compound:C04752|knapsack:C00007609|metacyc.compound:AMINO-HYDROXYMETHYL-METHYLPYRIMIDINE-PP|reaxys:763592 Graph (4-amino-2-methylpyrimidin-5-yl)methyl trihydrogen diphosphate|2-Methyl-4-amino-5-hydroxymethylpyrimidine diphosphate|4-Amino-2-methyl-5-diphosphomethylpyrimidine (4-amino-2-methylpyrimidin-5-yl)methyl trihydrogen diphosphate (4-amino-2-methylpyrimidin-5-yl)methyl trihydrogen diphosphate|2-Methyl-4-amino-5-hydroxymethylpyrimidine diphosphate|4-Amino-2-methyl-5-diphosphomethylpyrimidine http://purl.obolibrary.org/obo/CHEBI_16629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16630 biolink:ChemicalEntity 3-dehydroshikimate A monocarboxylic acid anion that is the conjugate base of 3-dehydroshikimic acid, arising from deprotonation of the carboxy group. beilstein:2938338|kegg.compound:C02637|metacyc.compound:3-DEHYDRO-SHIKIMATE Graph (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylate|3-dehydroshikimate (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylate (4S,5R)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylate|3-dehydroshikimate http://purl.obolibrary.org/obo/CHEBI_16630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16631 biolink:ChemicalEntity vitexin 2''-O-beta-D-glucoside A disaccharide derivative that is the 2''-O-glucosyl derivative of vitexin. cas:61360-94-9|kegg.compound:C04024|knapsack:C00006392|lipidmaps:LMPK12110248|pubmed:23312385|reaxys:6997398 Graph (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-2-O-beta-D-glucopyranosyl-D-glucitol|2''-O-Glucosylvitexin|Flavosativaside|Vitexin 2''-O-beta-D-glucoside (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-2-O-beta-D-glucopyranosyl-D-glucitol (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-2-O-beta-D-glucopyranosyl-D-glucitol|2''-O-Glucosylvitexin|Flavosativaside|Vitexin 2''-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16632 biolink:ChemicalEntity vanillate A methoxybenzoate that is the conjugate base of vanillic acid. drugbank:DB08711|kegg.compound:C06672|pdb-ccd:VNL|reaxys:6504377|umbbd.compound:c0194 Graph 4-HYDROXY-3-METHOXYBENZOATE|4-hydroxy-3-methoxybenzoate|vanillate 4-HYDROXY-3-METHOXYBENZOATE|4-hydroxy-3-methoxybenzoate 4-HYDROXY-3-METHOXYBENZOATE|4-hydroxy-3-methoxybenzoate|vanillate http://purl.obolibrary.org/obo/CHEBI_16632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16633 biolink:ChemicalEntity L-selenocysteine The L-enantiomer of selenocysteine. cas:10236-58-5|ecmdb:ECMDB03288|hmdb:HMDB0003288|kegg.compound:C05688|metacyc.compound:L-SELENOCYSTEINE|pdb-ccd:SEC|pubmed:11733012|pubmed:18429173|reaxys:2498378|wikipedia.en:Selenocysteine Graph (2R)-2-amino-3-selanylpropanoic acid|3-selenyl-L-alanine|L-Selenocystein|L-Selenocysteine|L-Selenozystein|SELENOCYSTEINE|Selenocysteine (2R)-2-amino-3-selanylpropanoic acid (2R)-2-amino-3-selanylpropanoic acid|3-selenyl-L-alanine|L-Selenocystein|L-Selenocysteine|L-Selenozystein|SELENOCYSTEINE|Selenocysteine http://purl.obolibrary.org/obo/CHEBI_16633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16634 biolink:ChemicalEntity raffinose A trisaccharide composed of α-D-galactopyranose, α-D-glucopyranose and β-D-fructofuranose joined in sequence by 1→6 and 1↔2 glycosidic linkages, respectively. cas:512-69-6|hmdb:HMDB0003213|kegg.compound:C00492|kegg.glycan:G00249|knapsack:C00001145|metacyc.compound:CPD-1099|pdb-ccd:RAF|pubmed:23317449|pubmed:23879777|pubmed:23882273|pubmed:24001862|pubmed:24354450|pubmed:24360500|reaxys:99543|wikipedia.en:Raffinose Graph 6G-alpha-D-galactosylsucrose|Gossypose|Melitose|Melitriose|Raffinose|alpha-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranosyl beta-D-fructofuranoside|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside|raffinose|rafinose|raflinose beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside 6G-alpha-D-galactosylsucrose|Gossypose|Melitose|Melitriose|Raffinose|alpha-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranosyl beta-D-fructofuranoside|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside|raffinose|rafinose|raflinose http://purl.obolibrary.org/obo/CHEBI_16634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16635 biolink:ChemicalEntity Met-tRNA(Met) kegg.compound:C02430|pubmed:5036974 Graph L-Methionyl-tRNA|L-Methionyl-tRNA(Met)|Met-tRNA(Met) L-Methionyl-tRNA|L-Methionyl-tRNA(Met)|Met-tRNA(Met) http://purl.obolibrary.org/obo/CHEBI_16635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16638 biolink:ChemicalEntity 3-methylbutanal A methylbutanal that is butanal substituted by a methyl group at position 3. It occurs as a volatile constituent in olives. cas:590-86-3|hmdb:HMDB0006478|kegg.compound:C07329|metacyc.compound:CPD-7031|pubmed:23182362|pubmed:24295708|reaxys:773692|wikipedia.en:Isovaleraldehyde Graph 3-Methylbutanal|3-methylbutanal|3-methylbutyraldehyde|Isoamyl aldehyde|Isopentaldehyde|Isovaleral|Isovaleraldehyde|Isovalerylaldehyde|beta-Methylbutanal|iso-C4H9CHO 3-Methylbutanal|3-methylbutanal 3-Methylbutanal|3-methylbutanal|3-methylbutyraldehyde|Isoamyl aldehyde|Isopentaldehyde|Isovaleral|Isovaleraldehyde|Isovalerylaldehyde|beta-Methylbutanal|iso-C4H9CHO http://purl.obolibrary.org/obo/CHEBI_16638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16639 biolink:ChemicalEntity 4-methoxybenzoate A methoxybenzoate that is the conjugate base of 4-methoxybenzoic acid. gmelin:327894|kegg.compound:C02519|reaxys:3905126|umbbd.compound:c0370 Graph 4-methoxybenzoate|p-methoxybenzoate 4-methoxybenzoate 4-methoxybenzoate|p-methoxybenzoate http://purl.obolibrary.org/obo/CHEBI_16639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16641 biolink:ChemicalEntity ethyl (R)-3-hydroxyhexanoate The (R)-enantiomer of ethyl 3-hydroxyhexanoate. kegg.compound:C03864|reaxys:3601638 Graph Ethyl (R)-3-hydroxyhexanoate|ethyl (3R)-3-hydroxyhexanoate|ethyl (R)-3-hydroxyhexanoate ethyl (3R)-3-hydroxyhexanoate Ethyl (R)-3-hydroxyhexanoate|ethyl (3R)-3-hydroxyhexanoate|ethyl (R)-3-hydroxyhexanoate http://purl.obolibrary.org/obo/CHEBI_16641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16643 biolink:ChemicalEntity L-methionine The L-enantiomer of methionine. cas:63-68-3|drugbank:DB00134|drugcentral:3347|ecmdb:ECMDB00696|gmelin:26935|hmdb:HMDB0000696|kegg.compound:C00073|kegg.drug:D00019|knapsack:C00001379|metacyc.compound:MET|pdb-ccd:MET_LFOH|pubmed:16575097|pubmed:21683740|pubmed:21946918|pubmed:22200379|pubmed:22370952|pubmed:22448874|pubmed:22517898|pubmed:24126240|pubmed:24939187|pubmed:5764336|reaxys:1722294|ymdb:YMDB00318 Graph (2S)-2-amino-4-(methylsulfanyl)butanoic acid|(S)-2-amino-4-(methylthio)butanoic acid|(S)-2-amino-4-(methylthio)butyric acid|(S)-methionine|L-(-)-methionine|L-Methionin|L-Methionine|L-alpha-amino-gamma-methylmercaptobutyric acid|L-methionine|M|METHIONINE|Met|Methionine L-Methionine|L-methionine|METHIONINE (2S)-2-amino-4-(methylsulfanyl)butanoic acid|(S)-2-amino-4-(methylthio)butanoic acid|(S)-2-amino-4-(methylthio)butyric acid|(S)-methionine|L-(-)-methionine|L-Methionin|L-Methionine|L-alpha-amino-gamma-methylmercaptobutyric acid|L-methionine|M|METHIONINE|Met|Methionine http://purl.obolibrary.org/obo/CHEBI_16643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16645 biolink:ChemicalEntity preuroporphyrinogen beilstein:1209089|cas:71861-60-4|cas:73023-76-4|kegg.compound:C01024|knapsack:C00007374 Graph (hydroxymethyl)bilane|3,8,13,18-tetrakis(carboxymethyl)-19-(hydroxymethyl)bilane-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid|Hydroxymethylbilane|preuroporphyrinogen 3,8,13,18-tetrakis(carboxymethyl)-19-(hydroxymethyl)bilane-2,7,12,17-tetrapropanoic acid (hydroxymethyl)bilane|3,8,13,18-tetrakis(carboxymethyl)-19-(hydroxymethyl)bilane-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid|Hydroxymethylbilane|preuroporphyrinogen http://purl.obolibrary.org/obo/CHEBI_16645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16646 biolink:ChemicalEntity carbohydrate Any member of the class of organooxygen compounds that is a polyhydroxy-aldehyde or -ketone or a lactol resulting from their intramolecular condensation (monosaccharides); substances derived from these by reduction of the carbonyl group (alditols), by oxidation of one or more hydroxy groups to afford the corresponding aldehydes, ketones, or carboxylic acids, or by replacement of one or more hydroxy group(s) by a hydrogen atom; and polymeric products arising by intermolecular acetal formation between two or more such molecules (disaccharides, polysaccharides and oligosaccharides). Carbohydrates contain only carbon, hydrogen and oxygen atoms; prior to any oxidation or reduction, most have the empirical formula Cm(H2O)n. Compounds obtained from carbohydrates by substitution, etc., are known as carbohydrate derivatives and may contain other elements. Cyclitols are generally not regarded as carbohydrates. wikipedia.en:Carbohydrate Graph Kohlenhydrat|Kohlenhydrate|a carbohydrate|carbohidrato|carbohidratos|carbohydrate|carbohydrates|glucide|glucides|glucido|glucidos|hydrates de carbone|saccharide|saccharides|saccharidum carbohydrate|carbohydrates Kohlenhydrat|Kohlenhydrate|a carbohydrate|carbohidrato|carbohidratos|carbohydrate|carbohydrates|glucide|glucides|glucido|glucidos|hydrates de carbone|saccharide|saccharides|saccharidum http://purl.obolibrary.org/obo/CHEBI_16646 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16647 biolink:ChemicalEntity L-fuculose 1-phosphate The 1-O-phospho derivative of L-fuculose. beilstein:1881578|kegg.compound:C01099|knapsack:C00019651 Graph 6-deoxy-1-O-phosphono-L-tagatose|6-deoxy-L-lyxo-hex-2-ulose 1-(dihydrogen phosphate)|6-deoxy-L-tagatose 1-(dihydrogen phosphate) 6-deoxy-L-lyxo-hex-2-ulose 1-(dihydrogen phosphate)|6-deoxy-L-tagatose 1-(dihydrogen phosphate) 6-deoxy-1-O-phosphono-L-tagatose|6-deoxy-L-lyxo-hex-2-ulose 1-(dihydrogen phosphate)|6-deoxy-L-tagatose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16648 biolink:ChemicalEntity dialkyl phosphate Graph dialkyl phosphates dialkyl phosphates http://purl.obolibrary.org/obo/CHEBI_16648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16650 biolink:ChemicalEntity UDP-N-acetyl-D-galactosamine A UDP-sugar having N-acetyl-D-galactosamine as the sugar component. kegg.glycan:G10611|pdb-ccd:UD2 Graph UDP-N-acetyl-D-galactosamine|Uridine 5'-(trihydrogen diphosphate), P'-(2-(acetylamino)-2-deoxy-alpha-D-galactopyranosyl) ester|Uridine diphosphate N-acetylgalactosamine|uridine 5'-[3-(2-acetamido-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] UDP-N-acetyl-D-galactosamine|Uridine 5'-(trihydrogen diphosphate), P'-(2-(acetylamino)-2-deoxy-alpha-D-galactopyranosyl) ester|Uridine diphosphate N-acetylgalactosamine|uridine 5'-[3-(2-acetamido-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16651 biolink:ChemicalEntity (S)-lactate An optically active form of lactate having (S)-configuration. gmelin:324523|kegg.compound:C00186|metacyc.compound:L-LACTATE|reaxys:4655977|umbbd.compound:c0152 Graph (+)-lactate|(2S)-2-hydroxypropanoate|(S)-lactate|L(+)-lactate|L-(+)-lactate|L-lactate (2S)-2-hydroxypropanoate (+)-lactate|(2S)-2-hydroxypropanoate|(S)-lactate|L(+)-lactate|L-(+)-lactate|L-lactate http://purl.obolibrary.org/obo/CHEBI_16651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16652 biolink:ChemicalEntity 1,4-diguanidinobutane A guanidine derivative consisting of butane having guanidino groups at the 1- and 4-positions. cas:544-05-8|kegg.compound:C03047|lincs.smallmolecule:LSM-6692 Graph 1,1'-(butane-1,4-diyl)diguanidine|1,4-Diguanidinobutane|Arcaine|N,N'''-1,4-Butanediylbisguanidine|Tetramethylenediguanide 1,1'-(butane-1,4-diyl)diguanidine 1,1'-(butane-1,4-diyl)diguanidine|1,4-Diguanidinobutane|Arcaine|N,N'''-1,4-Butanediylbisguanidine|Tetramethylenediguanide http://purl.obolibrary.org/obo/CHEBI_16652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16653 biolink:ChemicalEntity cycloeucalenol cas:469-39-6|kegg.compound:C02141|knapsack:C00007367 Graph 3beta,4alpha,5alpha-4,14-dimethyl-9,19-cycloergost-24(28)-en-3-ol|4alpha,14-dimethyl-9beta,19-cyclo-5alpha-ergost-24(28)-en-3beta-ol|Cycloeucalenol|cycloeucalenol|cycloleucalenol 4alpha,14-dimethyl-9beta,19-cyclo-5alpha-ergost-24(28)-en-3beta-ol 3beta,4alpha,5alpha-4,14-dimethyl-9,19-cycloergost-24(28)-en-3-ol|4alpha,14-dimethyl-9beta,19-cyclo-5alpha-ergost-24(28)-en-3beta-ol|Cycloeucalenol|cycloeucalenol|cycloleucalenol http://purl.obolibrary.org/obo/CHEBI_16653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16654 biolink:ChemicalEntity (R)-4-dehydropantoic acid The 4-dehydro derivative of (R)-pantoic acid. kegg.compound:C01053 Graph (2R)-2-hydroxy-3,3-dimethyl-4-oxobutanoic acid|(R)-4-Dehydropantoate|(R)-4-dehydropantoate (2R)-2-hydroxy-3,3-dimethyl-4-oxobutanoic acid (2R)-2-hydroxy-3,3-dimethyl-4-oxobutanoic acid|(R)-4-Dehydropantoate|(R)-4-dehydropantoate http://purl.obolibrary.org/obo/CHEBI_16654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16655 biolink:ChemicalEntity N-acetyl-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-D-galactosamine kegg.compound:C01310 Graph 2-acetamido-2-deoxy-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine|4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 2-acetamido-2-deoxy-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid 2-acetamido-2-deoxy-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine|4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine http://purl.obolibrary.org/obo/CHEBI_16655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16656 biolink:ChemicalEntity tropinone beilstein:1524439|beilstein:4658547|cas:532-24-1|drugbank:DB01874|gmelin:1568090|kegg.compound:C00783|pdb-ccd:TNE Graph (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-one|1alphaH,5alphaH-tropan-3-one|3-Tropanone|3-tropinone|8-METHYL-8-AZABICYCLO[3,2,1]OCTAN-3-ONE|8-methyl-8-azabicyclo[3.2.1]octan-3-one|N-methyl-8-azabicyclo[3.2.1]octan-3-one|Tropinon|Tropinone|tropan-3-one tropan-3-one (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-one|1alphaH,5alphaH-tropan-3-one|3-Tropanone|3-tropinone|8-METHYL-8-AZABICYCLO[3,2,1]OCTAN-3-ONE|8-methyl-8-azabicyclo[3.2.1]octan-3-one|N-methyl-8-azabicyclo[3.2.1]octan-3-one|Tropinon|Tropinone|tropan-3-one http://purl.obolibrary.org/obo/CHEBI_16656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16658 biolink:ChemicalEntity flavonol 3-O-[beta-D-xylosyl-(1->2)-beta-D-glycoside]s Any glycosyloxyflavone that consists of a flavonol attached to a xylosylglycosyl residue at position 3 via a glycosidic linkage. kegg.compound:C04069 Graph Flavonol 3-O-D-xylosylglycoside|Flavonol 3-O-[D-xylosyl-(1->2)-beta-D-glycoside]|Flavonol 3-[beta-D-xylosyl-(1->2)-beta-D-glycoside]|a flavonol 3-O-(beta-D-xylosyl-(1->2)-beta-D-glycoside)|flavonol 3-O-[beta-D-xylosyl-(1->2)-beta-D-glycoside] Flavonol 3-O-D-xylosylglycoside|Flavonol 3-O-[D-xylosyl-(1->2)-beta-D-glycoside]|Flavonol 3-[beta-D-xylosyl-(1->2)-beta-D-glycoside]|a flavonol 3-O-(beta-D-xylosyl-(1->2)-beta-D-glycoside)|flavonol 3-O-[beta-D-xylosyl-(1->2)-beta-D-glycoside] http://purl.obolibrary.org/obo/CHEBI_16658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166589 biolink:ChemicalEntity Dicyclohexyl disulfide cas:2550-40-5|chemspider:16423|hmdb:HMDB0041448 Graph (cyclohexyldisulanyl)cyclohexane (cyclohexyldisulanyl)cyclohexane (cyclohexyldisulanyl)cyclohexane http://purl.obolibrary.org/obo/CHEBI_166589 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16659 biolink:ChemicalEntity D-glycerate A glycerate that is the conjugate base of D-glyceric acid, obtained by deprotonation of the carboxy group. gmelin:1146853|hmdb:HMDB0000139|kegg.compound:C00258|metacyc.compound:GLYCERATE|reaxys:6114954 Graph (2R)-2,3-dihydroxypropanoate|(R)-glycerate|(R)-glycerate anion|alpha,beta-Hydroxypropionate (2R)-2,3-dihydroxypropanoate (2R)-2,3-dihydroxypropanoate|(R)-glycerate|(R)-glycerate anion|alpha,beta-Hydroxypropionate http://purl.obolibrary.org/obo/CHEBI_16659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166596 biolink:ChemicalEntity Nitecapone cas:116313-94-1|chemspider:4576539|hmdb:HMDB0041949|kegg.drug:D03241|pdb-ccd:EAO Graph 3-[(3,4-dihydroxy-5-nitrophenyl)methylidene]pentane-2,4-dione 3-[(3,4-dihydroxy-5-nitrophenyl)methylidene]pentane-2,4-dione 3-[(3,4-dihydroxy-5-nitrophenyl)methylidene]pentane-2,4-dione http://purl.obolibrary.org/obo/CHEBI_166596 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16660 biolink:ChemicalEntity (S)-4-hydroxymandelonitrile A 4-hydroxymandelonitrile that has (S)-configuration. cas:13093-65-7|drugbank:DB03430|kegg.compound:C03742|pdb-ccd:DHR|reaxys:3589471 Graph (2S)-hydroxy(4-hydroxyphenyl)acetonitrile|(S)-4-Hydroxymandelonitrile|(S)-4-hydroxymandelonitrile (2S)-hydroxy(4-hydroxyphenyl)acetonitrile (2S)-hydroxy(4-hydroxyphenyl)acetonitrile|(S)-4-Hydroxymandelonitrile|(S)-4-hydroxymandelonitrile http://purl.obolibrary.org/obo/CHEBI_16660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16663 biolink:ChemicalEntity poly-cis-polyprenyl diphosphate Any polyprenol diphosphate in which all of the tetrasubstituted C=C double bonds have cis configuration. kegg.compound:C04093 Graph poly-cis-polyprenyl diphosphates poly-cis-polyprenyl diphosphates http://purl.obolibrary.org/obo/CHEBI_16663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16664 biolink:ChemicalEntity albendazole A carbamate ester that is methyl 1H-benzimidazol-2-ylcarbamate substituted by a propylsulfanyl group at position 5. It is commonly used in the treatment of parasitic worm infestations. cas:54965-21-8|drugbank:DB00518|drugcentral:103|hmdb:HMDB0014659|kegg.compound:C01779|kegg.drug:D00134|lincs.smallmolecule:LSM-3782|metacyc.compound:ALBENDAZOLE|pesticides:albendazole|pubmed:22152396|pubmed:24403707|pubmed:24411094|reaxys:752696|vsdb:895|wikipedia.en:Albendazole Graph (5-(propylthio)-1H-benzimidazol-2-yl)carbamic acid methyl ester|5-(propylthio)-2-carbomethoxyaminobenzimidazole|Albendazole|Albenza|Eskazole|O-methyl N-(5-(propylthio)-2-benzimidazolyl)carbamate|Proftril|Valbazen|Zentel|albendazole|methyl [5-(propylsulfanyl)-1H-benzimidazol-2-yl]carbamate methyl [5-(propylsulfanyl)-1H-benzimidazol-2-yl]carbamate (5-(propylthio)-1H-benzimidazol-2-yl)carbamic acid methyl ester|5-(propylthio)-2-carbomethoxyaminobenzimidazole|Albendazole|Albenza|Eskazole|O-methyl N-(5-(propylthio)-2-benzimidazolyl)carbamate|Proftril|Valbazen|Zentel|albendazole|methyl [5-(propylsulfanyl)-1H-benzimidazol-2-yl]carbamate http://purl.obolibrary.org/obo/CHEBI_16664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16666 biolink:ChemicalEntity prephenic acid An oxo dicarboxylic acid that consists of 4-hydroxycyclohexa-2,5-diene-1-carboxylic acid substituted by a 2-carboxy-2-oxoethyl group at position 1. agr:IND44654981|cas:126-49-8|drugbank:DB08427|hmdb:HMDB0012283|knapsack:C00019632|pdb-ccd:PRE|pubmed:1156090|pubmed:13363412|pubmed:14185725|pubmed:155813|reaxys:2698270|wikipedia.en:Prephenic_acid Graph 1-Carboxy-4-hydroxy-2,5-cyclohexadiene-1-pyruvic acid|1-carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid|PREPHENIC ACID|Prephenic acid 1-Carboxy-4-hydroxy-2,5-cyclohexadiene-1-pyruvic acid|1-carboxy-4-hydroxy-alpha-oxo-2,5-cyclohexadiene-1-propanoic acid|PREPHENIC ACID|Prephenic acid http://purl.obolibrary.org/obo/CHEBI_16666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16667 biolink:ChemicalEntity (4-hydroxyphenyl)acetonitrile A hydroxynitrile that is phenylacetonitrile substituted by a hydroxy group at position 4. cas:14191-95-8|hmdb:HMDB0029757|kegg.compound:C03766|knapsack:C00029532|metacyc.compound:CPD-1074|pubmed:9677329|reaxys:1934470 Graph (4-hydroxyphenyl)acetonitrile|4-Hydroxybenzeneacetonitrile|4-Hydroxybenzyl cyanide|4-Hydroxybenzylcyanide|4-Hydroxyphenylacetonitrile|4-hydroxyphenylacetic acid nitrile|4-hydroxyphenylacetonitrile (4-hydroxyphenyl)acetonitrile (4-hydroxyphenyl)acetonitrile|4-Hydroxybenzeneacetonitrile|4-Hydroxybenzyl cyanide|4-Hydroxybenzylcyanide|4-Hydroxyphenylacetonitrile|4-hydroxyphenylacetic acid nitrile|4-hydroxyphenylacetonitrile http://purl.obolibrary.org/obo/CHEBI_16667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16668 biolink:ChemicalEntity hypotaurine An aminosulfinic acid comprising ethylamine having the sulfo group at the 2-position. cas:300-84-5|hmdb:HMDB0000965|kegg.compound:C00519|metacyc.compound:HYPOTAURINE|pubmed:22735334|reaxys:1743127|wikipedia.en:Hypotaurine Graph 2-Aminoethanesulfinic acid|2-aminoethanesulfinic acid|Hypotaurine 2-Aminoethanesulfinic acid|2-aminoethanesulfinic acid 2-Aminoethanesulfinic acid|2-aminoethanesulfinic acid|Hypotaurine http://purl.obolibrary.org/obo/CHEBI_16668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16669 biolink:ChemicalEntity 5-dehydro-2-deoxy-D-gluconate metacyc.compound:CPD-827 Graph 2-deoxy-D-threo-hex-5-ulosonate|5-Dehydro-2-deoxy-D-gluconate|5-dehydro-2-deoxy-D-gluconate 2-deoxy-D-threo-hex-5-ulosonate 2-deoxy-D-threo-hex-5-ulosonate|5-Dehydro-2-deoxy-D-gluconate|5-dehydro-2-deoxy-D-gluconate http://purl.obolibrary.org/obo/CHEBI_16669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16670 biolink:ChemicalEntity peptide Amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another with formal loss of water. The term is usually applied to structures formed from α-amino acids, but it includes those derived from any amino carboxylic acid. X = OH, OR, NH2, NHR, etc. kegg.compound:C00012 Graph Peptid|Peptide|peptides|peptido|peptidos peptides Peptid|Peptide|peptides|peptido|peptidos http://purl.obolibrary.org/obo/CHEBI_16670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16671 biolink:ChemicalEntity 4-guanidinobutanal cas:14049-14-0|kegg.compound:C02647 Graph 1-(4-oxobutyl)guanidine|4-Guanidinobutanal|N-(4-oxobutyl)guanidine 1-(4-oxobutyl)guanidine 1-(4-oxobutyl)guanidine|4-Guanidinobutanal|N-(4-oxobutyl)guanidine http://purl.obolibrary.org/obo/CHEBI_16671 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16673 biolink:ChemicalEntity protochlorophyllide An analogue of chlorophyll that lacks the phytol side-chain. The parent of the protochlorophyllide class. beilstein:7511448|cas:20369-67-9|kegg.compound:C02880|pdb-ccd:PMR|pubmed:16668650|pubmed:21190679|pubmed:21678944|reaxys:19512139|wikipedia.en:Protochlorophyllide Graph Protochlorophyllide|protochlorophyllide a|{3-[(21R)-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinyl-3,4-didehydrophorbin-3-yl-kappa(4)N(23),N(24),N(25),N(26)]propanoato(2-)}magnesium|{3-[(21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydrophorbin-3-yl-kappa(4)N(23),N(24),N(25),N(26)]propanoato(2-)}magnesium {3-[(21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydrophorbin-3-yl-kappa(4)N(23),N(24),N(25),N(26)]propanoato(2-)}magnesium Protochlorophyllide|protochlorophyllide a|{3-[(21R)-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinyl-3,4-didehydrophorbin-3-yl-kappa(4)N(23),N(24),N(25),N(26)]propanoato(2-)}magnesium|{3-[(21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydrophorbin-3-yl-kappa(4)N(23),N(24),N(25),N(26)]propanoato(2-)}magnesium http://purl.obolibrary.org/obo/CHEBI_16673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16675 biolink:ChemicalEntity quinolinic acid A pyridinedicarboxylic acid that is pyridine substituted by carboxy groups at positions 2 and 3. It is a metabolite of tryptophan. cas:89-00-9|drugbank:DB01796|gmelin:201344|hmdb:HMDB0000232|kegg.compound:C03722|knapsack:C00007381|pdb-ccd:NTM|pubmed:11226705|pubmed:11462760|pubmed:16008534|pubmed:8724297|reaxys:137110|wikipedia.en:Quinolinic_acid Graph 2,3-Pyridinedicarboxylic acid|Pyridine-2,3-dicarboxylate|QUINOLINIC ACID|Quinolinic acid|pyridine-2,3-dicarboxylic acid pyridine-2,3-dicarboxylic acid 2,3-Pyridinedicarboxylic acid|Pyridine-2,3-dicarboxylate|QUINOLINIC ACID|Quinolinic acid|pyridine-2,3-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_16675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166776 biolink:ChemicalEntity 20alpha-dihydroprednisolone A glucocorticoid that is prednisolone in which the oxo group at position 20 has been reduced to the corresponding α-hydroxy group. It is a metabolite of prednisolone. cas:15847-24-2|chemspider:27524367|pubmed:2055997|pubmed:23510304|pubmed:28806969|pubmed:34081842 Graph (11beta,20R)-11,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20R)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20R)-hydroxyprednisolone|20(R)-hydroxy prednisolone|20alpha-dihydro-PRED|20alpha-dihydro-prednisolone|20alpha-hydroxy prednisolone|20alpha-hydroxyprednisolone (20R)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one (11beta,20R)-11,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20R)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20R)-hydroxyprednisolone|20(R)-hydroxy prednisolone|20alpha-dihydro-PRED|20alpha-dihydro-prednisolone|20alpha-hydroxy prednisolone|20alpha-hydroxyprednisolone http://purl.obolibrary.org/obo/CHEBI_166776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16680 biolink:ChemicalEntity S-adenosyl-L-homocysteine An organic sulfide that is the S-adenosyl derivative of L-homocysteine. cas:979-92-0|drugbank:DB01752|gmelin:692100|hmdb:HMDB0000939|kegg.compound:C00021|knapsack:C00007230|metacyc.compound:ADENOSYL-HOMO-CYS|pdb-ccd:SAH|pubmed:11700066|pubmed:11746687|pubmed:11961214|pubmed:11997462|pubmed:12767735|pubmed:15026045|pubmed:15057524|pubmed:15542683|pubmed:15645450|pubmed:16109423|pubmed:16197293|pubmed:16197315|pubmed:16253211|pubmed:16423634|pubmed:16519522|pubmed:17044778|pubmed:17172447|pubmed:17300772|pubmed:17439666|pubmed:17726531|pubmed:18976670|pubmed:19249293|pubmed:19357721|pubmed:21837278|pubmed:22225784|pubmed:22455498|pubmed:24145794|reaxys:99188|wikipedia.en:S-Adenosyl-L-homocysteine Graph (2S)-2-amino-4-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}sulfanyl)butanoic acid|2-S-adenosyl-L-homocysteine|Adenosyl-L-homocysteine|AdoHcy|S-(5'-adenosyl)-L-homocysteine|S-(5'-deoxyadenosin-5'-yl)-L-homocysteine|S-ADENOSYL-L-HOMOCYSTEINE|S-Adenosyl-L-homocysteine|S-Adenosylhomocysteine|S-[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl]-L-homocysteine|SAH|adenosylhomocysteine S-(5'-deoxyadenosin-5'-yl)-L-homocysteine (2S)-2-amino-4-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}sulfanyl)butanoic acid|2-S-adenosyl-L-homocysteine|Adenosyl-L-homocysteine|AdoHcy|S-(5'-adenosyl)-L-homocysteine|S-(5'-deoxyadenosin-5'-yl)-L-homocysteine|S-ADENOSYL-L-HOMOCYSTEINE|S-Adenosyl-L-homocysteine|S-Adenosylhomocysteine|S-[1-(adenin-9-yl)-1,5-dideoxy-beta-D-ribofuranos-5-yl]-L-homocysteine|SAH|adenosylhomocysteine http://purl.obolibrary.org/obo/CHEBI_16680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16681 biolink:ChemicalEntity O-sinapoylglucaric acid kegg.compound:C02866 Graph O-Sinapoylglucarate O-Sinapoylglucarate http://purl.obolibrary.org/obo/CHEBI_16681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16682 biolink:ChemicalEntity N-acetyl-beta-alanine The N-acetyl derivative of β-alanine. cas:3025-95-4|gmelin:1317687|kegg.compound:C01073|metacyc.compound:CPD-580|reaxys:1704093 Graph 3-(acetylamino)propanoic acid|3-acetamidopropanoic acid|N-Acetyl-beta-alanine 3-acetamidopropanoic acid 3-(acetylamino)propanoic acid|3-acetamidopropanoic acid|N-Acetyl-beta-alanine http://purl.obolibrary.org/obo/CHEBI_16682 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166822 biolink:ChemicalEntity EC 3.4.23.15 (renin) inhibitor An EC 3.4.23.* (aspartic endopeptidase) inhibitor that interferes with the activity of renin (EC 3.4.23.15). wikipedia.en:Renin Graph EC 3.4.23.15 (renin) inhibitors|EC 3.4.23.15 inhibitor|EC 3.4.23.15 inhibitors|angiotensin-forming enzyme inhibitor|angiotensin-forming enzyme inhibitors|angiotensinogenase inhibitor|angiotensinogenase inhibitors|renin inhibitor|renin inhibitors EC 3.4.23.15 (renin) inhibitors|EC 3.4.23.15 inhibitor|EC 3.4.23.15 inhibitors|angiotensin-forming enzyme inhibitor|angiotensin-forming enzyme inhibitors|angiotensinogenase inhibitor|angiotensinogenase inhibitors|renin inhibitor|renin inhibitors http://purl.obolibrary.org/obo/CHEBI_166822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166823 biolink:ChemicalEntity peptide antigen zwitterion Zwitterionic form of any peptide antigen obtained from the tranfer of a proton from the carboxy group to the amino group; major species at pH 7.3. pubmed:23298205 Graph a peptide antigen a peptide antigen http://purl.obolibrary.org/obo/CHEBI_166823 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166824 biolink:ChemicalEntity peptide antigen Any peptide displayed by major histocompatibility (MHC) molecules on antigen-presenting cells. Class I MHC accommodate 8 to 13-residue peptides whereas class II MHC can bind 10 to 30-residue peptides, the optimal size being 12 to 16 residues. pubmed:23298205 Graph antigenic peptide antigenic peptide http://purl.obolibrary.org/obo/CHEBI_166824 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166825 biolink:ChemicalEntity pentamethonium A quarternary ammonium cation that is cadaverine in which the terminal amino hydrogens are substituted methyl groups. Its bromide and iodide salt exhibits ganglionic blocking activity and used in the treatment of hypertension. cas:2365-25-5|drugcentral:3808|pmc:PMC2069136|pubmed:13012178|pubmed:13031267|pubmed:13082669|pubmed:13203573|pubmed:13433672|pubmed:13519137|pubmed:13528481|pubmed:13659026|pubmed:13728012|pubmed:13922506|pubmed:13936437|pubmed:14412425|pubmed:14431440|pubmed:14814831|pubmed:14914343|pubmed:14957488|pubmed:15405907|pubmed:15409668|pubmed:15437947|pubmed:15444319|pubmed:15445056|pubmed:4390479|pubmed:6850164 Graph 1,5-pentanediylbis(trimethylaminium)|N(1),N(1),N(1),N(5),N(5),N(5)-hexamethylpentane-1,5-bis(aminium)|N,N,N,N',N',N'-hexamethyl-1,5-pentanediaminium|N,N,N,N',N',N'-hexamethylpentane-1,5-bis(aminium)|pentamethonum|trimethyl-[5-(trimethylazaniumyl)pentyl]azanium N,N,N,N',N',N'-hexamethylpentane-1,5-bis(aminium) 1,5-pentanediylbis(trimethylaminium)|N(1),N(1),N(1),N(5),N(5),N(5)-hexamethylpentane-1,5-bis(aminium)|N,N,N,N',N',N'-hexamethyl-1,5-pentanediaminium|N,N,N,N',N',N'-hexamethylpentane-1,5-bis(aminium)|pentamethonum|trimethyl-[5-(trimethylazaniumyl)pentyl]azanium http://purl.obolibrary.org/obo/CHEBI_166825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166828 biolink:ChemicalEntity saccharolipid Lipids that contain a carbohydrate moiety. wikipedia.en:Saccharolipid Graph saccharolipids saccharolipids http://purl.obolibrary.org/obo/CHEBI_166828 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166829 biolink:ChemicalEntity ochratoxin A(1-) A monocarboxylic acid anion that is conjugate base of ochratoxin A, arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3. metacyc.compound:CPD-22712|pubmed:33096150|pubmed:33137913|pubmed:33166747 Graph (2S)-2-({[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-7-yl]carbonyl}amino)-3-phenylpropanoate|(2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]amino}-3-phenylpropanoate|ochratoxin A (2S)-2-({[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-7-yl]carbonyl}amino)-3-phenylpropanoate (2S)-2-({[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-7-yl]carbonyl}amino)-3-phenylpropanoate|(2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]amino}-3-phenylpropanoate|ochratoxin A http://purl.obolibrary.org/obo/CHEBI_166829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16683 biolink:ChemicalEntity 2,3,6-trihydroxypyridine cas:39954-19-3|kegg.compound:C03458|umbbd.compound:c0475 Graph 2,3,6-Trihydroxypyridine|2,3,6-trihydroxypyridine|pyridine-2,3,6-triol pyridine-2,3,6-triol 2,3,6-Trihydroxypyridine|2,3,6-trihydroxypyridine|pyridine-2,3,6-triol http://purl.obolibrary.org/obo/CHEBI_16683 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166831 biolink:ChemicalEntity copper chelator A chelator that is any compound containing a ligand (typically organic) which is able to form a bond to a central copper atom at two or more points. pubmed:24934357|pubmed:29710396 Graph copper chelate|copper chelating agent|copper chelating agents|copper chelator|copper chelators copper chelate|copper chelating agent|copper chelating agents|copper chelator|copper chelators http://purl.obolibrary.org/obo/CHEBI_166831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16684 biolink:ChemicalEntity atropine A racemate composed of equimolar concentrations of (S)- and (R)-atropine . It is obtained from deadly nightshade (Atropa belladonna) and other plants of the family Solanaceae. beilstein:4236545|cas:51-55-8|drugbank:DB00572|hmdb:HMDB0014712|kegg.compound:C01479|kegg.drug:D00113|pubmed:15374592|pubmed:18369575|reaxys:1545928 Graph (+,-)-tropyl tropate|(+-)-atropine|(+-)-hyoscyamine|(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|Atropin|Atropine|[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] 3-hydroxy-2-phenyl-propanoate|atropina|dl-Hyoscyamine|dl-tropyltropate|rac-(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|rac-tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate|tropine tropate rac-(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|rac-tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate (+,-)-tropyl tropate|(+-)-atropine|(+-)-hyoscyamine|(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate|Atropin|Atropine|[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] 3-hydroxy-2-phenyl-propanoate|atropina|dl-Hyoscyamine|dl-tropyltropate|rac-(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate|rac-tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate|tropine tropate http://purl.obolibrary.org/obo/CHEBI_16684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16685 biolink:ChemicalEntity 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid Graph 5-(3-Carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylate|5-(3-carboxy-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylic acid 5-(3-carboxy-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylic acid 5-(3-Carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylate|5-(3-carboxy-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166856 biolink:ChemicalEntity hydroxytrimethylaminium A methylated tertiary amine that is trimethylammonium in which the hydrogen attached to the nitrogen is replaced by a hydroxy group. Graph (CH3)3NOH|hydroxy(trimethyl)ammonium|hydroxy(trimethyl)azanium|hydroxytrimethylazanium hydroxy(trimethyl)ammonium (CH3)3NOH|hydroxy(trimethyl)ammonium|hydroxy(trimethyl)azanium|hydroxytrimethylazanium http://purl.obolibrary.org/obo/CHEBI_166856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166868 biolink:ChemicalEntity (5S)-C-methyl-L-argininium residue metacyc.compound:Methyl-Coenzyme-M-Reductase-C5m-Arg|pubmed:31113866 Graph (5S)-C-methyl-L-arginine residue (5S)-C-methyl-L-arginine residue http://purl.obolibrary.org/obo/CHEBI_166868 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16688 biolink:ChemicalEntity ecdysone A 6-oxo steroid that is 5β-cholest-7-en-6-one substituted by hydroxy groups at positions 2, 3, 14, 22 and 25 respectively (the 2β, 3β, 22R stereoisomer). It is a steroid prohormone of the major insect moulting hormone 20-hydroxyecdysone. cas:3604-87-3|kegg.compound:C00477|knapsack:C00003651|lipidmaps:LMST01010210|pubmed:19342482|pubmed:22310011|pubmed:22828514|pubmed:23017214|pubmed:23072462|reaxys:2422986|wikipedia.en:Ecdysone Graph (22R)-2beta,3beta,14,22,25-pentahydroxy-5beta-cholest-7-en-6-one|(22R)-2beta,3beta,14alpha,22,25-pentahydroxy-5beta-cholest-7-en-6-one|(2beta,3beta,5beta,22R)-2,3,14,22,25-pentahydroxycholest-7-en-6-one|Ecdysone|ecdysone (2beta,3beta,5beta,22R)-2,3,14,22,25-pentahydroxycholest-7-en-6-one (22R)-2beta,3beta,14,22,25-pentahydroxy-5beta-cholest-7-en-6-one|(22R)-2beta,3beta,14alpha,22,25-pentahydroxy-5beta-cholest-7-en-6-one|(2beta,3beta,5beta,22R)-2,3,14,22,25-pentahydroxycholest-7-en-6-one|Ecdysone|ecdysone http://purl.obolibrary.org/obo/CHEBI_16688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16689 biolink:ChemicalEntity D-apiose cas:639-97-4|kegg.compound:C01488 Graph 3-C-(hydroxymethyl)-D-glycero-tetrose|3-C-Hydroxymethyltetrose|Apiose|D-Api|D-Apiose|aldehydo-D-apiose 3-C-(hydroxymethyl)-D-glycero-tetrose 3-C-(hydroxymethyl)-D-glycero-tetrose|3-C-Hydroxymethyltetrose|Apiose|D-Api|D-Apiose|aldehydo-D-apiose http://purl.obolibrary.org/obo/CHEBI_16689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166899 biolink:ChemicalEntity globulin type One of the major classifications of proteins, which may be further divided into the euglobulins and the pseudoglobulins. The former group is insoluble in water but soluble in saline solutions and may be precipitated in water that has been half-saturated with a salt such as ammonium sulfate. The latter group is soluble in water and has properties that resemble those of the true globulins. Globulins are an important source of protein in seed plants and are found in minute amounts in cereals. Globulins found in animal fluids are enzymes, antibodies, and fibrous and contractile proteins usually contained in the blood plasma. wikipedia.en:https://en.wikipedia.org/wiki/Globulin Graph http://purl.obolibrary.org/obo/CHEBI_166899 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16690 biolink:ChemicalEntity guanosine 3'-diphosphate 5'-triphosphate A guanosine bisphosphate having a diphosphate at the 3'-position and a triphosphate at the 5'-position. beilstein:1205996|cas:38918-96-6|kegg.compound:C04494 Graph Guanosine 3'-diphosphate 5'-triphosphate|Guanosine 5'-triphosphate,3'-diphosphate|Guanosine pentaphosphate|guanosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) guanosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) Guanosine 3'-diphosphate 5'-triphosphate|Guanosine 5'-triphosphate,3'-diphosphate|Guanosine pentaphosphate|guanosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_16690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166902 biolink:ChemicalEntity noradrenaline(1+) An organic cation that is the conjugate acid of noradrenaline, obtained by protonation of the primary amino group; major species at pH 7.3. Graph 2-(3,4-dihydroxyphenyl)-2-hydroxyethan-1-aminium|2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium|noradrenaline|noradrenaline cation|norepinephrine cation|norepinephrine(1+) 2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium 2-(3,4-dihydroxyphenyl)-2-hydroxyethan-1-aminium|2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium|noradrenaline|noradrenaline cation|norepinephrine cation|norepinephrine(1+) http://purl.obolibrary.org/obo/CHEBI_166902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166904 biolink:ChemicalEntity glycosyldiradylglycerol Any glycerolipid that is glycerol bearing a glycosyl group and two further substituent groups - either acyl, alkyl, or alk-1-enyl - at the remaining two positions. Graph http://purl.obolibrary.org/obo/CHEBI_166904 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16691 biolink:ChemicalEntity dethiobiotin A hexanoic acid having a 5-methyl-2-oxoimidazolidin-4-yl group at the 6-position. beilstein:177518|cas:533-48-2|hmdb:HMDB0003581|kegg.compound:C01909|knapsack:C00000757|pubmed:12730407|pubmed:21621502|pubmed:22326745|reaxys:84958 Graph 6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid|Desthiobiotin|Dethiobiotin 6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid 6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid|Desthiobiotin|Dethiobiotin http://purl.obolibrary.org/obo/CHEBI_16691 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16692 biolink:ChemicalEntity diphthamide residue An α-amino-acid residue derived from diphthamide. kegg.compound:C02872|pdb-ccd:DDE|resid:AA0040 Graph 2'-[3-carboxamido-3-(trimethylammonio)propyl]-L-histidine|2-[(3R)-3-carbamoyl-3-(trimethylammonio)propyl]-L-histidyl|Diphthamide|EF-2 diphthamide|Elongation factor 2 diphthamide|Peptide diphthamide|diphthamide residue|peptidyl-diphthamide|{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-TRIMETHYL-AMMONIUM 2'-[3-carboxamido-3-(trimethylammonio)propyl]-L-histidine|2-[(3R)-3-carbamoyl-3-(trimethylammonio)propyl]-L-histidyl|Diphthamide|EF-2 diphthamide|Elongation factor 2 diphthamide|Peptide diphthamide|diphthamide residue|peptidyl-diphthamide|{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-TRIMETHYL-AMMONIUM http://purl.obolibrary.org/obo/CHEBI_16692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16693 biolink:ChemicalEntity ADP-D-glycero-D-manno-heptose kegg.compound:C06397 Graph ADP-D-glycero-D-manno-heptose|adenine 5'-[3-(D-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] adenine 5'-[3-(D-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] ADP-D-glycero-D-manno-heptose|adenine 5'-[3-(D-glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16694 biolink:ChemicalEntity 5D-(5/6)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one A cyclic ketone comprising cyclohexen-2-one having hydroxy groups at the 2- and 6-positions and a hydroxymethyl group at the 5-position. kegg.compound:C04815 Graph (5S,6S)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one|5-D-(5/6)-5-C-(Hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one|5D-(5/6)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one|5D-(5/6)-5-C-(Hydroxymethyl)-2,6-dihydroxy-2-cyclohexen-1-one|5D-(5/6)-5-C-(hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one (5S,6S)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one|5D-(5/6)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one (5S,6S)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one|5-D-(5/6)-5-C-(Hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one|5D-(5/6)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one|5D-(5/6)-5-C-(Hydroxymethyl)-2,6-dihydroxy-2-cyclohexen-1-one|5D-(5/6)-5-C-(hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_16694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166942 biolink:ChemicalEntity PC(14:0_18:1) Graph PC 14:0_18:1 PC 14:0_18:1 http://purl.obolibrary.org/obo/CHEBI_166942 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166943 biolink:ChemicalEntity PC(15:0_18:2) Graph PC 15:0_18:2 PC 15:0_18:2 http://purl.obolibrary.org/obo/CHEBI_166943 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166944 biolink:ChemicalEntity PC(17:0_18:2) A phosphatidylcholine 35:2 in which one acyl group has 17 carbons and is fully saturated while the other has 18 carbons and 2 double bonds (position not specified). Graph PC 17:0_18:2|phosphatidylcholine 17:0_18:2|phosphatidylcholine(17:0_18:2) PC 17:0_18:2|phosphatidylcholine 17:0_18:2|phosphatidylcholine(17:0_18:2) http://purl.obolibrary.org/obo/CHEBI_166944 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166945 biolink:ChemicalEntity PC(17:0_20:4) A phosphatidylcholine 37:4 in which one acyl group has 17 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PC 17:0_20:4|phosphatidylcholine 17:0_20:4|phosphatidylcholine(17:0_20:4) PC 17:0_20:4|phosphatidylcholine 17:0_20:4|phosphatidylcholine(17:0_20:4) http://purl.obolibrary.org/obo/CHEBI_166945 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16695 biolink:ChemicalEntity uridine 5'-monophosphate A pyrimidine ribonucleoside 5'-monophosphate having uracil as the nucleobase. cas:58-97-9|drugbank:DB03685|gmelin:310455|hmdb:HMDB0000288|kegg.compound:C00105|knapsack:C00007311|metacyc.compound:UMP|pdb-ccd:U5PrF10|pdb-ccd:UrF10|pubmed:22735334|pubmed:2559771|reaxys:47486|wikipedia.en:Uridine_monophosphate Graph 5'-UMP|5'-uridylic acid|5'Uridylic acid|UMP|URIDINE-5'-MONOPHOSPHATE|Uridine 5'-monophosphate|Uridine monophosphate|Uridylic acid|pU|uridine 5'-(dihydrogen phosphate)|uridine 5'-phosphate|uridine 5'-phosphoric acid|uridylate 5'-uridylic acid 5'-UMP|5'-uridylic acid|5'Uridylic acid|UMP|URIDINE-5'-MONOPHOSPHATE|Uridine 5'-monophosphate|Uridine monophosphate|Uridylic acid|pU|uridine 5'-(dihydrogen phosphate)|uridine 5'-phosphate|uridine 5'-phosphoric acid|uridylate http://purl.obolibrary.org/obo/CHEBI_16695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16696 biolink:ChemicalEntity 3-methylthiopropylamine A derivative of propylamine having a methylmercapto group at the 3-position. beilstein:1731211|cas:4104-45-4|gmelin:486042|kegg.compound:C03354 Graph 3-(methylsulfanyl)propan-1-amine|3-(methylthio)-1-propanamine|3-Methylthiopropanamine|3-Methylthiopropylamine|3-methylthiopropylamine 3-(methylsulfanyl)propan-1-amine 3-(methylsulfanyl)propan-1-amine|3-(methylthio)-1-propanamine|3-Methylthiopropanamine|3-Methylthiopropylamine|3-methylthiopropylamine http://purl.obolibrary.org/obo/CHEBI_16696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166964 biolink:ChemicalEntity albumin type Family of globular proteins, the most common of which are the serum albumins. All the proteins of the albumin family are water-soluble, moderately soluble in concentrated salt solutions, and experience heat denaturation. pubmed:32481022|wikipedia.en:https://en.wikipedia.org/wiki/Albumin#Other_albumin_types Graph http://purl.obolibrary.org/obo/CHEBI_166964 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:166975 biolink:ChemicalEntity soybean oil An oil extracted from the seeds of Glycine max. Typical fatty acid composition is 51% linoleic acid, 7-10% α-linolenic acid, 23% oleic acid, 10% palmitic acid and 4% stearic acid. agr:IND605943385|cas:8001-22-7|drugbank:DB09422|kegg.drug:D04962|pubmed:19783644|pubmed:26365705|pubmed:32625705|pubmed:33357113|wikipedia.en:Soybean_oil Graph Intrafat|Intralipid|extract of soy|oils, soybean|soy bean oil|soy oil|soy-bean oil|soya bean oil|soya oil|soya-bean oil Intrafat|Intralipid|extract of soy|oils, soybean|soy bean oil|soy oil|soy-bean oil|soya bean oil|soya oil|soya-bean oil http://purl.obolibrary.org/obo/CHEBI_166975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16698 biolink:ChemicalEntity cyanamide A nitrile that is hydrogen cyanide in which the hydrogen has been replaced by an amino group. cas:420-04-2|drugbank:DB02679|gmelin:784|kegg.compound:C01566|kegg.drug:D00123|pdb-ccd:CNN|ppdb:184|pubmed:15991038|pubmed:17989515|pubmed:24429000|pubmed:24709147|reaxys:1732569|umbbd.compound:c0597|wikipedia.en:Cyanamide Graph CYANAMIDE|Carbodiimide|Cyanamide|H2N-C#N|NH2CN|amidocyanogen|carbamonitrile|cyanamide|cyanoamine CYANAMIDE|Cyanamide|cyanamide CYANAMIDE|Carbodiimide|Cyanamide|H2N-C#N|NH2CN|amidocyanogen|carbamonitrile|cyanamide|cyanoamine http://purl.obolibrary.org/obo/CHEBI_16698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166986 biolink:ChemicalEntity alkyldiacylglyceride A triradylglycerol with a single alkyl substituent and two acyl substituents at unspecified positions. Graph alkyldiacylglycerides|alkyldiacylglycerol|alkyldiacylglycerols|monoalkyldiacylglycerol|monoalkyldiacylglycerols alkyldiacylglycerides|alkyldiacylglycerol|alkyldiacylglycerols|monoalkyldiacylglycerol|monoalkyldiacylglycerols http://purl.obolibrary.org/obo/CHEBI_166986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166988 biolink:ChemicalEntity glycerophosphoglycerophosphoglycerol A glycerophospholipid composed of two molecules of glycerol phosphate covalently linked to a molecule of glycerol, and in which each of the glycerol phosphate moieties may be esterified to one or two fatty acids. Graph GPGPG GPGPG http://purl.obolibrary.org/obo/CHEBI_166988 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16699 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-arabinonate metacyc.compound:2-DH-3-DO-D-ARABINONATE Graph (4S)-4,5-dihydroxy-2-oxopentanoate|2-Dehydro-3-deoxy-D-arabinonate|2-dehydro-3-deoxy-D-arabinonate|3-deoxy-D-glycero-pent-2-ulosonate (4S)-4,5-dihydroxy-2-oxopentanoate|3-deoxy-D-glycero-pent-2-ulosonate (4S)-4,5-dihydroxy-2-oxopentanoate|2-Dehydro-3-deoxy-D-arabinonate|2-dehydro-3-deoxy-D-arabinonate|3-deoxy-D-glycero-pent-2-ulosonate http://purl.obolibrary.org/obo/CHEBI_16699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:166999 biolink:ChemicalEntity tomatidine(1+) pubmed:9076990 Graph tomatidine tomatidine http://purl.obolibrary.org/obo/CHEBI_166999 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1670 biolink:ChemicalEntity 3-ureidoisobutyric acid A ureidocarboxylic acid that is 2-methylpropanoic acid substituted by a carbamoylamino group at position 3. cas:2905-86-4|hmdb:HMDB0002031|kegg.compound:C05100|metacyc.compound:3-UREIDO-ISOBUTYRATE|pubmed:11675655|reaxys:1768736 Graph 3-((aminocarbonyl)amino)-2-methylpropanoic acid|3-Ureidoisobutyrate|3-carbamoylamino-2-methylpropanoic acid|beta-UBA|beta-ureidoisobutyric acid 3-carbamoylamino-2-methylpropanoic acid 3-((aminocarbonyl)amino)-2-methylpropanoic acid|3-Ureidoisobutyrate|3-carbamoylamino-2-methylpropanoic acid|beta-UBA|beta-ureidoisobutyric acid http://purl.obolibrary.org/obo/CHEBI_1670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16700 biolink:ChemicalEntity indican cas:487-60-5|kegg.compound:C08481|knapsack:C00001541 Graph 1H-indol-3-yl beta-D-glucopyranoside|Indican|Indican, plant|indican 1H-indol-3-yl beta-D-glucopyranoside 1H-indol-3-yl beta-D-glucopyranoside|Indican|Indican, plant|indican http://purl.obolibrary.org/obo/CHEBI_16700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16701 biolink:ChemicalEntity nucleoside 5'-phosphate A ribosyl or deoxyribosyl derivative of a pyrimidine or purine base in which C-5 of the ribose ring is mono-, di-, tri- or tetra-phosphorylated. kegg.compound:C01117 Graph Nucleoside 5'-phosphate|nucleoside 5'-phosphates Nucleoside 5'-phosphate|nucleoside 5'-phosphates http://purl.obolibrary.org/obo/CHEBI_16701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16702 biolink:ChemicalEntity N-sulfo-D-glucosamine The N-sulfoglucosamine formed by sulfating the amino group of D-glucosamine. kegg.compound:C01075|pubmed:22846255|pubmed:5775690|reaxys:10446611 Graph 2-deoxy-2-sulfoamino-D-glucopyranose|N-Sulfo-D-glucosamine 2-deoxy-2-sulfoamino-D-glucopyranose 2-deoxy-2-sulfoamino-D-glucopyranose|N-Sulfo-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_16702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16704 biolink:ChemicalEntity uridine A ribonucleoside composed of a molecule of uracil attached to a ribofuranose moiety via a β‒N1-glycosidic bond. cas:58-96-8|drugbank:DB02745|ecmdb:ECMDB00296|gmelin:397474|hmdb:HMDB0000296|kegg.compound:C00299|knapsack:C00019674|metacyc.compound:URIDINE|pdb-ccd:URI|pubmed:12084455|pubmed:15621516|pubmed:16839635|pubmed:17190852|pubmed:22392515|pubmed:22770225|reaxys:754904|wikipedia.en:Uridine|ymdb:YMDB00127 Graph 1-beta-D-ribofuranosylpyrimidine-2,4(1H,3H)-dione|1-beta-D-ribofuranosyluracil|URIDINE|Urd|Uridin|Uridine|beta-Uridine|u|uridine URIDINE|Uridine|uridine 1-beta-D-ribofuranosylpyrimidine-2,4(1H,3H)-dione|1-beta-D-ribofuranosyluracil|URIDINE|Urd|Uridin|Uridine|beta-Uridine|u|uridine http://purl.obolibrary.org/obo/CHEBI_16704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167041 biolink:ChemicalEntity phosphatidylserine 32:1 Graph PS 32:1|PS(32:1)|phosphatidylserine(32:1) PS 32:1|PS(32:1)|phosphatidylserine(32:1) http://purl.obolibrary.org/obo/CHEBI_167041 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167046 biolink:ChemicalEntity mannosyl-alpha-1->6-inositol-1-phospho-N-(2-hydroxyacyl)-phytoceramide(1-) Graph N-(2-hydroxyacyl)-4R-hydroxysphingoid base 1-phospho-[(D-mannopyranosyl-alpha-1->6)-1D-myo-inositol](1-)|an alpha-D-mannosylinositol-1-phospho-N-(2-hydroxyacyl)-4R-hydroxysphingoid base N-(2-hydroxyacyl)-4R-hydroxysphingoid base 1-phospho-[(D-mannopyranosyl-alpha-1->6)-1D-myo-inositol](1-)|an alpha-D-mannosylinositol-1-phospho-N-(2-hydroxyacyl)-4R-hydroxysphingoid base http://purl.obolibrary.org/obo/CHEBI_167046 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16705 biolink:ChemicalEntity 6-aminopenicillanic acid A penicillanic acid compound having a (6R)-amino substituent. The active nucleus common to all penicillins, it may be substituted at the 6-amino position to form the semisynthetic penicillins, resulting in a variety of antibacterial and pharmacologic characteristics. beilstein:959078|cas:551-16-6|gmelin:1876702|kegg.compound:C02954|patent:US2941995|pdb-ccd:X1E|pubmed:12569987|pubmed:1384868|pubmed:14687482|pubmed:1701026|pubmed:20970923|pubmed:21614893|pubmed:24293403|pubmed:24389703|pubmed:24631718|pubmed:25057428|pubmed:26852849|pubmed:26986755|pubmed:6166603|reaxys:15080|wikipedia.en:6-APA Graph (+)-6-aminopenicillanic acid|(2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6-APA|6-Aminopenicillamine acid|6-Aminopenicillanate|6-Aminopenicillanic acid|6-Apa|6-Aps|6-amino-2,2-dimethylpenam-3alpha-carboxylic acid|6beta-aminopenicillanic acid|Aminopenicillanic acid|Penicin|Penin|Phenacyl 6-aminopenicillinate 6-amino-2,2-dimethylpenam-3alpha-carboxylic acid (+)-6-aminopenicillanic acid|(2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6-APA|6-Aminopenicillamine acid|6-Aminopenicillanate|6-Aminopenicillanic acid|6-Apa|6-Aps|6-amino-2,2-dimethylpenam-3alpha-carboxylic acid|6beta-aminopenicillanic acid|Aminopenicillanic acid|Penicin|Penin|Phenacyl 6-aminopenicillinate http://purl.obolibrary.org/obo/CHEBI_16705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167055 biolink:ChemicalEntity Jasmonate derivatives Any octanoid that is derived from jasmonate. Graph http://purl.obolibrary.org/obo/CHEBI_167055 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167056 biolink:ChemicalEntity polyprenol diphosphate(3-) Graph polyprenol diphosphate polyprenol diphosphate http://purl.obolibrary.org/obo/CHEBI_167056 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167057 biolink:ChemicalEntity monolysocardiolipin(2-) The organophosphate oxoanion formed from any monolysocardiolipin by deprotonation of the two phospho groups; principal species present at pH 7.3 Graph a monolysocardiolipin a monolysocardiolipin http://purl.obolibrary.org/obo/CHEBI_167057 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16706 biolink:ChemicalEntity 2-iodophenol beilstein:1855300|cas:533-58-4|gmelin:406034|kegg.compound:C01874 Graph 2-Iodophenol|2-Jodphenol|2-iodophenol|o-Jodphenol|o-iodophenol 2-Iodophenol|2-iodophenol 2-Iodophenol|2-Jodphenol|2-iodophenol|o-Jodphenol|o-iodophenol http://purl.obolibrary.org/obo/CHEBI_16706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16708 biolink:ChemicalEntity adenine The parent compound of the 6-aminopurines, composed of a purine having an amino group at C-6. cas:73-24-5|drugbank:DB00173|drugcentral:89|gmelin:3903|hmdb:HMDB0000034|kegg.compound:C00147|kegg.drug:D00034|knapsack:C00001490|metacyc.compound:ADENINE|pdb-ccd:ADE|pubmed:11985597|pubmed:12829005|pubmed:12951489|pubmed:15063338|pubmed:15715490|pubmed:17439666|pubmed:8070089|reaxys:608603|wikipedia.en:Adenine Graph 6-Aminopurine|9H-purin-6-amine|A|ADENINE|Ade|Adenin|Adenine|adenine 9H-purin-6-amine 6-Aminopurine|9H-purin-6-amine|A|ADENINE|Ade|Adenin|Adenine|adenine http://purl.obolibrary.org/obo/CHEBI_16708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16709 biolink:ChemicalEntity pyridoxine A hydroxymethylpyridine with hydroxymethyl groups at positions 4 and 5, a hydroxy group at position 3 and a methyl group at position 2. The 4-methanol form of vitamin B6, it is converted intoto pyridoxal phosphate which is a coenzyme for synthesis of amino acids, neurotransmitters, sphingolipids and aminolevulinic acid. agr:IND607198670|cas:65-23-6|chemspider:1025|drugbank:DB00165|drugcentral:2836|foodb.food:FDB000574|gmelin:563676|hmdb:HMDB0000239|kegg.compound:C00314|kegg.drug:D08454|knapsack:C00001551|lincs.smallmolecule:LSM-5324|metacyc.compound:PYRIDOXINE|pdb-ccd:UEG|pubmed:10687314|pubmed:10894227|pubmed:11562405|pubmed:12640345|pubmed:12768081|pubmed:13046427|pubmed:15132238|pubmed:15369738|pubmed:15756083|pubmed:16236150|pubmed:16277693|pubmed:16690736|pubmed:17044573|pubmed:22932811|pubmed:24035968|pubmed:24601602|pubmed:2580028|pubmed:27113583|pubmed:2885064|pubmed:31093449|pubmed:32105687|pubmed:33549283|pubmed:33665688|pubmed:3710434|pubmed:559690|pubmed:6624427|pubmed:6801073|pubmed:9625217|reaxys:139854|wikipedia.en:Pyridoxine Graph 2-Methyl-3-hydroxy-4,5-dihydroxymethyl-pyridin|2-methyl-3-hydroxy-4,5-bis(hydroxymethyl)pyridine|2-methyl-3-hydroxy-4,5-di(hydroxymethyl)pyridine|2-methyl-3-hydroxy-4,5-dihydroxymethylpyridine|2-methyl-4,5-bis(hydroxymethyl)-3-hydroxypyridine|2-methyl-4,5-dimethylol-pyridin-3-ol|3-hydroxy-2-picoline-4,5-dimethanol|3-hydroxy-4,5-bis(hydroxymethyl)-2-methylpyridine|3-hydroxy-4,5-dimethylol-alpha-picoline|4,5-bis(hydroxymethyl)-2-methyl-pyridin-3-ol|4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol|5-hydroxy-6-methyl-3,4-pyridinedimethanol|Pyridoxol|piridossina|pyridoxina|pyridoxine|pyridoxinum|pyridoxolum|vitamin B6 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol 2-Methyl-3-hydroxy-4,5-dihydroxymethyl-pyridin|2-methyl-3-hydroxy-4,5-bis(hydroxymethyl)pyridine|2-methyl-3-hydroxy-4,5-di(hydroxymethyl)pyridine|2-methyl-3-hydroxy-4,5-dihydroxymethylpyridine|2-methyl-4,5-bis(hydroxymethyl)-3-hydroxypyridine|2-methyl-4,5-dimethylol-pyridin-3-ol|3-hydroxy-2-picoline-4,5-dimethanol|3-hydroxy-4,5-bis(hydroxymethyl)-2-methylpyridine|3-hydroxy-4,5-dimethylol-alpha-picoline|4,5-bis(hydroxymethyl)-2-methyl-pyridin-3-ol|4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol|5-hydroxy-6-methyl-3,4-pyridinedimethanol|Pyridoxol|piridossina|pyridoxina|pyridoxine|pyridoxinum|pyridoxolum|vitamin B6 http://purl.obolibrary.org/obo/CHEBI_16709 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167095 biolink:ChemicalEntity secondary fatty alcohol A fatty alcohol consisting of a chain of 3 to greater than 27 carbon atoms in which a hydroxy group is attached to a saturated carbon atom different from the terminal carbons. Secondary fatty alcohols may be saturated or unsaturated and may be branched or unbranched. Graph a secondary fatty alcohol a secondary fatty alcohol http://purl.obolibrary.org/obo/CHEBI_167095 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167097 biolink:ChemicalEntity trihexosylceramide sulfate An organosulfate oxoanion obtained by deprotonation of the sulfate group of any trihexosylceramide sulfate; major species at pH 7.3. Graph http://purl.obolibrary.org/obo/CHEBI_167097 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167098 biolink:ChemicalEntity N-(fatty acyl)-ethanolamine an N-acyl-ethanolamine where the acyl group is a fatty acyl chain with composition not specified, major species at pH 7.3. Graph an N-(fatty acyl)-ethanolamine an N-(fatty acyl)-ethanolamine http://purl.obolibrary.org/obo/CHEBI_167098 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16710 biolink:ChemicalEntity D-ribulose 1,5-bisphosphate A ribulose phosphate that is D-ribulose attached to phosphate groups at positions 1 and 5. It is an intermediate in photosynthesis. cas:24218-00-6|ecmdb:ECMDB20145|kegg.compound:C01182|knapsack:C00007293|metacyc.compound:D-RIBULOSE-15-P2|pdb-ccd:RUB|pubmed:15219406|pubmed:23301499|reaxys:2299163|wikipedia.en:Ribulose-1,5-bisphosphate Graph 1,5-di-O-phosphono-D-erythro-pent-2-ulose|1,5-di-O-phosphono-D-ribulose|D-Ribulose 1,5-bisphosphate|D-erythro-pentulose 1,5-bis(dihydrogen phosphate)|D-ribulose 1,5-bis(dihydrogen phosphate)|RIBULOSE-1,5-DIPHOSPHATE 1,5-di-O-phosphono-D-erythro-pent-2-ulose|1,5-di-O-phosphono-D-ribulose|D-erythro-pentulose 1,5-bis(dihydrogen phosphate)|D-ribulose 1,5-bis(dihydrogen phosphate) 1,5-di-O-phosphono-D-erythro-pent-2-ulose|1,5-di-O-phosphono-D-ribulose|D-Ribulose 1,5-bisphosphate|D-erythro-pentulose 1,5-bis(dihydrogen phosphate)|D-ribulose 1,5-bis(dihydrogen phosphate)|RIBULOSE-1,5-DIPHOSPHATE http://purl.obolibrary.org/obo/CHEBI_16710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167105 biolink:ChemicalEntity cholestane conjugate Any cholestanoid where the cholestane is conjugated. Graph http://purl.obolibrary.org/obo/CHEBI_167105 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167107 biolink:ChemicalEntity estrane conjugate Any estranoid where the estrane is conjugated. Graph http://purl.obolibrary.org/obo/CHEBI_167107 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167108 biolink:ChemicalEntity pregnane conjugate Any pregnane derivative where the pregnane is conjugated. Graph a pregnane conjugate a pregnane conjugate http://purl.obolibrary.org/obo/CHEBI_167108 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167109 biolink:ChemicalEntity acyl sugars Any saccharolipid having one or more sugars bound to fatty acyl chain(s). pubmed:15691016 Graph http://purl.obolibrary.org/obo/CHEBI_167109 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16711 biolink:ChemicalEntity 4-hydroxybut-2-ynal beilstein:1699178|kegg.compound:C02648 Graph 4-Hydroxy-2-butynal|4-Hydroxybut-2-ynal|4-hydroxy-2-butynal|4-hydroxybut-2-ynal 4-hydroxybut-2-ynal 4-Hydroxy-2-butynal|4-Hydroxybut-2-ynal|4-hydroxy-2-butynal|4-hydroxybut-2-ynal http://purl.obolibrary.org/obo/CHEBI_16711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167114 biolink:ChemicalEntity 2-hydroxydicarboxylate(2-) Any dicarboxylic acid carrying a hydroxy group on the carbon atom at position alpha to the carboxy group. Major species at pH 7.3. Graph a 2-hydroxydicarboxylate a 2-hydroxydicarboxylate http://purl.obolibrary.org/obo/CHEBI_167114 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167118 biolink:ChemicalEntity oxidized N-(fatty acyl)-ethanolamine Any N-acylethanolamine having an oxidized fatty acyl component. Graph oxidized N-(fatty acyl)-ethanolamine|oxygenated N-(fatty acyl)-ethanolamine oxidized N-(fatty acyl)-ethanolamine|oxygenated N-(fatty acyl)-ethanolamine http://purl.obolibrary.org/obo/CHEBI_167118 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16712 biolink:ChemicalEntity (S)-3-sulfolactic acid beilstein:2441637|kegg.compound:C11499 Graph (2S)-2-hydroxy-3-sulfopropanoic acid (2S)-2-hydroxy-3-sulfopropanoic acid (2S)-2-hydroxy-3-sulfopropanoic acid http://purl.obolibrary.org/obo/CHEBI_16712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16714 biolink:ChemicalEntity codeine A morphinane alkaloid found in the opium poppy, Papaver somniferum var. album; has analgesic, anti-tussive and anti-diarrhoeal properties. beilstein:5303198|beilstein:5768734|cas:76-57-3|drugbank:DB00318|drugcentral:725|gmelin:232454|kegg.compound:C06174|knapsack:C00001837|pubmed:2215478|pubmed:23507688|pubmed:24069665|pubmed:24176887|pubmed:24324229|pubmed:24396053|pubmed:24458010|pubmed:24491926|pubmed:24517264|pubmed:9776433|reaxys:94996|wikipedia.en:Codeine Graph (-)-Codeine|(1S,13R,14S,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0(1,13).0(5,17).0(7,18)]octadeca-7(18),8,10,15-tetraen-14-ol|(5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-ol|3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6alpha-ol|7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan-6alpha-ol|Codein|Codeine|Codicept|Coducept|O(3)-methylmorphine|codeina|codeine|codeine anhydrous|l-codeine|methylmorphine|morphine 3-methyl ether|morphine monomethyl ether|morphine-3-methyl ether 3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6alpha-ol (-)-Codeine|(1S,13R,14S,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0(1,13).0(5,17).0(7,18)]octadeca-7(18),8,10,15-tetraen-14-ol|(5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-ol|3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6alpha-ol|7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan-6alpha-ol|Codein|Codeine|Codicept|Coducept|O(3)-methylmorphine|codeina|codeine|codeine anhydrous|l-codeine|methylmorphine|morphine 3-methyl ether|morphine monomethyl ether|morphine-3-methyl ether http://purl.obolibrary.org/obo/CHEBI_16714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167148 biolink:ChemicalEntity 1-linoleoyl-2-acyl-sn-glycero-3-phosphocholine A phosphatidylcholine having a linoleoyl at sn-1 and a fatty acyl chain of unknown composition at sn-2. Major species at pH 7.3. Graph 1-(9Z,12Z-octadecadienoyl)-2-acyl-sn-glycero-3-phosphocholine 1-(9Z,12Z-octadecadienoyl)-2-acyl-sn-glycero-3-phosphocholine http://purl.obolibrary.org/obo/CHEBI_167148 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16715 biolink:ChemicalEntity 1,5-anhydro-D-fructose kegg.compound:C06485|metacyc.compound:15-ANHYDRO-D-FRUCTOSE|pdb-ccd:NHF Graph 1,5-Anhydro-D-fructose|1,5-anhydro-D-fructose|1,5-anhydro-D-threo-hex-2-ulose 1,5-Anhydro-D-fructose|1,5-anhydro-D-fructose 1,5-Anhydro-D-fructose|1,5-anhydro-D-fructose|1,5-anhydro-D-threo-hex-2-ulose http://purl.obolibrary.org/obo/CHEBI_16715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16716 biolink:ChemicalEntity benzene A six-carbon aromatic annulene in which each carbon atom donates one of its two 2p electrons into a delocalised π system. A toxic, flammable liquid byproduct of coal distillation, it is used as an industrial solvent. Benzene is a carcinogen that also damages bone marrow and the central nervous system. cas:71-43-2|gmelin:1671|hmdb:HMDB0001505|kegg.compound:C01407|pdb-ccd:BNZ|pubmed:11684179|pubmed:11993966|pubmed:12857942|pubmed:14677922|pubmed:15468289|pubmed:15935818|pubmed:16161967|pubmed:17373369|pubmed:18072742|pubmed:18407866|pubmed:18409691|pubmed:18836923|pubmed:19228219|pubmed:21325737|pubmed:23088855|pubmed:23222815|pubmed:23534829|pubmed:6353911|pubmed:8124204|reaxys:969212|umbbd.compound:c0142|wikipedia.en:Benzene Graph BENZENE|Benzen|Benzene|Benzine|Benzol|Bicarburet of hydrogen|Coal naphtha|Mineral naphtha|Phene|Pyrobenzol|Pyrobenzole|[6]annulene|benzene|benzole|cyclohexatriene|phenyl hydride BENZENE|Benzene|benzene BENZENE|Benzen|Benzene|Benzine|Benzol|Bicarburet of hydrogen|Coal naphtha|Mineral naphtha|Phene|Pyrobenzol|Pyrobenzole|[6]annulene|benzene|benzole|cyclohexatriene|phenyl hydride http://purl.obolibrary.org/obo/CHEBI_16716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167162 biolink:ChemicalEntity L-ascorbic acid 2-phosphate An aldonolactone phosphate that is the 2-phosphate ester of L-ascorbic acid. It can stimulate collagen formation. cas:23313-12-4|pubmed:1259740|pubmed:12951010|pubmed:19540373|pubmed:2033086|pubmed:23415114|pubmed:25714612|pubmed:30557502|pubmed:31171862|pubmed:31191662|pubmed:31919598|pubmed:32222244|pubmed:33122467|pubmed:7965212 Graph (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydrofuran-3-yl dihydrogen phosphate|2-O-phosphono-L-ascorbic acid|2-phospho-L-ascorbic acid|L-ascorbic acid 2-(dihydrogen phosphate)|L-ascorbyl-2-monophosphate|L-ascorbyl-2-phosphate|ascorbate-2-phosphate|ascorbyl-2-monophosphate|ascorbyl-2-phosphate (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydrofuran-3-yl dihydrogen phosphate (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-2-oxo-2,5-dihydrofuran-3-yl dihydrogen phosphate|2-O-phosphono-L-ascorbic acid|2-phospho-L-ascorbic acid|L-ascorbic acid 2-(dihydrogen phosphate)|L-ascorbyl-2-monophosphate|L-ascorbyl-2-phosphate|ascorbate-2-phosphate|ascorbyl-2-monophosphate|ascorbyl-2-phosphate http://purl.obolibrary.org/obo/CHEBI_167162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167163 biolink:ChemicalEntity L-ascorbate 2-phosphate(3-) An organophosphate oxoanion that is the trianion formed from L-ascorbic acid 2-phosphate by deprotonation of the 3-hydroxy group and of both hydroxy groups of the phosphate function; major species at pH 7.3. metacyc.compound:2-PHOSPHOASCORBATE Graph (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-oxido-2-oxo-2,5-dihydrofuran-3-yl phosphate|2-phospho-L-ascorbate (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-oxido-2-oxo-2,5-dihydrofuran-3-yl phosphate (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-oxido-2-oxo-2,5-dihydrofuran-3-yl phosphate|2-phospho-L-ascorbate http://purl.obolibrary.org/obo/CHEBI_167163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167164 biolink:ChemicalEntity mineral nutrient A mineral that is an inorganic nutrient which must be ingested and absorbed in adequate amounts to satisfy a wide range of essential metabolic and/or structural functions in the human body. wikipedia.en:Mineral_(nutrient) Graph mineral nutrient|mineral nutrients|nutrient mineral|nutrient minerals mineral nutrient|mineral nutrients|nutrient mineral|nutrient minerals http://purl.obolibrary.org/obo/CHEBI_167164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167165 biolink:ChemicalEntity kappa-opioid receptor antagonist Any compound that exhibits antagonist activity at the κ-opioid receptor. Graph kappa-opioid antagonist|kappa-opioid antagonists|kappa-opioid receptor antagonists kappa-opioid antagonist|kappa-opioid antagonists|kappa-opioid receptor antagonists http://purl.obolibrary.org/obo/CHEBI_167165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16717 biolink:ChemicalEntity (Z)-but-2-ene-1,2,3-tricarboxylic acid A tricarboxylic acid comprising (Z)-but-2-ene having the three carboxy groups at the 1-, 2- and 3-positions. cas:6061-93-4|kegg.compound:C04225 Graph (2Z)-but-2-ene-1,2,3-tricarboxylic acid|(Z)-But-2-ene-1,2,3-tricarboxylate|(Z)-but-2-ene-1,2,3-tricarboxylate|alpha-Methyl-cis-aconitate|alpha-Methylaconitate|cis-2-Butene-1,2,3-tricarboxylic acid|cis-2-Methylaconitate (2Z)-but-2-ene-1,2,3-tricarboxylic acid (2Z)-but-2-ene-1,2,3-tricarboxylic acid|(Z)-But-2-ene-1,2,3-tricarboxylate|(Z)-but-2-ene-1,2,3-tricarboxylate|alpha-Methyl-cis-aconitate|alpha-Methylaconitate|cis-2-Butene-1,2,3-tricarboxylic acid|cis-2-Methylaconitate http://purl.obolibrary.org/obo/CHEBI_16717 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167174 biolink:ChemicalEntity N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-L-glutamine residue An α-amino-acid residue formed from N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-L-glutamine. pubmed:30867594 Graph 5-glutamyl serotonin residue|N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-L-glutamine residue 5-glutamyl serotonin residue|N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-L-glutamine residue http://purl.obolibrary.org/obo/CHEBI_167174 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167175 biolink:ChemicalEntity N-[2-(3,4-dihydroxyphenyl)ethyl]-L-glutamine residue An α-amino-acid residue formed from N-[2-(3,4-dihydroxyphenyl)ethyl]-L-glutamine. pubmed:32273471 Graph 5-glutamyl dopamine residue|N-[2-(3,4-dihydroxyphenyl)ethyl]-L-glutamine residue 5-glutamyl dopamine residue|N-[2-(3,4-dihydroxyphenyl)ethyl]-L-glutamine residue http://purl.obolibrary.org/obo/CHEBI_167175 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167178 biolink:ChemicalEntity N-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-L-glutamine residue An α-amino-acid residue formed from N-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-L-glutamine. pubmed:23797785 Graph 5-glutamyl noradrenaline residue|N-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-L-glutamine residue 5-glutamyl noradrenaline residue|N-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-L-glutamine residue http://purl.obolibrary.org/obo/CHEBI_167178 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167179 biolink:ChemicalEntity N-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue An L-α-amino acid residue residue derived from Nα-γ-L-glutamylhistamine pubmed:23022564|pubmed:23797785 Graph N(5)-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue|N(alpha)-gamma-L-glutamylhistamine residue|N-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue N(5)-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue|N(alpha)-gamma-L-glutamylhistamine residue|N-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue http://purl.obolibrary.org/obo/CHEBI_167179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16718 biolink:ChemicalEntity (S)-reticuline The (S)-enantiomer of reticuline. beilstein:4299976|beilstein:95671|cas:485-19-8|kegg.compound:C02105|knapsack:C00001910|pdb-ccd:REN Graph (+)-Reticuline|(+)-reticuline|(1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-(+)-reticuline|(S)-Reticuline|L-(+)-Reticuline|Reticline (1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (+)-Reticuline|(+)-reticuline|(1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-(+)-reticuline|(S)-Reticuline|L-(+)-Reticuline|Reticline http://purl.obolibrary.org/obo/CHEBI_16718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167181 biolink:ChemicalEntity deoxyribonucleotide-(2'-deoxyribose)-deoxyribonucleotide residue(3-) pubmed:22375014 Graph a deoxyribonucleotide-(2'-deoxyribose)-deoxyribonucleotide residue a deoxyribonucleotide-(2'-deoxyribose)-deoxyribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_167181 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167183 biolink:ChemicalEntity piscicide A substance which is poisonous to fish and is primarily used to eliminate dominant species of fish in water. wikipedia.en:Piscicide Graph piscicides piscicides http://purl.obolibrary.org/obo/CHEBI_167183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16719 biolink:ChemicalEntity (R)-pantolactone A butan-4-olide that is dihydrofuran-2(3H)-one substituted by a hydroxy group at position 3 and two methyl groups at position 4 (the R-stereoisomer). cas:599-04-2|hmdb:HMDB0059876|kegg.compound:C01012|metacyc.compound:PANTOYL-LACTONE|pubmed:15195978|pubmed:7020480|reaxys:80957|ymdb:YMDB00796 Graph (3R)-3-hydroxy-4,4-dimethyldihydrofuran-2(3H)-one|(3R)-Dihydro-3-hydroxy-4,4-dimethyl-2(3H)-Furanone|(3R)-dihydro-3-hydroxy-4,4-dimethyl-2(3H)-furanone|(R)-Pantolactone|(R)-Pantoyl lactone|(R)-pantolactone|(R)-pantoyl lactone (3R)-3-hydroxy-4,4-dimethyldihydrofuran-2(3H)-one (3R)-3-hydroxy-4,4-dimethyldihydrofuran-2(3H)-one|(3R)-Dihydro-3-hydroxy-4,4-dimethyl-2(3H)-Furanone|(3R)-dihydro-3-hydroxy-4,4-dimethyl-2(3H)-furanone|(R)-Pantolactone|(R)-Pantoyl lactone|(R)-pantolactone|(R)-pantoyl lactone http://purl.obolibrary.org/obo/CHEBI_16719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167204 biolink:ChemicalEntity 4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide A benzamide resulting from the formal condensation of the carboxy group of 4-amino-5-chloro-2-ethoxybenzoic acid with the amino group of 1-[4-(4-fluorobenzyl)morpholin-2-yl]methanamine. Graph 4-amino-5-chloro-2-ethoxy-N-((4-(4-fluorobenzyl)-2-morpholinyl)methyl)benzamide|4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide 4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide 4-amino-5-chloro-2-ethoxy-N-((4-(4-fluorobenzyl)-2-morpholinyl)methyl)benzamide|4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide http://purl.obolibrary.org/obo/CHEBI_167204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167205 biolink:ChemicalEntity (R)-mosapride A 4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide that has (R)-configuration. cas:156925-24-5 Graph 4-amino-5-chloro-2-ethoxy-N-{[(2R)-4-(4-fluorobenzyl)morpholin-2-yl]methyl}benzamide 4-amino-5-chloro-2-ethoxy-N-{[(2R)-4-(4-fluorobenzyl)morpholin-2-yl]methyl}benzamide 4-amino-5-chloro-2-ethoxy-N-{[(2R)-4-(4-fluorobenzyl)morpholin-2-yl]methyl}benzamide http://purl.obolibrary.org/obo/CHEBI_167205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167206 biolink:ChemicalEntity (S)-mosapride A 4-amino-5-chloro-2-ethoxy-N-({4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide that has (S)-configuration. cas:156925-23-4 Graph 4-amino-5-chloro-2-ethoxy-N-({(2S)-4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide 4-amino-5-chloro-2-ethoxy-N-({(2S)-4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide 4-amino-5-chloro-2-ethoxy-N-({(2S)-4-[(4-fluorophenyl)methyl]morpholin-2-yl}methyl)benzamide http://purl.obolibrary.org/obo/CHEBI_167206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167216 biolink:ChemicalEntity phosphatidylcholine O-16:0_16:1 Graph PC O-16:0_16:1|PC(O-16:0_16:1)|phosphatidylcholine(O-16:0_16:1) PC O-16:0_16:1|PC(O-16:0_16:1)|phosphatidylcholine(O-16:0_16:1) http://purl.obolibrary.org/obo/CHEBI_167216 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167217 biolink:ChemicalEntity phosphatidylcholine O-16:0_20:4 Graph PC O-16:0_20:4|PC(O-16:0_20:4)|phosphatidylcholine(O-16:0_20:4) PC O-16:0_20:4|PC(O-16:0_20:4)|phosphatidylcholine(O-16:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167217 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167218 biolink:ChemicalEntity phosphatidylcholine O-16:1_18:1 Graph PC O-16:1_18:1|PC(O-16:1_18:1)|phosphatidylcholine(O-16:1_18:1) PC O-16:1_18:1|PC(O-16:1_18:1)|phosphatidylcholine(O-16:1_18:1) http://purl.obolibrary.org/obo/CHEBI_167218 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167219 biolink:ChemicalEntity phosphatidylcholine O-18:1_16:0 Graph PC O-18:1_16:0|PC(O-18:1_16:0)|phosphatidylcholine(O-18:1_16:0) PC O-18:1_16:0|PC(O-18:1_16:0)|phosphatidylcholine(O-18:1_16:0) http://purl.obolibrary.org/obo/CHEBI_167219 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167223 biolink:ChemicalEntity phosphatidylethanolamine O-16:1_18:2 Graph PE O-16:1_18:2|PE(O-16:1_18:2)|phosphatidylethanolamine(O-16:1_18:2) PE O-16:1_18:2|PE(O-16:1_18:2)|phosphatidylethanolamine(O-16:1_18:2) http://purl.obolibrary.org/obo/CHEBI_167223 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167225 biolink:ChemicalEntity phosphatidylethanolamine O-16:1_20:4 Graph PE O-16:1_20:4|PE(O-16:1_20:4)|phosphatidylethanolamine(O-16:1_20:4) PE O-16:1_20:4|PE(O-16:1_20:4)|phosphatidylethanolamine(O-16:1_20:4) http://purl.obolibrary.org/obo/CHEBI_167225 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167228 biolink:ChemicalEntity phosphatidylethanolamine O-18:1_20:4 Graph PE O-18:1_20:4|PE(O-18:1_20:4)|phosphatidylethanolamine(O-18:1_20:4) PE O-18:1_20:4|PE(O-18:1_20:4)|phosphatidylethanolamine(O-18:1_20:4) http://purl.obolibrary.org/obo/CHEBI_167228 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16723 biolink:ChemicalEntity 4-methylthio-2-oxobutanoate The 2-oxo monocarboxylic acid anion derived from 4-methylthio-2-oxobutanoic acid. The major microspecies at pH 7.3, it is formed from L-methionine via the action of methionine transaminase. beilstein:3662236|kegg.compound:C01180|metacyc.compound:CPD-479|pubmed:10074065|pubmed:15280032 Graph 2-oxo-4-methylthiobutanoate|4-(methylsulfanyl)-2-oxobutanoate|4-methylsulfanyl-2-oxobutanoate 4-(methylsulfanyl)-2-oxobutanoate 2-oxo-4-methylthiobutanoate|4-(methylsulfanyl)-2-oxobutanoate|4-methylsulfanyl-2-oxobutanoate http://purl.obolibrary.org/obo/CHEBI_16723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167230 biolink:ChemicalEntity phosphatidylethanolamine O-18:2_18:2 Graph PE O-18:2_18:2|PE(O-18:2_18:2)|phosphatidylethanolamine(O-18:2_18:2) PE O-18:2_18:2|PE(O-18:2_18:2)|phosphatidylethanolamine(O-18:2_18:2) http://purl.obolibrary.org/obo/CHEBI_167230 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167232 biolink:ChemicalEntity phosphatidylethanolamine O-18:2_20:4 Graph PE O-18:2_20:4|PE(O-18:2_20:4)|phosphatidylethanolamine(O-18:2_20:4) PE O-18:2_20:4|PE(O-18:2_20:4)|phosphatidylethanolamine(O-18:2_20:4) http://purl.obolibrary.org/obo/CHEBI_167232 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16724 biolink:ChemicalEntity 4-hydroxybutyrate A 4-hydroxy monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of 4-hydroxybutyric acid. beilstein:3903887|drugbank:DB01440|gmelin:1524032|kegg.compound:C00989|umbbd.compound:c0022 Graph 4-hydroxybutanoate|GHB|gamma-hydroxybutyrate 4-hydroxybutanoate 4-hydroxybutanoate|GHB|gamma-hydroxybutyrate http://purl.obolibrary.org/obo/CHEBI_16724 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167242 biolink:ChemicalEntity phosphatidylcholine 14:0_16:0 Graph PC 14:0_16:0|PC(14:0_16:0)|phosphatidylcholine(14:0_16:0) PC 14:0_16:0|PC(14:0_16:0)|phosphatidylcholine(14:0_16:0) http://purl.obolibrary.org/obo/CHEBI_167242 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167246 biolink:ChemicalEntity PC(16:0_16:1) A phosphatidylcholine 32:1 in which one acyl group has 16 carbons and is fully saturated while the other has 16 carbons and 1 double bond (position not specified). Graph PC 16:0_16:1|phosphatidylcholine 16:0_16:1|phosphatidylcholine(16:0_16:1) PC 16:0_16:1|phosphatidylcholine 16:0_16:1|phosphatidylcholine(16:0_16:1) http://purl.obolibrary.org/obo/CHEBI_167246 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167247 biolink:ChemicalEntity phosphatidylcholine 16:0_17:1 Graph PC 16:0_17:1|PC(16:0_17:1)|phosphatidylcholine(16:0_17:1) PC 16:0_17:1|PC(16:0_17:1)|phosphatidylcholine(16:0_17:1) http://purl.obolibrary.org/obo/CHEBI_167247 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167248 biolink:ChemicalEntity phosphatidylcholine 16:0_18:0 Graph PC 16:0_18:0|PC(16:0_18:0)|phosphatidylcholine(16:0_18:0) PC 16:0_18:0|PC(16:0_18:0)|phosphatidylcholine(16:0_18:0) http://purl.obolibrary.org/obo/CHEBI_167248 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167249 biolink:ChemicalEntity PC(16:0_18:1) A phosphatidylcholine 34:1 in which one acyl group has 16 carbons and is fully saturated while the other has 18 carbons and 1 double bond (position not specified). Graph PC 16:0_18:1|phosphatidylcholine 16:0_18:1|phosphatidylcholine(16:0_18:1) PC 16:0_18:1|phosphatidylcholine 16:0_18:1|phosphatidylcholine(16:0_18:1) http://purl.obolibrary.org/obo/CHEBI_167249 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16725 biolink:ChemicalEntity 2,3-dihydroxy-p-cumic acid beilstein:2722152|cas:19420-61-2|kegg.compound:C06580 Graph 2,3-Dihydroxy-p-cumate|2,3-dihydroxy-4-(1-methylethyl)benzoic acid|2,3-dihydroxy-4-(propan-2-yl)benzoic acid|2,3-dihydroxy-4-isopropylbenzoic acid|4-isopropyl-o-pyrocatechuic acid 2,3-dihydroxy-4-(propan-2-yl)benzoic acid 2,3-Dihydroxy-p-cumate|2,3-dihydroxy-4-(1-methylethyl)benzoic acid|2,3-dihydroxy-4-(propan-2-yl)benzoic acid|2,3-dihydroxy-4-isopropylbenzoic acid|4-isopropyl-o-pyrocatechuic acid http://purl.obolibrary.org/obo/CHEBI_16725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167250 biolink:ChemicalEntity PC(16:0_20:4) A phosphatidylcholine 36:4 in which one acyl group has 16 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PC 16:0_20:4|phosphatidylcholine 16:0_20:4|phosphatidylcholine(16:0_20:4) PC 16:0_20:4|phosphatidylcholine 16:0_20:4|phosphatidylcholine(16:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167250 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167251 biolink:ChemicalEntity PC(16:0_22:4) A phosphatidylcholine 38:4 in which one acyl group has 16 carbons and is fully saturated while the other has 22 carbons and 4 double bonds (position not specified). Graph PC 16:0_22:4|phosphatidylcholine 16:0_22:4|phosphatidylcholine(16:0_22:4) PC 16:0_22:4|phosphatidylcholine 16:0_22:4|phosphatidylcholine(16:0_22:4) http://purl.obolibrary.org/obo/CHEBI_167251 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167253 biolink:ChemicalEntity PC(16:1_18:1) A phosphatidylcholine 34:2 in which one acyl group has 16 carbons and 1 double bond while the other has 18 carbons and 1 double bond (position not specified). Graph PC 16:1_18:1|phosphatidylcholine 16:1_18:1|phosphatidylcholine(16:1_18:1) PC 16:1_18:1|phosphatidylcholine 16:1_18:1|phosphatidylcholine(16:1_18:1) http://purl.obolibrary.org/obo/CHEBI_167253 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167254 biolink:ChemicalEntity PC(17:0_18:1) A phosphatidylcholine 35:1 in which one acyl group has 17 carbons and is fully saturated while the other has 18 carbons and 1 double bond (position not specified). Graph PC 17:0_18:1|phosphatidylcholine 17:0_18:1|phosphatidylcholine(17:0_18:1) PC 17:0_18:1|phosphatidylcholine 17:0_18:1|phosphatidylcholine(17:0_18:1) http://purl.obolibrary.org/obo/CHEBI_167254 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167255 biolink:ChemicalEntity PC(18:0_18:1) A phosphatidylcholine 36:1 in which one acyl group has 18 carbons and is fully saturated while the other has 18 carbons and 1 double bond (position not specified). Graph PC 18:0_18:1|phosphatidylcholine 18:0_18:1|phosphatidylcholine(18:0_18:1) PC 18:0_18:1|phosphatidylcholine 18:0_18:1|phosphatidylcholine(18:0_18:1) http://purl.obolibrary.org/obo/CHEBI_167255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167256 biolink:ChemicalEntity PC(18:0_20:4) A phosphatidylcholine 38:4 in which one acyl group has 18 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PC 18:0_20:4|phosphatidylcholine 18:0_20:4|phosphatidylcholine(18:0_20:4) PC 18:0_20:4|phosphatidylcholine 18:0_20:4|phosphatidylcholine(18:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167256 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167257 biolink:ChemicalEntity PC(18:1_18:1) A phosphatidylcholine 36:2 in which both acyl groups have 18 carbons and 1 double bond each (position not specified). Graph PC 18:1_18:1|phosphatidylcholine 18:1_18:1|phosphatidylcholine(18:1_18:1) PC 18:1_18:1|phosphatidylcholine 18:1_18:1|phosphatidylcholine(18:1_18:1) http://purl.obolibrary.org/obo/CHEBI_167257 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167259 biolink:ChemicalEntity PC(18:1_20:4) A phosphatidylcholine 38:5 in which one acyl group has 18 carbons and 1 double bond while the other has 20 carbons and 4 double bonds (position not specified). Graph PC 18:1_20:4|phosphatidylcholine 18:1_20:4|phosphatidylcholine(18:1_20:4) PC 18:1_20:4|phosphatidylcholine 18:1_20:4|phosphatidylcholine(18:1_20:4) http://purl.obolibrary.org/obo/CHEBI_167259 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167261 biolink:ChemicalEntity PE(16:0_20:4) A phosphatidylethanolamine 36:4 in which one acyl group has 16 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PE 16:0_20:4|phosphatidylethanolamine 16:0_20:4|phosphatidylethanolamine(16:0_20:4) PE 16:0_20:4|phosphatidylethanolamine 16:0_20:4|phosphatidylethanolamine(16:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167261 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16727 biolink:ChemicalEntity 3-maleylpyruvate(2-) kegg.compound:C02167 Graph (2Z)-4,6-dioxohept-2-enedioate|3-maleylpyruvate (2Z)-4,6-dioxohept-2-enedioate (2Z)-4,6-dioxohept-2-enedioate|3-maleylpyruvate http://purl.obolibrary.org/obo/CHEBI_16727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167270 biolink:ChemicalEntity phosphatidylinositol 16:0_18:1 Graph PI 16:0_18:1|PI(16:0_18:1)|phosphatidylinositol(16:0_18:1) PI 16:0_18:1|PI(16:0_18:1)|phosphatidylinositol(16:0_18:1) http://purl.obolibrary.org/obo/CHEBI_167270 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167272 biolink:ChemicalEntity PI(16:0_20:4) A phosphatidylinositol 36:4 in which one acyl group has 16 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PI 16:0_20:4|phosphatidylinositol 16:0_20:4|phosphatidylinositol(16:0_20:4) PI 16:0_20:4|phosphatidylinositol 16:0_20:4|phosphatidylinositol(16:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167272 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167273 biolink:ChemicalEntity PI(18:0_18:1) A phosphatidylinositol 36:1 in which one acyl group has 18 carbons and is fully saturated while the other has 18 carbons and 1 double bond (position not specified). Graph PI 18:0_18:1|phosphatidylinositol 18:0_18:1|phosphatidylinositol(18:0_18:1) PI 18:0_18:1|phosphatidylinositol 18:0_18:1|phosphatidylinositol(18:0_18:1) http://purl.obolibrary.org/obo/CHEBI_167273 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167275 biolink:ChemicalEntity PI(18:0_20:3) A phosphatidylinositol 38:3 in which one acyl group has 18 carbons and is fully saturated while the other has 20 carbons and 3 double bonds (position not specified). Graph PI 18:0_20:3|phosphatidylinositol 18:0_20:3|phosphatidylinositol(18:0_20:3) PI 18:0_20:3|phosphatidylinositol 18:0_20:3|phosphatidylinositol(18:0_20:3) http://purl.obolibrary.org/obo/CHEBI_167275 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167276 biolink:ChemicalEntity PI(18:0_20:4) A phosphatidylinositol 38:4 in which one acyl group has 18 carbons and is fully saturated while the other has 20 carbons and 4 double bonds (position not specified). Graph PI 18:0_20:4|phosphatidylinositol 18:0_20:4|phosphatidylinositol(18:0_20:4) PI 18:0_20:4|phosphatidylinositol 18:0_20:4|phosphatidylinositol(18:0_20:4) http://purl.obolibrary.org/obo/CHEBI_167276 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16728 biolink:ChemicalEntity 2-acyl-sn-glycero-3-phosphocholine(1+) A 2-acylglycerophosphocholine in which the glycerol moiety has sn stereochemistry and which has an unspecified acyl group attached at the 2-position. kegg.compound:C04233|pubmed:15913955 Graph 1-Lysolecithin|1-Lysophosphatidylcholine|2-Acyl-sn-glycero-3-phosphocholine|2-Acylglycero-3-phosphocholine|2-acyl-sn-glycero-3-phosphocholines|3-Lysolecithin|LPC|l-alpha-lysophosphatidylcholine 1-Lysolecithin|1-Lysophosphatidylcholine|2-Acyl-sn-glycero-3-phosphocholine|2-Acylglycero-3-phosphocholine|2-acyl-sn-glycero-3-phosphocholines|3-Lysolecithin|LPC|l-alpha-lysophosphatidylcholine http://purl.obolibrary.org/obo/CHEBI_16728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16729 biolink:ChemicalEntity formyl dihydrogen phosphate kegg.compound:C02405 Graph (formyloxy)phosphonic acid|Formyl phosphate|formic phosphoric monoanhydride|formyl dihydrogen phosphate (formyloxy)phosphonic acid|Formyl phosphate|formic phosphoric monoanhydride (formyloxy)phosphonic acid|Formyl phosphate|formic phosphoric monoanhydride|formyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_16729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16730 biolink:ChemicalEntity chloramphenicol 3-acetate kegg.compound:C03601 Graph (2R,3R)-2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl acetate|Chloramphenicol 3-acetate|chloramphenicol 3-acetate (2R,3R)-2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl acetate (2R,3R)-2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl acetate|Chloramphenicol 3-acetate|chloramphenicol 3-acetate http://purl.obolibrary.org/obo/CHEBI_16730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167306 biolink:ChemicalEntity phosphatidylcholine 16:0_16:0 Graph PC 16:0_16:0|PC(16:0_16:0)|phosphatidylcholine(16:0_16:0) PC 16:0_16:0|PC(16:0_16:0)|phosphatidylcholine(16:0_16:0) http://purl.obolibrary.org/obo/CHEBI_167306 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167308 biolink:ChemicalEntity dextromethadone A 6-(dimethylamino)-4,4-diphenylheptan-3-one that has (S)-configuration. It is the less active enantiomer of methadone and has very little activity on opioid receptors and mainly responsible for the inhibition of hERG K+ channels and thus for cardiac toxicity. The drug is currently under clinical development for the treatment of major depressive disorder. cas:5653-80-5|chemspider:559067|drugbank:DB15198|pubmed:21175445|pubmed:23249875|pubmed:23935979|pubmed:27055456|pubmed:27456067|pubmed:27974484|pubmed:29458047|pubmed:30907440|pubmed:31091116|pubmed:31368772|pubmed:31454827|pubmed:32302325|pubmed:33345336|reaxys:3213667|wikipedia.en:Dextromethadone Graph (+)-(S)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(+)-methadone|(6S)-6-(dimethylamino)-4,4-diphenylheptan-3-one|(6S)-methadone|(S)-(+)-methadone|(S)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(S)-methadone|REL-1017|S-(+)-methadone|S-methadone|d-6-(dimethylamino)-4,4-diphenyl-3-heptanone|d-methadone (6S)-6-(dimethylamino)-4,4-diphenylheptan-3-one (+)-(S)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(+)-methadone|(6S)-6-(dimethylamino)-4,4-diphenylheptan-3-one|(6S)-methadone|(S)-(+)-methadone|(S)-6-(dimethylamino)-4,4-diphenyl-3-heptanone|(S)-methadone|REL-1017|S-(+)-methadone|S-methadone|d-6-(dimethylamino)-4,4-diphenyl-3-heptanone|d-methadone http://purl.obolibrary.org/obo/CHEBI_167308 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167309 biolink:ChemicalEntity 6-(dimethylamino)-4,4-diphenylheptan-3-one A ketone that is heptan-3-one substituted by a dimethylamino group at position 6 and two phenyl groups at position 4. Graph 6-(dimethylamino)-4,4-diphenyl-3-heptanone|6-(dimethylamino)-4,4-diphenylheptan-3-one 6-(dimethylamino)-4,4-diphenylheptan-3-one 6-(dimethylamino)-4,4-diphenyl-3-heptanone|6-(dimethylamino)-4,4-diphenylheptan-3-one http://purl.obolibrary.org/obo/CHEBI_167309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16731 biolink:ChemicalEntity (E)-cinnamaldehyde The E (trans) stereoisomer of cinnamaldehyde, the parent of the class of cinnamaldehydes. bpdb:1069|cas:14371-10-9|hmdb:HMDB0003441|kegg.compound:C00903|knapsack:C00002725|knapsack:C00035187|pubmed:11975643|pubmed:17140783|pubmed:17662960|pubmed:18218683|pubmed:19845671|pubmed:20431333|pubmed:20955755|pubmed:21266172|pubmed:21388814|pubmed:21394803|pubmed:21466812|pubmed:21469739|pubmed:21517069|pubmed:21603596|pubmed:21708228|pubmed:21767279|pubmed:21788726|pubmed:29079364|reaxys:1071571|wikipedia.en:Cinnamaldehyde Graph (3E)-3-phenylprop-2-enal|(E)-3-Phenyl-2-propenal|(E)-3-Phenyl-propenal|(E)-3-Phenylpropenal|(E)-Cinnamaldehyde|(E)-Cinnamic aldehyde|(E)-cinnamaldehyde|(E)-phenylvinyl aldehyde|3-phenylacrylaldehyde|Cinnamaldehyde|trans-Cinnamic aldehyde (3E)-3-phenylprop-2-enal (3E)-3-phenylprop-2-enal|(E)-3-Phenyl-2-propenal|(E)-3-Phenyl-propenal|(E)-3-Phenylpropenal|(E)-Cinnamaldehyde|(E)-Cinnamic aldehyde|(E)-cinnamaldehyde|(E)-phenylvinyl aldehyde|3-phenylacrylaldehyde|Cinnamaldehyde|trans-Cinnamic aldehyde http://purl.obolibrary.org/obo/CHEBI_16731 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16732 biolink:ChemicalEntity CDP-ethanolamine A phosphoethanolamine consisting of ethanolamine having a cytidine 5'-diphosphate moiety attached to the oxygen. beilstein:67058|cas:3036-18-8|kegg.compound:C00570 Graph 5'-O-[{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]cytidine|CDP ethanolamine|Cytidine diphosphate ethanolamine|cytidine 5'-(trihydrogen diphosphate), P'-(2-aminoethyl) ester|cytidine 5'-[3-(2-aminoethyl) dihydrogen diphosphate]|cytidine diphosphate ethanolamine 5'-O-[{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]cytidine|cytidine 5'-[3-(2-aminoethyl) dihydrogen diphosphate] 5'-O-[{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]cytidine|CDP ethanolamine|Cytidine diphosphate ethanolamine|cytidine 5'-(trihydrogen diphosphate), P'-(2-aminoethyl) ester|cytidine 5'-[3-(2-aminoethyl) dihydrogen diphosphate]|cytidine diphosphate ethanolamine http://purl.obolibrary.org/obo/CHEBI_16732 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167322 biolink:ChemicalEntity N(omega)-(N-acetyl-beta-D-glucosaminyl)-L-arginyl(1+) residue pubmed:23955153|pubmed:24025841|pubmed:30979585 Graph N(omega)-(N-acetyl-beta-D-glucosaminyl)-L-arginyl residue N(omega)-(N-acetyl-beta-D-glucosaminyl)-L-arginyl residue http://purl.obolibrary.org/obo/CHEBI_167322 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16733 biolink:ChemicalEntity D-alpha-amino acid kegg.compound:C00405 Graph D-Amino acid|D-alpha-amino acid|D-alpha-amino acids D-alpha-amino acids D-Amino acid|D-alpha-amino acid|D-alpha-amino acids http://purl.obolibrary.org/obo/CHEBI_16733 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16734 biolink:ChemicalEntity N-acetyl-D-tryptophan The N-acetyl derivative of D-tryptophan. beilstein:89477|cas:2280-01-5|kegg.compound:C03137 Graph (2R)-2-acetamido-3-(1H-indol-3-yl)propanoic acid|N-Acetyl-D-tryptophan|N-acetyl-D-tryptophan (2R)-2-acetamido-3-(1H-indol-3-yl)propanoic acid|N-Acetyl-D-tryptophan|N-acetyl-D-tryptophan (2R)-2-acetamido-3-(1H-indol-3-yl)propanoic acid|N-Acetyl-D-tryptophan|N-acetyl-D-tryptophan http://purl.obolibrary.org/obo/CHEBI_16734 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167345 biolink:ChemicalEntity Cedrene chemspider:454638 Graph 2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-ene 2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-ene 2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-ene http://purl.obolibrary.org/obo/CHEBI_167345 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16735 biolink:ChemicalEntity 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-6-O-sulfo-D-glucopyranose kegg.compound:C04865 Graph 2-acetamido-2-deoxy-6-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 6-sulfate|4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 6-sulfate 2-acetamido-2-deoxy-6-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid 2-acetamido-2-deoxy-6-O-sulfo-D-galactopyranos-3-O-yl 4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid|4-Deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 6-sulfate|4-deoxy-beta-D-gluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine 6-sulfate http://purl.obolibrary.org/obo/CHEBI_16735 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16737 biolink:ChemicalEntity creatinine A lactam obtained by formal cyclocondensation of creatine. It is a metabolite of creatine. cas:60-27-5|hmdb:HMDB0000562|kegg.compound:C00791|kegg.drug:D03600|metacyc.compound:CREATININE|pubmed:11256540|pubmed:11981083|pubmed:17190852|pubmed:17422601|pubmed:18182718|pubmed:19236048|pubmed:19715855|pubmed:19968328|pubmed:21775764|pubmed:22047975|pubmed:22121923|pubmed:22166252|pubmed:22207347|pubmed:22212624|pubmed:22223530|pubmed:22331238|pubmed:22338083|pubmed:22349552|pubmed:22390548|pubmed:22432114|pubmed:22441184|pubmed:22459582|pubmed:22498455|reaxys:112064|wikipedia.en:Creatinine Graph 1-Methylglycocyamidine|1-Methylhydantoin-2-imide|1-methylglycocyamidine|2-Amino-1-methylimidazolin-4-one|2-amino-1,5-dihydro-1-methyl-4H-Imidazol-4-one|2-imino-1-methylimidazolidin-4-one|Creatine anhydride|Creatinine|Kreatinin|creatinina|creatinine 2-imino-1-methylimidazolidin-4-one 1-Methylglycocyamidine|1-Methylhydantoin-2-imide|1-methylglycocyamidine|2-Amino-1-methylimidazolin-4-one|2-amino-1,5-dihydro-1-methyl-4H-Imidazol-4-one|2-imino-1-methylimidazolidin-4-one|Creatine anhydride|Creatinine|Kreatinin|creatinina|creatinine http://purl.obolibrary.org/obo/CHEBI_16737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16738 biolink:ChemicalEntity 2,4-dichlorophenol A dichlorophenol that is phenol carrying chloro substituents at positions 2 and 4. cas:120-83-2|gmelin:261170|hmdb:HMDB0004811|kegg.compound:C02625|metacyc.compound:24-DICHLOROPHENOL|pubmed:10633543|reaxys:742467|umbbd.compound:c0289|wikipedia.en:2,4-Dichlorophenol Graph 2,4-Dichlorophenol|2,4-dichlorophenol 2,4-Dichlorophenol|2,4-dichlorophenol 2,4-Dichlorophenol|2,4-dichlorophenol http://purl.obolibrary.org/obo/CHEBI_16738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16739 biolink:ChemicalEntity 2-furoate A furancarboxylate that is the conjugate base of 2-furoic acid. beilstein:1366018|gmelin:326316|kegg.compound:C01546 Graph 2-furoate|furan-2-carboxylate furan-2-carboxylate 2-furoate|furan-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_16739 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16740 biolink:ChemicalEntity trans-cyclohexa-3,5-diene-1,2-diol beilstein:3195290|gmelin:1866786 Graph rel-(1R,2R)-cyclohexa-3,5-diene-1,2-diol|trans-1,2-dihydrobenzene-1,2-diol rel-(1R,2R)-cyclohexa-3,5-diene-1,2-diol rel-(1R,2R)-cyclohexa-3,5-diene-1,2-diol|trans-1,2-dihydrobenzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16740 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16741 biolink:ChemicalEntity 4-(beta-D-glucosyloxy)benzoic acid A β-D-glucoside of 4-hydroxybenzoic acid. kegg.compound:C03993|pubmed:15675800|pubmed:17827684|pubmed:18348529|reaxys:33159 Graph 4-(beta-D-glucopyranosyloxy)benzoic acid|4-Hydroxybenzoate-O-glucoside|4-O-beta-D-glucopyranosyl-p-hydroxybenzoic acid|4-hydroxybenzoic acid 4-O-beta-D-glucopyranoside|p-hydroxybenzoic acid 4-O-beta-D-glucopyranoside|p-hydroxybenzoic acid beta-D-glucopyranoside 4-(beta-D-glucopyranosyloxy)benzoic acid 4-(beta-D-glucopyranosyloxy)benzoic acid|4-Hydroxybenzoate-O-glucoside|4-O-beta-D-glucopyranosyl-p-hydroxybenzoic acid|4-hydroxybenzoic acid 4-O-beta-D-glucopyranoside|p-hydroxybenzoic acid 4-O-beta-D-glucopyranoside|p-hydroxybenzoic acid beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_16741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16742 biolink:ChemicalEntity orotic acid A pyrimidinemonocarboxylic acid that is uracil bearing a carboxy substituent at position C-6. cas:65-86-1|drugbank:DB02262|drugcentral:3402|gmelin:101990|hmdb:HMDB0000226|kegg.compound:C00295|kegg.drug:D00055|knapsack:C00019689|metacyc.compound:OROTATE|pdb-ccd:ORO|pubmed:11059538|pubmed:22019295|pubmed:22285839|pubmed:22307261|pubmed:22371390|pubmed:22634191|pubmed:22707164|pubmed:22770225|pubmed:22863860|pubmed:7264771|reaxys:383901|wikipedia.en:Orotic_acid Graph 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid|OROTIC ACID|Orotic acid|Orotsaeure|Uracil-6-carboxylic acid 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid|OROTIC ACID|Orotic acid|Orotsaeure|Uracil-6-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_16742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16743 biolink:ChemicalEntity D-tagatose 1,6-bisphosphate A ketohexose bisphosphate that is D-tagatose carrying phosphate groups at positions 1 and 6. pubmed:12003946 Graph 1,6-di-O-phosphono-D-lyxo-hex-2-ulose|1,6-di-O-phosphono-D-tagatose|D-lyxo-hex-2-ulose 1,6-bis(dihydrogen phosphate)|D-tagatose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-D-lyxo-hex-2-ulose|1,6-di-O-phosphono-D-tagatose|D-lyxo-hex-2-ulose 1,6-bis(dihydrogen phosphate)|D-tagatose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-D-lyxo-hex-2-ulose|1,6-di-O-phosphono-D-tagatose|D-lyxo-hex-2-ulose 1,6-bis(dihydrogen phosphate)|D-tagatose 1,6-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16743 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16744 biolink:ChemicalEntity pregna-4,9(11)-diene-3,20-dione kegg.compound:C04084 Graph Pregna-4,9(11)-diene-3,20-dione|pregna-4,9(11)-diene-3,20-dione Pregna-4,9(11)-diene-3,20-dione|pregna-4,9(11)-diene-3,20-dione Pregna-4,9(11)-diene-3,20-dione|pregna-4,9(11)-diene-3,20-dione http://purl.obolibrary.org/obo/CHEBI_16744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167445 biolink:ChemicalEntity N(omega)-(6-deoxy-alpha-L-mannosyl)-L-arginyl(2+) residue pubmed:28451135|pubmed:28951478 Graph N(omega)-(alpha-L-rhamnosyl)-L-arginyl residue N(omega)-(alpha-L-rhamnosyl)-L-arginyl residue http://purl.obolibrary.org/obo/CHEBI_167445 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167457 biolink:ChemicalEntity poly[(R)-3-hydroxyalkanoate] Graph poly[(R)-3-hydroxyalkanoate] poly[(R)-3-hydroxyalkanoate] http://purl.obolibrary.org/obo/CHEBI_167457 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16746 biolink:ChemicalEntity 1,2,3,5-tetrahydroxybenzene cas:634-94-6|kegg.compound:C03743 Graph 1,2,3,5-Tetrahydroxybenzene|1,2,3,5-tetrahydroxybenzene|benzene-1,2,3,5-tetrol benzene-1,2,3,5-tetrol 1,2,3,5-Tetrahydroxybenzene|1,2,3,5-tetrahydroxybenzene|benzene-1,2,3,5-tetrol http://purl.obolibrary.org/obo/CHEBI_16746 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16747 biolink:ChemicalEntity 4-methylene-L-glutamine A non-proteinogenic L-α-amino acid that is L-glutamine in which the hydrogens attached to the carbon γ to the carboxy group are replaced by a methylene group. kegg.compound:C01109 Graph (2S)-2-amino-4-carbamoylpent-4-enoic acid|4-Methylene-L-glutamine|4-methylidene-L-glutamine (2S)-2-amino-4-carbamoylpent-4-enoic acid|4-methylidene-L-glutamine (2S)-2-amino-4-carbamoylpent-4-enoic acid|4-Methylene-L-glutamine|4-methylidene-L-glutamine http://purl.obolibrary.org/obo/CHEBI_16747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16749 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol A phosphatidylinositol in which the inositol moiety is the 1D-myo isomer and the phosphatidyl group is located at its position 1. kegg.compound:C01194|pubmed:28600633 Graph (3-Phosphatidyl)-1-D-inositol|1,2-diacyl-sn-glycero(3)phospho(1)-D-myo-inositol|1-(3-sn-phosphatidyl)-D-myo-inositol|1-O-(3-sn-phosphatidyl)-1D-myo-inositol|1-Phosphatidyl-1D-myo-inositol|1-Phosphatidyl-D-myo-inositol|1-Phosphatidyl-myo-inositol|Phosphatidyl-1D-myo-inositol|Phosphatidylinositol|PtdIns|phosphoinositide 1-O-(3-sn-phosphatidyl)-1D-myo-inositol (3-Phosphatidyl)-1-D-inositol|1,2-diacyl-sn-glycero(3)phospho(1)-D-myo-inositol|1-(3-sn-phosphatidyl)-D-myo-inositol|1-O-(3-sn-phosphatidyl)-1D-myo-inositol|1-Phosphatidyl-1D-myo-inositol|1-Phosphatidyl-D-myo-inositol|1-Phosphatidyl-myo-inositol|Phosphatidyl-1D-myo-inositol|Phosphatidylinositol|PtdIns|phosphoinositide http://purl.obolibrary.org/obo/CHEBI_16749 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167497 biolink:ChemicalEntity 1-O-(alk-1-enyl)-2-acyl-sn-glycerolipid A plasmalogen of unkown fatty acid composition and where the glycerolipid is not defined, R3 can be H or a phospholipid. Graph a 1-O-(1Z-alkenyl)-2-acyl-sn-glycerolipid|a plasmalogen a 1-O-(1Z-alkenyl)-2-acyl-sn-glycerolipid|a plasmalogen http://purl.obolibrary.org/obo/CHEBI_167497 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16750 biolink:ChemicalEntity guanosine A purine nucleoside in which guanine is attached to ribofuranose via a β-N9-glycosidic bond. cas:118-00-3|drugbank:DB02857|ecmdb:ECMDB00133|gmelin:55323|hmdb:HMDB0000133|kegg.compound:C00387|knapsack:C00019679|metacyc.compound:GUANOSINE|pdb-ccd:GMP|pubmed:11434576|pubmed:15471343|pubmed:15920424|pubmed:17060520|pubmed:17202332|pubmed:18191898|pubmed:18549801|pubmed:21435378|pubmed:21500353|pubmed:21515778|pubmed:21671255|pubmed:21774919|pubmed:2559771|reaxys:625911|wikipedia.en:Guanosine|ymdb:YMDB00509 Graph 2(3H)-imino-9-beta-D-ribofuranosyl-9H-purin-6(1H)-one|2-amino-1,9-dihydro-9-beta-D-ribofuranosyl-6H-purin-6-one|2-amino-9-beta-D-ribofuranosyl-1,9-dihydro-6H-purin-6-one|9-beta-D-ribofuranosyl-guanine|G|Guanine riboside|Guanine-9-beta-D-ribofuranoside|Guanosin|Guanosine|Guo|guanosine Guanosine|guanosine 2(3H)-imino-9-beta-D-ribofuranosyl-9H-purin-6(1H)-one|2-amino-1,9-dihydro-9-beta-D-ribofuranosyl-6H-purin-6-one|2-amino-9-beta-D-ribofuranosyl-1,9-dihydro-6H-purin-6-one|9-beta-D-ribofuranosyl-guanine|G|Guanine riboside|Guanine-9-beta-D-ribofuranoside|Guanosin|Guanosine|Guo|guanosine http://purl.obolibrary.org/obo/CHEBI_16750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16751 biolink:ChemicalEntity inulobiose A glycosyl glycoside comprising D-fructose attached to a D-fructofuranosyl residue via a β-(2→1)-linkage. cas:470-58-6|kegg.compound:C01711|kegg.glycan:G10528 Graph 1-O-beta-D-Fructo-furanosyl-D-fructose|1-O-beta-D-fructofuranosyl-D-fructose|D-fructosyl-2,1-alpha-D-fructose|Inulobiose|beta-D-fructofuranosyl-(2->1)-D-fructose|inulobiose 1-O-beta-D-fructofuranosyl-D-fructose|beta-D-fructofuranosyl-(2->1)-D-fructose 1-O-beta-D-Fructo-furanosyl-D-fructose|1-O-beta-D-fructofuranosyl-D-fructose|D-fructosyl-2,1-alpha-D-fructose|Inulobiose|beta-D-fructofuranosyl-(2->1)-D-fructose|inulobiose http://purl.obolibrary.org/obo/CHEBI_16751 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16752 biolink:ChemicalEntity erythro-5-phosphonooxy-L-lysine The 5-phosphonooxy derivative of L-lysine having erythro-stereochemistry. kegg.compound:C03366 Graph (2S,5R)-2,6-diamino-5-(phosphonooxy)hexanoic acid|(5R)-5-phosphonooxy-L-lysine|5-Phosphonooxy-L-lysine|O-Phosphohydroxy-L-lysine (2S,5R)-2,6-diamino-5-(phosphonooxy)hexanoic acid|(5R)-5-phosphonooxy-L-lysine (2S,5R)-2,6-diamino-5-(phosphonooxy)hexanoic acid|(5R)-5-phosphonooxy-L-lysine|5-Phosphonooxy-L-lysine|O-Phosphohydroxy-L-lysine http://purl.obolibrary.org/obo/CHEBI_16752 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167527 biolink:ChemicalEntity cis-2-enoyl-CoA(4-) A 2-enoyl-CoA in which the double bond between positions 2 and 3 of the S-acyl group has cis- geometry; major microspecies at pH 7.3 Graph (Z)-2-enoyl-CoA (Z)-2-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_167527 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16753 biolink:ChemicalEntity pantetheine An amide obtained by formal condensation of the carboxy group of pantothenic acid and the amino group of cysteamine. cas:496-65-1|chemspider:388453|foodb.food:FDB023172|hmdb:HMDB0003426|kegg.compound:C00831|metacyc.compound:CPD-511|pdb-ccd:PNY|pubmed:18805469|pubmed:21440446|pubmed:21912874|pubmed:21930947|reaxys:1714196|wikipedia.en:Pantetheine Graph (2R)-2,4-dihydroxy-3,3-dimethyl-N-{3-oxo-3-[(2-sulfanylethyl)amino]propyl}butanamide|(R)-Pantetheine|(R)-pantetheine|D-Pantetheine|Lactobacillus bulgaricus factor|Pantetheine (2R)-2,4-dihydroxy-3,3-dimethyl-N-{3-oxo-3-[(2-sulfanylethyl)amino]propyl}butanamide (2R)-2,4-dihydroxy-3,3-dimethyl-N-{3-oxo-3-[(2-sulfanylethyl)amino]propyl}butanamide|(R)-Pantetheine|(R)-pantetheine|D-Pantetheine|Lactobacillus bulgaricus factor|Pantetheine http://purl.obolibrary.org/obo/CHEBI_16753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16754 biolink:ChemicalEntity 4-carboxymethyl-3-methylbut-2-en-1,4-olide A 5-oxo-2-furylacetic acid having a 3-methyl substituent. kegg.compound:C04558 Graph (3-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|3-Methylmuconolactone|3-methylmuconolactone|4-Carboxymethyl-3-methylbut-2-en-1,4-olide|5-carboxymethyl-4-methylfuran-2(5H)-one (3-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid (3-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|3-Methylmuconolactone|3-methylmuconolactone|4-Carboxymethyl-3-methylbut-2-en-1,4-olide|5-carboxymethyl-4-methylfuran-2(5H)-one http://purl.obolibrary.org/obo/CHEBI_16754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16755 biolink:ChemicalEntity chenodeoxycholic acid A dihydroxy-5β-cholanic acid that is (5β)-cholan-24-oic acid substituted by hydroxy groups at positions 3 and 7 respectively. cas:474-25-9|drugbank:DB06777|drugcentral:4361|hmdb:HMDB0000518|kegg.compound:C02528|kegg.drug:D00163|lincs.smallmolecule:LSM-5353|lipidmaps:LMST04010032|pdb-ccd:JN3|pubmed:11530998|pubmed:16037564|pubmed:24448653|pubmed:24464484|reaxys:3219887|wikipedia.en:Chenodiol Graph 3alpha,7alpha-Dihydroxy-5beta-cholanic acid|3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid|7alpha-hydroxylithocholic acid|CDCA|Chenix|Chenodeoxycholic acid|Chenodiol|anthropodeoxycholic acid|anthropodesoxycholic acid|chenic acid|gallodesoxycholic acid 3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid 3alpha,7alpha-Dihydroxy-5beta-cholanic acid|3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid|7alpha-hydroxylithocholic acid|CDCA|Chenix|Chenodeoxycholic acid|Chenodiol|anthropodeoxycholic acid|anthropodesoxycholic acid|chenic acid|gallodesoxycholic acid http://purl.obolibrary.org/obo/CHEBI_16755 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167550 biolink:ChemicalEntity dodecene An alkene that is dodecane containing one double bond at unspecified position. Graph dodecene dodecene dodecene http://purl.obolibrary.org/obo/CHEBI_167550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167555 biolink:ChemicalEntity 2-dodecene A dodecene that is dodecane with a double bond at position 2. cas:1652-96-6|chemspider:19907027|pubmed:28188331 Graph dodec-2-ene|n-dodec-2-en dodec-2-ene dodec-2-ene|n-dodec-2-en http://purl.obolibrary.org/obo/CHEBI_167555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167559 biolink:ChemicalEntity glycan "Any oligosaccharide, polysaccharide or their derivatives consisting of monosaccharides or monosaccharide derivatives linked by glycosidic bonds. See also http://www.ontobee.org/ontology/GNO?iri=http://purl.obolibrary.org/obo/GNO_00000001." Graph glycans glycans http://purl.obolibrary.org/obo/CHEBI_167559 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167574 biolink:ChemicalEntity semaglutide A polypeptide that contains a linear sequence of 31 amino acids joined together by peptide linkages. It is an agonist of glucagon-like peptide-1 receptors (GLP-1 AR) and used for the treatment of type 2 diabetes. cas:910463-68-2|chemspider:34981134|drugbank:DB13928|kegg.drug:D10025|pubmed:24608440|pubmed:29431519|pubmed:30000039|pubmed:30741689|pubmed:31305048|pubmed:31486321|pubmed:31770356|pubmed:31801807|pubmed:31952996|pubmed:31975761|pubmed:32232400|pubmed:32476529|pubmed:32890462|pubmed:32921892|pubmed:33074557|pubmed:33108617|pubmed:33159658|pubmed:33179892|pubmed:33185364|pubmed:33222922|pubmed:33257834|pubmed:33354706|pubmed:33363667|pubmed:33417950|pubmed:33439580|pubmed:33439583|pubmed:33447122|pubmed:33565043|pubmed:33567185|pubmed:33591618|pubmed:33615400|pubmed:33627989|pubmed:33627997|pubmed:37541662|pubmed:38639998|pubmed:38673931|pubmed:38685990|pubmed:38938530|pubmed:39056124|pubmed:39763244|pubmed:39848681|pubmed:40009989|pubmed:40353578|wikipedia.en:Semaglutide Graph L-histidyl-2-methylalanyl-L-alpha-glutamylglycyl-L-threonyl-L-phenylalanyl-L-threonyl-L-seryl-L-alpha-aspartyl-L-valyl-L-seryl-L-seryl-L-tyrosyl-L-leucyl-L-alpha-glutamylglycyl-L-glutaminyl-L-alanyl-L-alanyl-N(6)-((N-(17-carboxyheptadecanoyl)-D-gamma-glutamyl)amino-10-oxo-3,6,12,15-tetraoxa-9-azaheptadecanan-1-oyl)-L-lysyl-L-alpha-glutamyl-L-phenylalanyl-L-isoleucyl-L-alanyl-L-tryptophyl-L-leucyl-L-valyl-L-arginylglycyl-L-arginylglycine|NN 9535|NN-9535|NN9535|NNC 0113-0217|NNC-0113-0217|Ozempic|Rybelsus L-histidyl-2-methylalanyl-L-alpha-glutamylglycyl-L-threonyl-L-phenylalanyl-L-threonyl-L-seryl-L-alpha-aspartyl-L-valyl-L-seryl-L-seryl-L-tyrosyl-L-leucyl-L-alpha-glutamylglycyl-L-glutaminyl-L-alanyl-L-alanyl-N(6)-((N-(17-carboxyheptadecanoyl)-D-gamma-glutamyl)amino-10-oxo-3,6,12,15-tetraoxa-9-azaheptadecanan-1-oyl)-L-lysyl-L-alpha-glutamyl-L-phenylalanyl-L-isoleucyl-L-alanyl-L-tryptophyl-L-leucyl-L-valyl-L-arginylglycyl-L-arginylglycine L-histidyl-2-methylalanyl-L-alpha-glutamylglycyl-L-threonyl-L-phenylalanyl-L-threonyl-L-seryl-L-alpha-aspartyl-L-valyl-L-seryl-L-seryl-L-tyrosyl-L-leucyl-L-alpha-glutamylglycyl-L-glutaminyl-L-alanyl-L-alanyl-N(6)-((N-(17-carboxyheptadecanoyl)-D-gamma-glutamyl)amino-10-oxo-3,6,12,15-tetraoxa-9-azaheptadecanan-1-oyl)-L-lysyl-L-alpha-glutamyl-L-phenylalanyl-L-isoleucyl-L-alanyl-L-tryptophyl-L-leucyl-L-valyl-L-arginylglycyl-L-arginylglycine|NN 9535|NN-9535|NN9535|NNC 0113-0217|NNC-0113-0217|Ozempic|Rybelsus http://purl.obolibrary.org/obo/CHEBI_167574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16758 biolink:ChemicalEntity 3-dehydrocarnitinium A quaternary ammonium ion that is the conjugate acid of 3-dehydrocarnitine. cas:10457-99-5|kegg.compound:C02636 Graph 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium|3-Dehydrocarnitine|3-carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium|3-carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium 3-carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium 3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium|3-Dehydrocarnitine|3-carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium|3-carboxy-N,N,N-trimethyl-2-oxopropan-1-aminium http://purl.obolibrary.org/obo/CHEBI_16758 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16760 biolink:ChemicalEntity phenanthrene-3,4-diol beilstein:2266540|cas:478-71-7|kegg.compound:C03164|umbbd.compound:c0435 Graph 3,4-Dihydroxyphenanthrene|3,4-dihydroxyphenanthrene|3,4-phenanthrenediol|Morphol|Phenanthrene-3,4-diol|phenanthrene-3,4-diol Phenanthrene-3,4-diol|phenanthrene-3,4-diol 3,4-Dihydroxyphenanthrene|3,4-dihydroxyphenanthrene|3,4-phenanthrenediol|Morphol|Phenanthrene-3,4-diol|phenanthrene-3,4-diol http://purl.obolibrary.org/obo/CHEBI_16760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167600 biolink:ChemicalEntity delgocitinib A pyrrolopyrimidine that is 7H-pyrrolo[2,3-d]pyrimidine substituted by a (3S,4R)-1-(cyanoacetyl)-3-methyl-1,6-diazaspiro[3.4]octan-6-yl group at position 4. It is a pan-Janus kinase (JAK) inhibitor and is approved for treatment of atopic dermatitis (AD) in Japan. cas:1263774-59-9|chemspider:59718502|drugbank:DB16133|kegg.drug:D11046|patent:US20140187534|pdb-ccd:FHX|pubmed:25387665|pubmed:26115905|pubmed:26546348|pubmed:27665390|pubmed:28423239|pubmed:28960254|pubmed:29665062|pubmed:31425780|pubmed:31466119|pubmed:31820485|pubmed:31924380|pubmed:32029304|pubmed:32166597|pubmed:32511913|pubmed:33334258|pubmed:33377547|pubmed:33605031 Graph 3-[(3S,4R)-3-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,6-diazaspiro[3.4]octan-1-yl]-3-oxopropanenitrile|Corectim|JTE-052|JTE-052A|LEO 124249|LEO 124249A|LEO-124249|LEO-124249A|delgocitinib|delgocitinibum 3-[(3S,4R)-3-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,6-diazaspiro[3.4]octan-1-yl]-3-oxopropanenitrile 3-[(3S,4R)-3-methyl-6-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,6-diazaspiro[3.4]octan-1-yl]-3-oxopropanenitrile|Corectim|JTE-052|JTE-052A|LEO 124249|LEO 124249A|LEO-124249|LEO-124249A|delgocitinib|delgocitinibum http://purl.obolibrary.org/obo/CHEBI_167600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167604 biolink:ChemicalEntity naphthalene-1,8-diol A member of the class of naphthalenediols that is naphthalene in which the hydrogens at positions 1 and 8 are replaced by hydroxy groups. cas:569-42-6|chemspider:61718|knapsack:C00000552|pubmed:28471002|pubmed:29500263|pubmed:31458630|pubmed:6539583|reaxys:2044947 Graph 1,8-DHN|1,8-dihydroxynaphthalene|1,8-naphthalenediol|naphthalene-1,8-diol naphthalene-1,8-diol 1,8-DHN|1,8-dihydroxynaphthalene|1,8-naphthalenediol|naphthalene-1,8-diol http://purl.obolibrary.org/obo/CHEBI_167604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167605 biolink:ChemicalEntity 1,8-dihydroxynaphthalene-melanin A melanin pigment produced by certain fungi. It plays important roles in UV protection, oxidative stress and pathogenesis. In Aspergillus fumigatus, it is used as a virulence factor and plays an important role in the survival of the fungus during unfavorable conditions both in vivo and in vitro, and protects it from the host immune system. The pigment is generally synthesised from the pentaketide pathway in which 1,8-dihydroxynaphthalene is the immediate precursor which is polymerized to 1,8-dihydroxynaphthalene-melanin by a laccase enzyme. pubmed:11179356|pubmed:12788746|pubmed:15033240|pubmed:15212456|pubmed:19306112|pubmed:20473673|pubmed:22714980|pubmed:23998343|pubmed:24123270|pubmed:26467568|pubmed:30582052|pubmed:31116900|pubmed:32391495|pubmed:33463687 Graph 1,8-DHN-melanin|1,8-dihydroxynaphthalene (DHN) melanin|1,8-dihydroxynaphthalene (DHN)-melanin|1,8-dihydroxynaphthalene melanin 1,8-DHN-melanin|1,8-dihydroxynaphthalene (DHN) melanin|1,8-dihydroxynaphthalene (DHN)-melanin|1,8-dihydroxynaphthalene melanin http://purl.obolibrary.org/obo/CHEBI_167605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167609 biolink:ChemicalEntity 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)(2-) residue Graph 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside) residue 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside) residue http://purl.obolibrary.org/obo/CHEBI_167609 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16761 biolink:ChemicalEntity ADP A purine ribonucleoside 5'-diphosphate having adenine as the nucleobase. cas:20398-34-9|cas:58-64-0|drugbank:DB03431|gmelin:88452|kegg.compound:C00008|kegg.glycan:G11113|knapsack:C00019353|pdb-ccd:ADP|pubmed:16295522|reaxys:67722 Graph 5'-adenylphosphoric acid|ADENOSINE-5'-DIPHOSPHATE|ADP|Adenosine 5'-diphosphate|H3adp|adenosine 5'-(trihydrogen diphosphate) Adenosine 5'-diphosphate|adenosine 5'-(trihydrogen diphosphate) 5'-adenylphosphoric acid|ADENOSINE-5'-DIPHOSPHATE|ADP|Adenosine 5'-diphosphate|H3adp|adenosine 5'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_16761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167616 biolink:ChemicalEntity 5'-end ribonucleoside 5'-diphosphate(3-) residue Graph a 5'-diphospho-ribonucleoside residue a 5'-diphospho-ribonucleoside residue http://purl.obolibrary.org/obo/CHEBI_167616 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167617 biolink:ChemicalEntity 5'-(5'-triphosphoguanosine)-(ribonucleotide)(3-) residue Graph a 5'-(5'-triphosphoguanosine)-ribonucleoside residue a 5'-(5'-triphosphoguanosine)-ribonucleoside residue http://purl.obolibrary.org/obo/CHEBI_167617 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167618 biolink:ChemicalEntity 5'-end ribonucleotide 5'-triphosphate(4-) residue Graph 5'-end triphospho-ribonucleoside residue 5'-end triphospho-ribonucleoside residue http://purl.obolibrary.org/obo/CHEBI_167618 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167629 biolink:ChemicalEntity JTE-607 dihydrochloride The dihydrochloride salt of JTE-607. It is a cytokine inhibitor which suppresses the production of proinflammatory cytokines such as interleukin (IL-1β), IL-6, IL-8, granulocyte macrophage colony stimulating factor (GM-CSF), and tumor necrosis factor (TNF-α). It acts as a pro-drug which is cleaved by carboxylesterase 1 (CES1) to its active free acid form, which then binds to cleavage and polyadenylation specificity factor 3 (CPSF3). cas:188791-09-5|pubmed:10493164|pubmed:12005207|pubmed:12388363|pubmed:15044056|pubmed:15173729|pubmed:15280441|pubmed:16982331|pubmed:18691526|pubmed:20028380|pubmed:21820084|pubmed:31399191|pubmed:31819276 Graph (-)-ethyl-N-[3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-L-phenylalaninate dihydrochloride|JTE 607|JTE 607 dihydrochloride|JTE-607|JTE-607 .2HCl|JTE-607 dihydrochloride|N-[3,5-dichloro-2-hydroxy-4-[2-(4-methyl-1-piperazinyl)ethoxy]benzoyl]-L-phenylalanine ethyl ester dihydrochloride|ethyl (2S)-2-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzamido}-3-phenylpropanoate dihydrochloride|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate dihydrochloride ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate dihydrochloride (-)-ethyl-N-[3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-L-phenylalaninate dihydrochloride|JTE 607|JTE 607 dihydrochloride|JTE-607|JTE-607 .2HCl|JTE-607 dihydrochloride|N-[3,5-dichloro-2-hydroxy-4-[2-(4-methyl-1-piperazinyl)ethoxy]benzoyl]-L-phenylalanine ethyl ester dihydrochloride|ethyl (2S)-2-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzamido}-3-phenylpropanoate dihydrochloride|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate dihydrochloride http://purl.obolibrary.org/obo/CHEBI_167629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16763 biolink:ChemicalEntity 2-oxobutanoate A 2-oxo monocarboxylic acid anion that is the conjugate base of 2-oxobutanoic acid, obtained by deprotonation of the carboxy group. gmelin:899148|hmdb:HMDB0000005|kegg.compound:C00109|metacyc.compound:2-OXOBUTANOATE|reaxys:3601760|umbbd.compound:c0360 Graph 2-Ketobutanoate|2-Oxobutyrate|2-ketobutyrate|2-oxobutanoate|alpha-ketobutyrate|alpha-oxobutyrate 2-oxobutanoate 2-Ketobutanoate|2-Oxobutyrate|2-ketobutyrate|2-oxobutanoate|alpha-ketobutyrate|alpha-oxobutyrate http://purl.obolibrary.org/obo/CHEBI_16763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167630 biolink:ChemicalEntity JTE-607 free base A secondary carboxamide resulting from the formal condensation of the carboxy group of 3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoic acid with the amino group of ethyl L-phenylalaninate. It inhibits cytokine production in human peripheral blood mononuclear cells (PBMC's) without causing immunosuppression. cas:188791-71-1|chemspider:8114170|pubmed:10493164|pubmed:15044056|pubmed:15280441 Graph JTE-607 (free base)|N-[3,5-dichloro-2-hydroxy-4-[2-(4-methyl-1-piperazinyl)ethoxy]benzoyl]-L-phenylalanine ethyl ester|ethyl (2S)-2-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzamido}-3-phenylpropanoate|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate JTE-607 (free base)|N-[3,5-dichloro-2-hydroxy-4-[2-(4-methyl-1-piperazinyl)ethoxy]benzoyl]-L-phenylalanine ethyl ester|ethyl (2S)-2-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzamido}-3-phenylpropanoate|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl}-L-phenylalaninate http://purl.obolibrary.org/obo/CHEBI_167630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167631 biolink:ChemicalEntity JTE-607 zwitterion A zwitterion formed from JTE-607 by transfer of a proton from the hydroxy to the methylated amino group. Major species at pH 7.3. Graph 2,4-dichloro-6-{[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}-3-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]phenolate 2,4-dichloro-6-{[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}-3-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]phenolate 2,4-dichloro-6-{[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}-3-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]phenolate http://purl.obolibrary.org/obo/CHEBI_167631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167632 biolink:ChemicalEntity JTE-607(2+) An organic cation obtained by protonation of the two tertiary amino groups of JTE-607 free base. Graph 1-[2-(2,6-dichloro-4-{[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}-3-hydroxyphenoxy)ethyl]-4-methylpiperazinediium|JTE-607 dication|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazinediium-1-yl)ethoxy]benzoyl}-L-phenylalaninate ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazinediium-1-yl)ethoxy]benzoyl}-L-phenylalaninate 1-[2-(2,6-dichloro-4-{[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}-3-hydroxyphenoxy)ethyl]-4-methylpiperazinediium|JTE-607 dication|ethyl N-{3,5-dichloro-2-hydroxy-4-[2-(4-methylpiperazinediium-1-yl)ethoxy]benzoyl}-L-phenylalaninate http://purl.obolibrary.org/obo/CHEBI_167632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167633 biolink:ChemicalEntity CPSF3 inhibitor Any inhibitor which inhibits the activity of cleavage and polyadenylation specificity factor subunit 3 protein (CPSF3). wikipedia.en:CPSF3 Graph CPSF-73 inhibitor|CPSF-73 inhibitors|CPSF3 inhibitors|CPSF73 inhibitor|CPSF73 inhibitors|cleavage and polyadenylation specific factor 3 inhibitor|cleavage and polyadenylation specific factor 3 inhibitors|cleavage and polyadenylation specificity factor 73 KDa subunit inhibitor|cleavage and polyadenylation specificity factor 73 KDa subunit inhibitors|cleavage and polyadenylation specificity factor subunit 3 inhibitor|cleavage and polyadenylation specificity factor subunit 3 inhibitors CPSF-73 inhibitor|CPSF-73 inhibitors|CPSF3 inhibitors|CPSF73 inhibitor|CPSF73 inhibitors|cleavage and polyadenylation specific factor 3 inhibitor|cleavage and polyadenylation specific factor 3 inhibitors|cleavage and polyadenylation specificity factor 73 KDa subunit inhibitor|cleavage and polyadenylation specificity factor 73 KDa subunit inhibitors|cleavage and polyadenylation specificity factor subunit 3 inhibitor|cleavage and polyadenylation specificity factor subunit 3 inhibitors http://purl.obolibrary.org/obo/CHEBI_167633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167637 biolink:ChemicalEntity mycofactocin A small molecule derived from a peptide of the type known as RiPP (ribosomally synthesized and post-translationally modified peptides), naturally occurring in many types of Mycobacterium. metacyc.compound:Mycofactocins|pubmed:21223593|pubmed:28634235|wikipedia.en:Mycofactocin Graph http://purl.obolibrary.org/obo/CHEBI_167637 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167638 biolink:ChemicalEntity 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide A member of the class of benzamides that is benzamide substituted by a hydroxy group at position 2 and by a 1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl group at position 5. Graph 2-hydroxy-5-(1-hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)benzamide|2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide 2-hydroxy-5-(1-hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)benzamide|2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide http://purl.obolibrary.org/obo/CHEBI_167638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167639 biolink:ChemicalEntity (S,S)-labetalol A 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide that has 1S,2S-configuration. cas:83167-24-2|chemspider:118196|pubmed:10853616|pubmed:1447344|pubmed:6124636 Graph 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide|S,S-labetalol 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide|S,S-labetalol http://purl.obolibrary.org/obo/CHEBI_167639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16764 biolink:ChemicalEntity 2'-deoxy-5-methyl-5'-cytidylic acid A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having 5-methylcytidine as the nucleobase. cas:2498-41-1|kegg.compound:C03495|pdb-ccd:5CM Graph 2'-Deoxy-5-methylcytidine 5'-monophosphate|2'-deoxy-5-methyl-5'-cytidylic acid|5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE|5-Methyldeoxycytidine 5'-phosphate|Deoxy-5-methylcytidylate|Deoxy-5-methylcytidylic acid 2'-deoxy-5-methyl-5'-cytidylic acid 2'-Deoxy-5-methylcytidine 5'-monophosphate|2'-deoxy-5-methyl-5'-cytidylic acid|5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE|5-Methyldeoxycytidine 5'-phosphate|Deoxy-5-methylcytidylate|Deoxy-5-methylcytidylic acid http://purl.obolibrary.org/obo/CHEBI_16764 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167640 biolink:ChemicalEntity (R,S)-labetolol A 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide that has 1R,2S-configuration. cas:83167-31-1|chemspider:2308682|pubmed:10853616|pubmed:1447344|pubmed:6124636 Graph 2-hydroxy-5-[(1R)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide 2-hydroxy-5-[(1R)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide 2-hydroxy-5-[(1R)-1-hydroxy-2-{[(2S)-4-phenylbutan-2-yl]amino}ethyl]benzamide http://purl.obolibrary.org/obo/CHEBI_167640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167641 biolink:ChemicalEntity (S,R)-labetolol A 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide that has 1S,2R-configuration. cas:83167-32-2|chemspider:118198|pubmed:10853616|pubmed:1447344|pubmed:34351937|pubmed:6124636 Graph 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2R)-4-phenylbutan-2-yl]amino}ethyl]benzamide 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2R)-4-phenylbutan-2-yl]amino}ethyl]benzamide 2-hydroxy-5-[(1S)-1-hydroxy-2-{[(2R)-4-phenylbutan-2-yl]amino}ethyl]benzamide http://purl.obolibrary.org/obo/CHEBI_167641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167649 biolink:ChemicalEntity 1-deoxynojirimycin-1-sulfonic acid A hydroxypiperidine that is duvoglustat carrying a sulfo group at position 6β. It is an α-glucosidase inhibitor and an activator of the human glucose sensor SGLT3. cas:81703-56-2|chemspider:9303621|pubmed:17110502|pubmed:21471980 Graph (2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)-2-piperidinesulfonic acid|(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidine-2-sulfonic acid|nojirimycin 1-sulfonic acid (2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidine-2-sulfonic acid (2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)-2-piperidinesulfonic acid|(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidine-2-sulfonic acid|nojirimycin 1-sulfonic acid http://purl.obolibrary.org/obo/CHEBI_167649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16765 biolink:ChemicalEntity tryptamine An aminoalkylindole consisting of indole having a 2-aminoethyl group at the 3-position. cas:61-54-1|drugbank:DB08653|gmelin:603448|hmdb:HMDB0000303|kegg.compound:C00398|knapsack:C00001434|metacyc.compound:TRYPTAMINE|pdb-ccd:TSS|pubmed:16126914|pubmed:22770225|pubmed:24345948|pubmed:24558969|reaxys:125513|wikipedia.en:Tryptamine Graph 1H-indole-3-ethanamine|2-(1H-INDOL-3-YL)ETHANAMINE|2-(1H-indol-3-yl)ethanamine|2-(3-indolyl)ethylamine|3-(2-Aminoethyl)indole|Tryptamine 2-(1H-INDOL-3-YL)ETHANAMINE|2-(1H-indol-3-yl)ethanamine 1H-indole-3-ethanamine|2-(1H-INDOL-3-YL)ETHANAMINE|2-(1H-indol-3-yl)ethanamine|2-(3-indolyl)ethylamine|3-(2-Aminoethyl)indole|Tryptamine http://purl.obolibrary.org/obo/CHEBI_16765 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167650 biolink:ChemicalEntity ASP-3026 A member of the class of diamino-1,3,5-triazines that is 1,3,5-triazine-2,4-diamine in which the amino groups at positions 2 and 4 are respectively carrying 2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl and 2-(propan-2-ylsulfonyl)phenyl substituents. It is a potent inhibitor of anaplastic lymphoma kinase (ALK), Ack and ROS1 activity (IC50 values are 3.5, 5.8 and 8.9 nM respectively) and exhibits anti-cancer properties. cas:1097917-15-1|chemspider:28424239|drugbank:DB12729|pdb-ccd:F6O|pubmed:24419060|pubmed:25026277|pubmed:25727400|pubmed:25749034|pubmed:25888090|pubmed:26020125|pubmed:26027465|pubmed:26964870|pubmed:26966027|pubmed:27565932|pubmed:28930717|pubmed:29491259|pubmed:31177400|pubmed:31340850|pubmed:33053158|pubmed:33331996 Graph 2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine|ASP 3026|ASP3026|N(2)-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N(4)-[2-[(1-methylethyl)sulfonyl]phenyl]-1,3,5-triazine-2,4-diamine|N-{2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}-N'-[2-(propan-2-ylsulfonyl)phenyl]-1,3,5-triazine-2,4-diamine N-{2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}-N'-[2-(propan-2-ylsulfonyl)phenyl]-1,3,5-triazine-2,4-diamine 2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine|ASP 3026|ASP3026|N(2)-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N(4)-[2-[(1-methylethyl)sulfonyl]phenyl]-1,3,5-triazine-2,4-diamine|N-{2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}-N'-[2-(propan-2-ylsulfonyl)phenyl]-1,3,5-triazine-2,4-diamine http://purl.obolibrary.org/obo/CHEBI_167650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167651 biolink:ChemicalEntity AZD1080 A member of the class of hydroxyindoles that is 1H-indole substituted by hydroxy, 5-(morpholin-4-ylmethyl)pyridin-2-yl, and cyano groups at positions 2, 3 and 5, respectively. It is a potent, brain permeable inhibitor of human GSK3α and GSK3β with Ki of 6.9 nM and 31 nM, respectively. The drug was being developed by AstraZeneca for the treatment of Alzheimer's disease (clinical trial now discontinued). cas:612487-72-6|chemspider:24808514|pubmed:23410232|pubmed:27050373|pubmed:27051274|pubmed:32184604|pubmed:33422940 Graph 2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile|2-hydroxy-3-[5-(morpholin-4-ylmethyl)pyridin-2-yl]-1H-indole-5-carbonitrile|AZ-11548415|AZD 1080|AZD-1080 2-hydroxy-3-[5-(morpholin-4-ylmethyl)pyridin-2-yl]-1H-indole-5-carbonitrile 2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile|2-hydroxy-3-[5-(morpholin-4-ylmethyl)pyridin-2-yl]-1H-indole-5-carbonitrile|AZ-11548415|AZD 1080|AZD-1080 http://purl.obolibrary.org/obo/CHEBI_167651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167652 biolink:ChemicalEntity AZD2858 A member of the class of pyrazines that is pyrazine substituted by (pyridin-3-yl)aminocarbonyl, amino, and 4-(4-methylpiperazine-1-sulfonyl)phenyl groups at positions 2, 3 and 6, respectively. It is a potent inhibitor of GSK3α and GSK3β (IC50 values of 0.9 and 4.9 nM, respectively) and increases bone mass (via Wnt activation) in rats. cas:486424-20-8|chemspider:8314492|pdb-ccd:GR9|pmc:PMC4200977|pmc:PMC6795005|pubmed:22142634|pubmed:22489897|pubmed:23337038|pubmed:23872097|pubmed:27789709|pubmed:28881139 Graph 3-amino-6-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-3-pyridinyl-2-pyrazinecarboxamide|3-amino-6-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-N-(pyridin-3-yl)pyrazine-2-carboxamide|AZD 2858|AZD-2858 3-amino-6-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-N-(pyridin-3-yl)pyrazine-2-carboxamide 3-amino-6-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-3-pyridinyl-2-pyrazinecarboxamide|3-amino-6-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-N-(pyridin-3-yl)pyrazine-2-carboxamide|AZD 2858|AZD-2858 http://purl.obolibrary.org/obo/CHEBI_167652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167653 biolink:ChemicalEntity AZD3463 A member of the class of indoles that is 1H-indole substituted by a 2-[4-(4-aminopiperidin-1-yl)-2-methoxyanilino]-5-chloropyrimidin-4-yl group at position 3. It is an orally bioavailable dual inhibitor of ALK and IGF1R with Ki value of 0.75 nM for ALK. cas:1356962-20-3|chemspider:29315067|pubmed:26571493|pubmed:26786851|pubmed:30647405|pubmed:31346159|pubmed:32355780|pubmed:32698744|pubmed:33109342|pubmed:33141044 Graph AZD 3463|AZD-3463|N-[4-(4-amino-1-piperidinyl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)-2-pyrimidinamine|N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine AZD 3463|AZD-3463|N-[4-(4-amino-1-piperidinyl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)-2-pyrimidinamine|N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine http://purl.obolibrary.org/obo/CHEBI_167653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167654 biolink:ChemicalEntity BAYu9773 A dicarboxylic acid that is that is (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid substituted by a hydroxy group at position 4S and a (4-carboxyphenyl)sulfanediyl group at 5R. It is a dual cysteinyl leukotriene receptor antagonist that acts at the CysLT1 and CysLT2 receptors (IC50 = 0.44 and 0.30 μM, respectively). cas:154978-38-8|chemspider:4470554|pubmed:12466244|pubmed:12598425|pubmed:1659283|pubmed:18315950|pubmed:18503712|pubmed:19118273|pubmed:19563734|pubmed:19941848|pubmed:20014485|pubmed:20423349|pubmed:21396378|pubmed:21646802|pubmed:21903747|pubmed:23801612|pubmed:25408836|pubmed:25707327|pubmed:27198524|pubmed:7698171|pubmed:8982726|pubmed:9597121|pubmed:9797038 Graph 4-{[(4S,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxynonadeca-6,8,10,13-tetraen-5-yl]sulfanyl}benzoic acid|6(R)-(4-carboxyphenylthio)-5(S)-hydroxy-7(E),9(E),11(E),14(Z)-eicosatetraenoic acid|BAY u9773|BAY-u 9773|BAY-u9773 4-{[(4S,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxynonadeca-6,8,10,13-tetraen-5-yl]sulfanyl}benzoic acid 4-{[(4S,5R,6E,8E,10Z,13Z)-1-carboxy-4-hydroxynonadeca-6,8,10,13-tetraen-5-yl]sulfanyl}benzoic acid|6(R)-(4-carboxyphenylthio)-5(S)-hydroxy-7(E),9(E),11(E),14(Z)-eicosatetraenoic acid|BAY u9773|BAY-u 9773|BAY-u9773 http://purl.obolibrary.org/obo/CHEBI_167654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167655 biolink:ChemicalEntity BMS-214662 A member of the class of benzodiazepines that is 2,3,4,5-tetrahydro-1H-1,4-benzodiazepine substituted by (1H-imidazol-5-yl)methyl, benzyl, (thiophen-2-yl)sulfonyl, and cyano groups at positions 1, 3R, 4 and 7, respectively. It is a potent inhibitor of farnesyltransferase (IC50 = 1.35nM) which was under clinical development for the treatment of solid tumors. cas:195987-41-8|chemspider:395310|drugbank:DB12234|pdb-ccd:BMV|pubmed:11020273|pubmed:11606387|pubmed:12789624|pubmed:15073096|pubmed:15102665|pubmed:15170324|pubmed:15356656|pubmed:15710949|pubmed:15728224|pubmed:15738311|pubmed:15756013|pubmed:15930351|pubmed:16362299|pubmed:17510207|pubmed:17956348|pubmed:18156496|pubmed:19738029|pubmed:19883257|pubmed:21483442|pubmed:23184491|pubmed:27688185 Graph (3R)-3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-(thiophen-2-ylsulfonyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-carbonitrile|(3R)-3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine-7-carbonitrile|(R)-2,3,4,5-tetrahydro-1-(1H-imidazol-4-ylmethyl)-3-(phenylmethyl)-4-(2-thienylsulfonyl)-1H-1,4-benzodiazepine-7-carbonitrile|(R)-7-cyano-2,3,4,5-tetrahydro-1-(1H-imidazol-4-ylmethyl)-3-(phenylmethyl)-4-(2-thienylsulfonyl)-1H-1,4-benzodiazepine|BMS 214662|BMS214662 (3R)-3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-(thiophen-2-ylsulfonyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-carbonitrile (3R)-3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-(thiophen-2-ylsulfonyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-carbonitrile|(3R)-3-benzyl-1-(1H-imidazol-5-ylmethyl)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine-7-carbonitrile|(R)-2,3,4,5-tetrahydro-1-(1H-imidazol-4-ylmethyl)-3-(phenylmethyl)-4-(2-thienylsulfonyl)-1H-1,4-benzodiazepine-7-carbonitrile|(R)-7-cyano-2,3,4,5-tetrahydro-1-(1H-imidazol-4-ylmethyl)-3-(phenylmethyl)-4-(2-thienylsulfonyl)-1H-1,4-benzodiazepine|BMS 214662|BMS214662 http://purl.obolibrary.org/obo/CHEBI_167655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167656 biolink:ChemicalEntity brivanib alaninate A carboxylic ester resulting from the formal condensation of the carboxy group of L-alanine with the hydroxy group of brivanib. It is a prodrug of brivanib (BMS-540215), a potent oral dual inhibitor of VEGFR-2 and FGFR-1 (IC50 of 25 nM and 148 nM, respectively) and was in development for the treatment of hepatocellular and colon carcinomas. cas:649735-63-7|chemspider:9330033|drugbank:DB11865|kegg.drug:D08878|pubmed:16570908|pubmed:17638901|pubmed:18288793|pubmed:18815076|pubmed:18829493|pubmed:19396600|pubmed:20024612|pubmed:20303261|pubmed:21115896|pubmed:21289073|pubmed:21391890|pubmed:21629245|pubmed:21659627|pubmed:22189636|pubmed:22983304|pubmed:23030483|pubmed:23690424|pubmed:24325631|pubmed:24780101|pubmed:25470221|pubmed:25724158|pubmed:26852852|pubmed:27771049|pubmed:30855507|wikipedia.en:Brivanib_alaninate Graph (1R,2S)-2-aminopropionic acid 2-[4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yloxy]-1-methylethyl ester|(2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-yl (2S)-2-aminopropanoate|(2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-yl L-alaninate|BMS 582664|BMS-582664|BMS582664|alaninate de brivanib|alaninati brivanibum|alaninato de brivanib|brivanib alaninate (2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-yl L-alaninate (1R,2S)-2-aminopropionic acid 2-[4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yloxy]-1-methylethyl ester|(2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-yl (2S)-2-aminopropanoate|(2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-yl L-alaninate|BMS 582664|BMS-582664|BMS582664|alaninate de brivanib|alaninati brivanibum|alaninato de brivanib|brivanib alaninate http://purl.obolibrary.org/obo/CHEBI_167656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167657 biolink:ChemicalEntity CHIR-98014 A member of the class of aminopyrimidines that is pyrimidine substituted by {2-[(6-amino-5-nitropyridin-2-yl)amino]ethyl}amino, 2,4-dichlorophenyl, and 1H-imidazol-1-yl groups at positions 2, 4 and 5, respectively. It is a potent ATP-competitive inhibitor of GSK3α and GSK3β (IC50 values of 0.65 and 0.58 nM, respectively). cas:252935-94-7|chemspider:27445282|pubmed:12606497|pubmed:24779365|pubmed:26149502|pubmed:29016121|pubmed:29436606|pubmed:29842899|pubmed:30662679|pubmed:31540917|pubmed:32236757|pubmed:33667649 Graph 6-N-[2-[[4-(2,4-dichlorophenyl)-5-imidazol-1-ylpyrimidin-2-yl]amino]ethyl]-3-nitropyridine-2,6-diamine|CHIR 98014|CHIR98014|N(6)-(2-{[4-(2,4-dichlorophenyl)-5-(1H-imidazol-1-yl)pyrimidin-2-yl]amino}ethyl)-3-nitropyridine-2,6-diamine|N-6-[2-[[4-(2,4-dichlorophenyl)-5-(1H-imidazol-1-yl)-2-pyrimidinyl]amino]ethyl]-3-nitro-2,6-pyridinediamine N(6)-(2-{[4-(2,4-dichlorophenyl)-5-(1H-imidazol-1-yl)pyrimidin-2-yl]amino}ethyl)-3-nitropyridine-2,6-diamine 6-N-[2-[[4-(2,4-dichlorophenyl)-5-imidazol-1-ylpyrimidin-2-yl]amino]ethyl]-3-nitropyridine-2,6-diamine|CHIR 98014|CHIR98014|N(6)-(2-{[4-(2,4-dichlorophenyl)-5-(1H-imidazol-1-yl)pyrimidin-2-yl]amino}ethyl)-3-nitropyridine-2,6-diamine|N-6-[2-[[4-(2,4-dichlorophenyl)-5-(1H-imidazol-1-yl)-2-pyrimidinyl]amino]ethyl]-3-nitro-2,6-pyridinediamine http://purl.obolibrary.org/obo/CHEBI_167657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167658 biolink:ChemicalEntity CP-724714 A 2-methoxy-N-[3-[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]-6-quinazolinyl]prop-2-enyl]acetamide in which the double bond adopts a trans-configuration. It is a potent inhibitor of HER2/ErbB2 (IC50 = 10 nM) and exhibits anti-cancer activity. cas:845680-17-3|chemspider:8050601|drugbank:DB12302|lincs.smallmolecule:LSM-42777|pubmed:17285315|pubmed:17317835|pubmed:17805538|pubmed:17942920|pubmed:18500794|pubmed:19223659|pubmed:25426072|pubmed:26846307|pubmed:28014873|pubmed:28902361|pubmed:29662626|pubmed:30858165|pubmed:31613219|pubmed:33463944 Graph (E)-2-methoxy-N-[3-[4-[[3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl]amino]quinazolin-6-yl]allyl]ethanamide|2-methoxy-N-[(2E)-3-(4-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]anilino}quinazolin-6-yl)prop-2-en-1-yl]acetamide|2-methoxy-N-[(2E)-3-[4-[[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]amino]-6-quinazolinyl]-2-propen-1-yl]-acetamide|2-methoxy-N-[(E)-3-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]prop-2-enyl]acetamide|CP 724714|CP-724,714|CP724714 2-methoxy-N-[(2E)-3-(4-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]anilino}quinazolin-6-yl)prop-2-en-1-yl]acetamide (E)-2-methoxy-N-[3-[4-[[3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl]amino]quinazolin-6-yl]allyl]ethanamide|2-methoxy-N-[(2E)-3-(4-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]anilino}quinazolin-6-yl)prop-2-en-1-yl]acetamide|2-methoxy-N-[(2E)-3-[4-[[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]phenyl]amino]-6-quinazolinyl]-2-propen-1-yl]-acetamide|2-methoxy-N-[(E)-3-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]prop-2-enyl]acetamide|CP 724714|CP-724,714|CP724714 http://purl.obolibrary.org/obo/CHEBI_167658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167659 biolink:ChemicalEntity GDC-0623 A member of the class of imidazopyridines that is imidazo[1,5-a]pyridine substituted by (2-fluoro-4-iodophenyl)amino and (2-hydroxyethoxy)aminoacyl groups at positions 5 and 6. It is a potent ATP non-competitive inhibitor of MEK1 (Ki = 0.13nM) and also has efficacy against both mutant BRAF and mutant KRAS. It is in clinical development for treatment of patients with locally advanced or metastatic solid tumors. cas:1168091-68-6|chemspider:30687718|drugbank:DB11982|pdb-ccd:LCJ|pubmed:23934108|pubmed:25193232|pubmed:26245900|pubmed:26438627|pubmed:27422710|pubmed:31581174|pubmed:32238059 Graph 5-(2-fluoro-4-iodoanilino)-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-6-carboxamide|5-[(2-fluoro-4-iodophenyl)amino]-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-6-carboxamide|G 868|G-868|G868|GDC 0623|GDC0623|RG 7421|RG-7421 5-(2-fluoro-4-iodoanilino)-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-6-carboxamide 5-(2-fluoro-4-iodoanilino)-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-6-carboxamide|5-[(2-fluoro-4-iodophenyl)amino]-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-6-carboxamide|G 868|G-868|G868|GDC 0623|GDC0623|RG 7421|RG-7421 http://purl.obolibrary.org/obo/CHEBI_167659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16766 biolink:ChemicalEntity 4-carboxymethyl-4-methylbut-2-en-1,4-olide A 5-oxo-2-furylacetic acid having a 4-methyl substituent. kegg.compound:C04559|umbbd.compound:c0209 Graph (2-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|4-Carboxymethyl-4-methylbut-2-en-1,4-olide|4-Methylmuconolactone|4-methylmuconolactone|5-carboxymethyl-5-methylfuran-2(5H)-one (2-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid (2-methyl-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|4-Carboxymethyl-4-methylbut-2-en-1,4-olide|4-Methylmuconolactone|4-methylmuconolactone|5-carboxymethyl-5-methylfuran-2(5H)-one http://purl.obolibrary.org/obo/CHEBI_16766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167660 biolink:ChemicalEntity LB42908 A member of the class of pyrrolecarboxamides that is 1H-pyrrole substituted by [1-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]methyl, (4-methylpiperazin-1-yl)carbonyl, and naphthalen-1-yl groups at positions 1, 3 and 4, respectively. It is a potent inhibitor of Ras farnesyltransferase (IC50= 0.9nM against H-Ras and 2.4nM against K-Ras) with potential anticancer activity. cas:226927-89-5|chemspider:34980887|pubmed:11714612|pubmed:15812228|pubmed:16331612|pubmed:16712893|pubmed:22497764|pubmed:24059235 Graph (1-((1-(benzo[d][1,3]dioxol-5-ylmethyl)-1H-imidazol-5-yl)methyl)-4-(naphthalen-1-yl)-1H-pyrrol-3-yl)(4-methylpiperazin-1-yl)methanone|LB 42908|LB-42908|[1-[[3-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-4-naphthalen-1-ylpyrrol-3-yl]-(4-methylpiperazin-1-yl)methanone|[1-{[1-(1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]-methyl}-4-(1-naphtyl)-1H-pyrrol-3-yl](4-methyl-1-piperazynyl)methanone|[1-{[1-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]methyl}-4-(naphthalen-1-yl)-1H-pyrrol-3-yl](4-methylpiperazin-1-yl)methanone [1-{[1-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]methyl}-4-(naphthalen-1-yl)-1H-pyrrol-3-yl](4-methylpiperazin-1-yl)methanone (1-((1-(benzo[d][1,3]dioxol-5-ylmethyl)-1H-imidazol-5-yl)methyl)-4-(naphthalen-1-yl)-1H-pyrrol-3-yl)(4-methylpiperazin-1-yl)methanone|LB 42908|LB-42908|[1-[[3-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-4-naphthalen-1-ylpyrrol-3-yl]-(4-methylpiperazin-1-yl)methanone|[1-{[1-(1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]-methyl}-4-(1-naphtyl)-1H-pyrrol-3-yl](4-methyl-1-piperazynyl)methanone|[1-{[1-(3a,7a-dihydro-1,3-benzodioxol-5-ylmethyl)-1H-imidazol-5-yl]methyl}-4-(naphthalen-1-yl)-1H-pyrrol-3-yl](4-methylpiperazin-1-yl)methanone http://purl.obolibrary.org/obo/CHEBI_167660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167661 biolink:ChemicalEntity LY-2090314 A member of the class of diazepinoindoles that is 1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indole substituted by piperidin-1-ylcarbonyl, 4-(imidazo[1,2-a]pyridin-3-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl and fluoro groups at position 2, 7 and 9, respectively. It is a potent ATP-competitive inhibitor of glycogen synthase kinase-3 (GSK-3) with IC50 values of 1.5 nM and 0.9 nM for GSK-3α and GSK-3β. The drug is in clinical development for the treatment of advanced/metastatic cancer. cas:603288-22-8|chemspider:8204956|drugbank:DB11913|lincs.smallmolecule:LSM-45915|pubmed:15267232|pubmed:23305709|pubmed:24658455|pubmed:25915038|pubmed:26403509|pubmed:26735141|pubmed:26967552|pubmed:28397338|pubmed:28766886|pubmed:28772167|pubmed:29593255|pubmed:29751783|pubmed:31261037|pubmed:31562256|pubmed:31623866|pubmed:32382110|pubmed:32391602|pubmed:32539133 Graph 3-[9-fluoro-1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-4-imidazo[1,2-a]pyridin-3-yl-1H-pyrrole-2,5-dione|3-[9-fluoro-2-(piperidin-1-ylcarbonyl)-1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl]-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione|LY 2090314|LY2090314 3-[9-fluoro-2-(piperidin-1-ylcarbonyl)-1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl]-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione 3-[9-fluoro-1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-4-imidazo[1,2-a]pyridin-3-yl-1H-pyrrole-2,5-dione|3-[9-fluoro-2-(piperidin-1-ylcarbonyl)-1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl]-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione|LY 2090314|LY2090314 http://purl.obolibrary.org/obo/CHEBI_167661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167662 biolink:ChemicalEntity LY3009120 A member of the class of pyridopyrimidines that is pyrido[2,3-d]pyrimidine substituted by methylamino, 5-{[(3,3-dimethylbutyl)carbamoyl]amino}-4-fluoro-2-methylphenyl, and methyl groups at positions 2, 6 and 7, respectively. It is a potent pan RAF inhibitor which inhibits BRAFV600E, BRAFWT and CRAFWT (IC50 = 5.8, 9.1 and 15 nM, respectively). It also inhibits RAF homo- and heterodimers and exhibits anti-cancer properties. cas:1454682-72-4|pdb-ccd:4Z5|pubmed:25965804|pubmed:26343583|pubmed:26732095|pubmed:27422710|pubmed:27999210|pubmed:28382170|pubmed:28576749|pubmed:29059158|pubmed:29903896|pubmed:30272260|pubmed:30622172|pubmed:30944150|pubmed:31645440|pubmed:32366411|pubmed:33255818|pubmed:33565241 Graph 1-(3,3-dimethylbutyl)-3-{2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl}urea|DP 4978|DP-4978|DP4978|LY 3009120|LY-3009120|N-(3,3-dimethylbutyl)-N'-[2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl]urea 1-(3,3-dimethylbutyl)-3-{2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl}urea 1-(3,3-dimethylbutyl)-3-{2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl}urea|DP 4978|DP-4978|DP4978|LY 3009120|LY-3009120|N-(3,3-dimethylbutyl)-N'-[2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl]urea http://purl.obolibrary.org/obo/CHEBI_167662 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167663 biolink:ChemicalEntity MI-1148 A tripeptide comprising of L-arginine, 3-methyl-L-valine and L-arginine joined in sequence by peptide linkages and in which the amino terminus is substituted by a [4-(carbamimidamidomethyl)phenyl]acetyl group and the carboxy terminus is substituted by a (4-carbamimidoylbenzyl)amino group. It is a highly potent inhibitor of furin endoprotease (Ki = 5.5 pM) that has anti-infectious activity. chemspider:35033268|pubmed:21757345|pubmed:22539349|pubmed:25974265|pubmed:29059503 Graph (2S)-5-carbamimidamido-2-{[(2S)-2-{[(2S)-5-carbamimidamido-2-{2-[4-(carbamimidamidomethyl)phenyl]acetamido}pentanoyl]amino}-3,3-dimethylbutanoyl]amino}-N-(4-carbamimidoylbenzyl)pentanamide|4-(guanidinomethyl)phenylacetyl-Arg-Tle-Arg-4-amidinobenzylamide|4-guanidinomethyl-Phac-Arg-Tle-Arg-4-amba|4-guanidinomethyl-phenylacteyl-Arg-Tle-Arg-4-amidinobenzylamide|MI 1148|MI1148|N(2)-{[4-(carbamimidamidomethyl)phenyl]acetyl}-L-arginyl-3-methyl-L-valyl-N-(4-carbamimidoylbenzyl)-L-argininamide|N(2)-{[4-(carbamimidamidomethyl)phenyl]acetyl}-L-arginyl-3-methyl-L-valyl-N-[(4-carbamimidoylphenyl)methyl]-L-argininamide N(2)-{[4-(carbamimidamidomethyl)phenyl]acetyl}-L-arginyl-3-methyl-L-valyl-N-(4-carbamimidoylbenzyl)-L-argininamide (2S)-5-carbamimidamido-2-{[(2S)-2-{[(2S)-5-carbamimidamido-2-{2-[4-(carbamimidamidomethyl)phenyl]acetamido}pentanoyl]amino}-3,3-dimethylbutanoyl]amino}-N-(4-carbamimidoylbenzyl)pentanamide|4-(guanidinomethyl)phenylacetyl-Arg-Tle-Arg-4-amidinobenzylamide|4-guanidinomethyl-Phac-Arg-Tle-Arg-4-amba|4-guanidinomethyl-phenylacteyl-Arg-Tle-Arg-4-amidinobenzylamide|MI 1148|MI1148|N(2)-{[4-(carbamimidamidomethyl)phenyl]acetyl}-L-arginyl-3-methyl-L-valyl-N-(4-carbamimidoylbenzyl)-L-argininamide|N(2)-{[4-(carbamimidamidomethyl)phenyl]acetyl}-L-arginyl-3-methyl-L-valyl-N-[(4-carbamimidoylphenyl)methyl]-L-argininamide http://purl.obolibrary.org/obo/CHEBI_167663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167664 biolink:ChemicalEntity MK-8353 A member of the class of indazoles that is 1H-indazole substituted by a 6-(propan-2-yloxy)pyridin-3-yl group at position 3 and by a {[(3S)-3-(methylsulfanyl)-1-(2-{4-[4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl]-3,6-dihydropyridin-1(2H)-yl}-2-oxoethyl)pyrrolidin-3-yl]carbonyl}amino group at position 5. It is a potent and selective inhibitor of ERK1 and ERK2 in vitro (IC50 values of 23.0 nM and 8.8 nM, respectively). The drug is being developed by Merck Sharp & Dohme and is currently in clinical development for the treatment of advanced/metastatic solid tumors. cas:1184173-73-6|pdb-ccd:G67|pubmed:29467321|pubmed:30034615|pubmed:30794926|pubmed:30797103|pubmed:32202379 Graph (3S)-3-(methylsulfanyl)-1-(2-{4-[4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl]-3,6-dihydropyridin-1(2H)-yl}-2-oxoethyl)-N-{3-[6-(propan-2-yloxy)pyridin-3-yl]-1H-indazol-5-yl}pyrrolidine-3-carboxamide|MK 8353|MK8353|SCH-900353|SCH900353 (3S)-3-(methylsulfanyl)-1-(2-{4-[4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl]-3,6-dihydropyridin-1(2H)-yl}-2-oxoethyl)-N-{3-[6-(propan-2-yloxy)pyridin-3-yl]-1H-indazol-5-yl}pyrrolidine-3-carboxamide (3S)-3-(methylsulfanyl)-1-(2-{4-[4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl]-3,6-dihydropyridin-1(2H)-yl}-2-oxoethyl)-N-{3-[6-(propan-2-yloxy)pyridin-3-yl]-1H-indazol-5-yl}pyrrolidine-3-carboxamide|MK 8353|MK8353|SCH-900353|SCH900353 http://purl.obolibrary.org/obo/CHEBI_167664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167665 biolink:ChemicalEntity MP-A08 A sulfonamide that consists of two moieties of 4-methyl-N-phenylbenzenesulfonamide connected to each other at position 2 by an aldimine linker. It is a ATP-competitive inhibitor of sphingosine kinase that targets both SK1 and SK2 (Ki values of 27 μM and 6.9 μM, respectively) and exhibits anti-cancer properties. cas:219832-49-2|chemspider:24832025|pubmed:25788259|pubmed:26822263 Graph 4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide|4-methyl-N-{2-[(2-{[(4-methylphenyl)sulfonyl]amino}benzylidene)amino]phenyl}benzenesulfonamide|MP A08|MPA08 4-methyl-N-{2-[(2-{[(4-methylphenyl)sulfonyl]amino}benzylidene)amino]phenyl}benzenesulfonamide 4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]iminomethyl]phenyl]benzenesulfonamide|4-methyl-N-{2-[(2-{[(4-methylphenyl)sulfonyl]amino}benzylidene)amino]phenyl}benzenesulfonamide|MP A08|MPA08 http://purl.obolibrary.org/obo/CHEBI_167665 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167666 biolink:ChemicalEntity N-ethyl-1-deoxynojirimycin A hydroxypiperidine that is duvoglustat in which the amino hydrogen is replaced by an ethyl group. It is an inhibitor of α-glucosidase, an agonist of the glucose sensor SGLT3 and exhibits anti-HIV activity. cas:72458-42-5|chemspider:397723|pubmed:17110502|pubmed:3169233|pubmed:3264071 Graph (2R,3R,4R,5S)-1-ethyl-2-(hydroxymethyl)-3,4,5-piperidinetriol|(2R,3R,4R,5S)-1-ethyl-2-(hydroxymethyl)piperidine-3,4,5-triol|EtDNJ|N-ethyl-DNJ|N-ethyldeoxynojirimycin|N-ethylmoranoline (2R,3R,4R,5S)-1-ethyl-2-(hydroxymethyl)piperidine-3,4,5-triol (2R,3R,4R,5S)-1-ethyl-2-(hydroxymethyl)-3,4,5-piperidinetriol|(2R,3R,4R,5S)-1-ethyl-2-(hydroxymethyl)piperidine-3,4,5-triol|EtDNJ|N-ethyl-DNJ|N-ethyldeoxynojirimycin|N-ethylmoranoline http://purl.obolibrary.org/obo/CHEBI_167666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167667 biolink:ChemicalEntity garomefrine A sulfonamide that is benzene substituted by (methylsulfonyl)amino, (1R)-2-amino-1-hydroxyethyl and fluoro groups at positions 1, 3 and 4, respectively. It is a selective agonist of α1A adrenoreceptor. cas:137431-02-8|chemspider:8014483|pubmed:10367106|pubmed:10425363|pubmed:10468772|pubmed:11413741|pubmed:15100386|pubmed:8719417|pubmed:9007522 Graph (-)-garomefrin|N-{3-[(1R)-2-amino-1-hydroxyethyl]-4-fluorophenyl}methanesulfonamide|NS-49 (free base) N-{3-[(1R)-2-amino-1-hydroxyethyl]-4-fluorophenyl}methanesulfonamide (-)-garomefrin|N-{3-[(1R)-2-amino-1-hydroxyethyl]-4-fluorophenyl}methanesulfonamide|NS-49 (free base) http://purl.obolibrary.org/obo/CHEBI_167667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167668 biolink:ChemicalEntity (2R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol A 2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol that has R-configuration. It is a sphingosine kinase-2 inhibitor. cas:1382486-90-9|chemspider:28667627|pubmed:12954648|pubmed:21620961|pubmed:23113536|pubmed:23314175|pubmed:24396570|pubmed:24471412|pubmed:24486401|pubmed:24970170|pubmed:25643074|pubmed:26985306|pubmed:27864936|pubmed:28408190|pubmed:30359564|pubmed:33035646 Graph (2R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|(R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|(R)-FTY720 methyl ether|(R)-FTY720-OMe (2R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol (2R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|(R)-2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|(R)-FTY720 methyl ether|(R)-FTY720-OMe http://purl.obolibrary.org/obo/CHEBI_167668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167669 biolink:ChemicalEntity (E)-2-[[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]benzoic acid A member of the class of 1,3-thiazoles that is 1,3-thiazole substituted by (2E)-2-(2-carboxybenzylidene)hydrazinyl and 2-chlorophenyl groups at positions 2 and 4, respectively. It is a potent inhibitor of human dihydroorotate dehydrogenase (hDHODH) with IC50 of 32 nM. It exhibits antineoplastic activity and broad-spectrum antiviral activity against various RNA viruses including influenza A, Zika, Ebola, and SARS-CoV-2 viruses. pdb-ccd:3X2|pubmed:32754890 Graph 2-[(E)-{2-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid|S312 2-[(E)-{2-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid 2-[(E)-{2-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid|S312 http://purl.obolibrary.org/obo/CHEBI_167669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16767 biolink:ChemicalEntity 3,4-dichloroaniline A dichloroaniline having the two chloro-substituents at the 3- and 4-positions. beilstein:636837|cas:95-76-1|gmelin:602350|kegg.compound:C02791|pubmed:16169045 Graph 1-amino-3,4-dichlorobenzene|3,4-DCA|3,4-Dichloranilin|3,4-Dichloroaniline|3,4-dichloraniline|3,4-dichloroaniline|3,4-dichlorobenzenamine|4,5-dichloroaniline|m,p-dichloroaniline 3,4-Dichloroaniline|3,4-dichloroaniline 1-amino-3,4-dichlorobenzene|3,4-DCA|3,4-Dichloranilin|3,4-Dichloroaniline|3,4-dichloraniline|3,4-dichloroaniline|3,4-dichlorobenzenamine|4,5-dichloroaniline|m,p-dichloroaniline http://purl.obolibrary.org/obo/CHEBI_16767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167670 biolink:ChemicalEntity SCH772984 A member of the class of indazoles that is 1H-indazole substituted by pyridin-4-yl and {[(3R)-1-(2-oxo-2-{4-[4-(pyrimidin-2-yl)phenyl]piperazin-1-yl}ethyl)pyrrolidin-3-yl]carbonyl}amino groups at positions 3 and 5, respectively. It is a potent inhibitor of mitogen-activated protein kinases ERK1 and ERK2 (IC50 = 4 and 1 nM, respectively) that exhibits anti-cancer properties. cas:942183-80-4|lincs.smallmolecule:LSM-45224|pdb-ccd:38Z|pdb-ccd:F3Z|pubmed:23847348|pubmed:25142146|pubmed:25195011|pubmed:26832798|pubmed:27275127|pubmed:28781955|pubmed:29193645|pubmed:29262554|pubmed:29775310|pubmed:30915617|pubmed:31055884|pubmed:31311868|pubmed:32652503|pubmed:32821122|pubmed:33105944|pubmed:33151174|pubmed:33231464|pubmed:33258389|pubmed:33595872|pubmed:33692846|pubmed:33706642 Graph (3R)-1-(2-oxo-2-{4-[4-(pyrimidin-2-yl)phenyl]piperazin-1-yl}ethyl)-N-[3-(pyridin-4-yl)-1H-indazol-5-yl]pyrrolidine-3-carboxamide|(3R)-1-[2-oxo-2-[4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl]ethyl]-N-[3-(4-pyridinyl)-1H-indazol-5-yl]-3-pyrrolidinecarboxamide|SCH 772984|SCH-772984 (3R)-1-(2-oxo-2-{4-[4-(pyrimidin-2-yl)phenyl]piperazin-1-yl}ethyl)-N-[3-(pyridin-4-yl)-1H-indazol-5-yl]pyrrolidine-3-carboxamide (3R)-1-(2-oxo-2-{4-[4-(pyrimidin-2-yl)phenyl]piperazin-1-yl}ethyl)-N-[3-(pyridin-4-yl)-1H-indazol-5-yl]pyrrolidine-3-carboxamide|(3R)-1-[2-oxo-2-[4-[4-(2-pyrimidinyl)phenyl]-1-piperazinyl]ethyl]-N-[3-(4-pyridinyl)-1H-indazol-5-yl]-3-pyrrolidinecarboxamide|SCH 772984|SCH-772984 http://purl.obolibrary.org/obo/CHEBI_167670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167671 biolink:ChemicalEntity SLM6071469 A 1,2,4-oxadiazole that is substituted by 3-(trifluoromethyl)-4-{[4-(trifluoromethyl)benzyl]oxy}phenyl and (2S)-1-carbamimidoylpyrrolidin-2-yl groups at positions 3 and 5, respectively. It is a potent inhibitor of sphingosine kinase 2 (SphK2) with Ki of 89 nM. chemspider:88298529|patent:WO2017172989|pubmed:31895563 Graph (2S)-2-[3-[3-(trifluoromethyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboximidamide|(2S)-2-{3-[3-(trifluoromethyl)-4-{[4-(trifluoromethyl)benzyl]oxy}phenyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carboximidamide|(S)-2-(3-(3-(trifluoromethyl)-4-((4-(trifluoromethyl)benzyl)oxy)phenyl)-1,2,4-oxadiazol-5-yl)pyrrolidine-1-carboximidamide|SLM 6071469|SLM-6071469 (2S)-2-{3-[3-(trifluoromethyl)-4-{[4-(trifluoromethyl)benzyl]oxy}phenyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carboximidamide (2S)-2-[3-[3-(trifluoromethyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboximidamide|(2S)-2-{3-[3-(trifluoromethyl)-4-{[4-(trifluoromethyl)benzyl]oxy}phenyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carboximidamide|(S)-2-(3-(3-(trifluoromethyl)-4-((4-(trifluoromethyl)benzyl)oxy)phenyl)-1,2,4-oxadiazol-5-yl)pyrrolidine-1-carboximidamide|SLM 6071469|SLM-6071469 http://purl.obolibrary.org/obo/CHEBI_167671 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167672 biolink:ChemicalEntity TAK-580 A 1,3-thiazolecarboxamide that is 2-[(1R)-1-aminoethyl]-1,3-thiazole-5-carboxylic acid in which the carboxy group undergoes formal condensation with the amino group of 5-chloro-4-(trifluoromethyl)pyridin-2-amine and in which the amino group undergoes formal condensation with the carboxy group of 6-amino-5-chloropyrimidine-4-carboxylic acid. It is a pan-RAF kinase inhibitor which is currently in clinical development for the treatment of radiographically recurrent or progressive low-grade glioma in children and young adults. cas:1096708-71-2|chemspider:28637796|drugbank:DB15266|lincs.smallmolecule:LSM-45644|patent:US20090036419|pdb-ccd:QOP|pmc:PMC6012010|pmc:PMC7715228|pmc:PMC7715396|pubmed:27768280|pubmed:28082416|pubmed:30622172|pubmed:32588846|pubmed:33216827 Graph 2-[(1R)-1-[(6-amino-5-chloropyrimidine-4-carbonyl)amino]ethyl]-N-[5-chloro-4-(trifluoromethyl)pyridin-2-yl]-1,3-thiazole-5-carboxamide|6-amino-5-chloro-N-[(1R)-1-(5-{[5-chloro-4-(trifluoromethyl)pyridin-2-yl]carbamoyl}-1,3-thiazol-2-yl)ethyl]pyrimidine-4-carboxamide|AMG 2112819|AMG-2112819|AMG2112819|BIIB 024|BIIB-024|BIIB024|DAY101|MLN 2480|MLN-2480|MLN2480|TAK 580|TAK580 6-amino-5-chloro-N-[(1R)-1-(5-{[5-chloro-4-(trifluoromethyl)pyridin-2-yl]carbamoyl}-1,3-thiazol-2-yl)ethyl]pyrimidine-4-carboxamide 2-[(1R)-1-[(6-amino-5-chloropyrimidine-4-carbonyl)amino]ethyl]-N-[5-chloro-4-(trifluoromethyl)pyridin-2-yl]-1,3-thiazole-5-carboxamide|6-amino-5-chloro-N-[(1R)-1-(5-{[5-chloro-4-(trifluoromethyl)pyridin-2-yl]carbamoyl}-1,3-thiazol-2-yl)ethyl]pyrimidine-4-carboxamide|AMG 2112819|AMG-2112819|AMG2112819|BIIB 024|BIIB-024|BIIB024|DAY101|MLN 2480|MLN-2480|MLN2480|TAK 580|TAK580 http://purl.obolibrary.org/obo/CHEBI_167672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167673 biolink:ChemicalEntity TAK-632 A member of the class of benzothiazoles that is 1,3-benzothiazole substituted by (cyclopropanecarbonyl)amino, 4-fluoro-3-{2-[3-(trifluoromethyl)phenyl]acetamido}phenoxy, and cyano groups at positions 2, 6 and 7, respectively. It is a potent pan-RAF inhibitor with IC50 of 1.4, 2.4 and 8.3 nM for CRAF, BRAFV600E, BRAFWT, respectively. cas:1228591-30-7|pdb-ccd:1SU|pubmed:23906342|pubmed:24121489|pubmed:26862741|pubmed:27155899|pubmed:29727562|pubmed:30825190|pubmed:31095385|pubmed:31734178 Graph N-(7-cyano-6-(4-fluoro-3-(2-(3-(trifluoromethyl)phenyl)acetamido)phenoxy)benzo[d]thiazol-2-yl)cyclopropanecarboxamide|N-[5-[[7-cyano-2-[(cyclopropylcarbonyl)amino]-6-benzothiazolyl]oxy]-2-fluorophenyl]-3-(trifluoromethyl)-benzeneacetamide|N-[7-cyano-6-(4-fluoro-3-{2-[3-(trifluoromethyl)phenyl]acetamido}phenoxy)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide|TAK 632|TAK632 N-[7-cyano-6-(4-fluoro-3-{2-[3-(trifluoromethyl)phenyl]acetamido}phenoxy)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide N-(7-cyano-6-(4-fluoro-3-(2-(3-(trifluoromethyl)phenyl)acetamido)phenoxy)benzo[d]thiazol-2-yl)cyclopropanecarboxamide|N-[5-[[7-cyano-2-[(cyclopropylcarbonyl)amino]-6-benzothiazolyl]oxy]-2-fluorophenyl]-3-(trifluoromethyl)-benzeneacetamide|N-[7-cyano-6-(4-fluoro-3-{2-[3-(trifluoromethyl)phenyl]acetamido}phenoxy)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide|TAK 632|TAK632 http://purl.obolibrary.org/obo/CHEBI_167673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167674 biolink:ChemicalEntity tesevatinib A member of the class of quinazolines that is quinazoline substituted by (3,4-dichloro-2-fluorophenyl)amino, methoxy, and [(3aR,5r,6aS)-2-methyloctahydrocyclopenta[c]pyrrol-5-yl]methoxy groups at positions 4, 6 and 7, respectively. It is a multi-target tyrosine kinase inhibitor of EGFR, ErbB2, KDR, Flt4 and EphB4 and exhibits anti-cancer properties. cas:781613-23-8|chemspider:32699556|drugbank:DB11973|kegg.drug:D11772|pubmed:17575237|pubmed:18413839|pubmed:18520300|pubmed:19362942|pubmed:22011666|pubmed:22173702|pubmed:22722787|pubmed:23411383|pubmed:28729967|pubmed:30030583|pubmed:31692482|wikipedia.en:Tesevatinib Graph 7-{[(3aR,5R,6aS)-2-methyl-octahydrocyclopenta[c]pyrrol-5-yl]methoxy}-N-(3,4-dichloro-2-fluorophenyl)-6-methoxyquinazolin-4-amine|EXEL 7647|EXEL-7647|EXEL7647|KD 019|KD-019|KD019|N-(3,4-dichloro-2-fluorophenyl)-6-methoxy-7-{[(3aR,5r,6aS)-2-methyloctahydrocyclopenta[c]pyrrol-5-yl]methoxy}quinazolin-4-amine|XL 647|XL-647|XL647|tesevatinib|tesevatinibum N-(3,4-dichloro-2-fluorophenyl)-6-methoxy-7-{[(3aR,5r,6aS)-2-methyloctahydrocyclopenta[c]pyrrol-5-yl]methoxy}quinazolin-4-amine 7-{[(3aR,5R,6aS)-2-methyl-octahydrocyclopenta[c]pyrrol-5-yl]methoxy}-N-(3,4-dichloro-2-fluorophenyl)-6-methoxyquinazolin-4-amine|EXEL 7647|EXEL-7647|EXEL7647|KD 019|KD-019|KD019|N-(3,4-dichloro-2-fluorophenyl)-6-methoxy-7-{[(3aR,5r,6aS)-2-methyloctahydrocyclopenta[c]pyrrol-5-yl]methoxy}quinazolin-4-amine|XL 647|XL-647|XL647|tesevatinib|tesevatinibum http://purl.obolibrary.org/obo/CHEBI_167674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167677 biolink:ChemicalEntity EC 6.1.1.6 (lysine--tRNA ligase) inhibitor An EC 6.1.1.* (ligases forming aminoacyl tRNA and related compounds) inhibitor that specifically inhibits the action of lysine-tRNA ligase (EC 6.1.1.6). wikipedia.en:Lysine-tRNA_ligase Graph EC 6.1.1.6 (lysine--tRNA ligase) inhibitors|EC 6.1.1.6 inhibitor|EC 6.1.1.6 inhibitors|L-lysine-transfer RNA ligase inhibitor|L-lysine-transfer RNA ligase inhibitors|L-lysine:tRNA(Lys) ligase (AMP-forming) inhibitor|L-lysine:tRNA(Lys) ligase (AMP-forming) inhibitors|LysRS inhibitor|LysRS inhibitors|lysine translase inhibitor|lysine translase inhibitors|lysine--tRNA ligase inhibitor|lysine--tRNA ligase inhibitors|lysine-tRNA synthetase inhibitor|lysine-tRNA synthetase inhibitors|lysyl-tRNA synthetase inhibitor|lysyl-tRNA synthetase inhibitors|lysyl-transfer RNA synthetase inhibitor|lysyl-transfer RNA synthetase inhibitors|lysyl-transfer ribonucleate synthetase inhibitor|lysyl-transfer ribonucleate synthetase inhibitors EC 6.1.1.6 (lysine--tRNA ligase) inhibitors|EC 6.1.1.6 inhibitor|EC 6.1.1.6 inhibitors|L-lysine-transfer RNA ligase inhibitor|L-lysine-transfer RNA ligase inhibitors|L-lysine:tRNA(Lys) ligase (AMP-forming) inhibitor|L-lysine:tRNA(Lys) ligase (AMP-forming) inhibitors|LysRS inhibitor|LysRS inhibitors|lysine translase inhibitor|lysine translase inhibitors|lysine--tRNA ligase inhibitor|lysine--tRNA ligase inhibitors|lysine-tRNA synthetase inhibitor|lysine-tRNA synthetase inhibitors|lysyl-tRNA synthetase inhibitor|lysyl-tRNA synthetase inhibitors|lysyl-transfer RNA synthetase inhibitor|lysyl-transfer RNA synthetase inhibitors|lysyl-transfer ribonucleate synthetase inhibitor|lysyl-transfer ribonucleate synthetase inhibitors http://purl.obolibrary.org/obo/CHEBI_167677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167679 biolink:ChemicalEntity garomefrine(1+) A primary ammonium ion that is the conjugate acid of garomefrine, obtained from the protonation of the primary amino group. Major microspecies at pH 7.3. Graph (2R)-2-{2-fluoro-5-[(methylsulfonyl)amino]phenyl}-2-hydroxyethanaminium|garomefrine cation (2R)-2-{2-fluoro-5-[(methylsulfonyl)amino]phenyl}-2-hydroxyethanaminium (2R)-2-{2-fluoro-5-[(methylsulfonyl)amino]phenyl}-2-hydroxyethanaminium|garomefrine cation http://purl.obolibrary.org/obo/CHEBI_167679 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16768 biolink:ChemicalEntity mycothiol A pseudodisaccharide, 1D-myo-inosityl-α-D-glucopyranoside, in which the hydroxy group at the 2-position of the glucose moiety is replaced by an (N-acetyl-L-cysteinyl)amido group. beilstein:9308053|cas:192126-76-4|kegg.compound:C06717|kegg.glycan:G11174|metacyc.compound:CPD1G-2|pubmed:11929223|pubmed:12809551|pubmed:14594852|pubmed:16768|pubmed:17428791|pubmed:17644601|pubmed:18772286|pubmed:19505149|pubmed:21919472|pubmed:22992771|pubmed:23428102|pubmed:23615850|pubmed:9804803|reaxys:9308053|wikipedia.en:Mycothiol Graph (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside|1-D-myo-inositol-2-(N-acetyl-L-cysteinyl)amino-2-deoxy-alpha-D-glucopyranoside|1-O-(2'-[N-acetyl-L-cysteinyl]amido-2'-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol|1-O-(2-[N-acetyl-L-cysteinyl]amido-2-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol|1-O-[2-(N(2)-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-1D-myo-inositol|1-O-[2-(N-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-D-myo-inositol|1-O-[2-[[(2R)-2-(acetylamino)-3-mercapto-1-oxopropyl]amino]-2-deoxy-alpha-D-glucopyranosyl]-D-myo-inositol|1-O-{2-[(N-acetyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranosyl}-1D-myo-inositol|1D-1-O-[2-(N-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-myo-inositol|AcCys-GlcN-Ins|MSH|Mycothiol|mycothiol 1-O-{2-[(N-acetyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranosyl}-1D-myo-inositol (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl 2-[(N-acetyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranoside|1-D-myo-inositol-2-(N-acetyl-L-cysteinyl)amino-2-deoxy-alpha-D-glucopyranoside|1-O-(2'-[N-acetyl-L-cysteinyl]amido-2'-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol|1-O-(2-[N-acetyl-L-cysteinyl]amido-2-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol|1-O-[2-(N(2)-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-1D-myo-inositol|1-O-[2-(N-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-D-myo-inositol|1-O-[2-[[(2R)-2-(acetylamino)-3-mercapto-1-oxopropyl]amino]-2-deoxy-alpha-D-glucopyranosyl]-D-myo-inositol|1-O-{2-[(N-acetyl-L-cysteinyl)amino]-2-deoxy-alpha-D-glucopyranosyl}-1D-myo-inositol|1D-1-O-[2-(N-acetyl-L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-myo-inositol|AcCys-GlcN-Ins|MSH|Mycothiol|mycothiol http://purl.obolibrary.org/obo/CHEBI_16768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167686 biolink:ChemicalEntity brivanib A secondary alcohol resulting from the hydrolysis of the carboxylic ester group of brivanib alaninate. It is a dual VEGFR-2/FGFR-1 kinase inhibitor whose alanine prodrug, brivanib alaninate is currently under development as an oral agent for the treatment of cancer. cas:649735-46-6|chemspider:9409099|drugbank:DB11958|kegg.drug:D09589|patent:WO2011044019|pubmed:16570908|pubmed:18288793|pubmed:19396600|pubmed:20671097|pubmed:21289073|pubmed:24780101|pubmed:30595557|pubmed:31270802|pubmed:31522033|pubmed:31633365 Graph (2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-ol|(R)-1-(4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5- methylpyrrolo[2,1-f][1,2,4]triazin-6-yloxy)propan- 2-ol|BMS 540215|BMS-540215|BMS540215 (2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-ol (2R)-1-({4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl}oxy)propan-2-ol|(R)-1-(4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5- methylpyrrolo[2,1-f][1,2,4]triazin-6-yloxy)propan- 2-ol|BMS 540215|BMS-540215|BMS540215 http://purl.obolibrary.org/obo/CHEBI_167686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16769 biolink:ChemicalEntity 2-oxoglutaramate cas:18465-19-5|kegg.compound:C00940 Graph 2-oxoglutaramate|5-amino-2,5-dioxopentanoate|alpha-ketoglutaramate 5-amino-2,5-dioxopentanoate 2-oxoglutaramate|5-amino-2,5-dioxopentanoate|alpha-ketoglutaramate http://purl.obolibrary.org/obo/CHEBI_16769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167695 biolink:ChemicalEntity punicalagin An ellagitannin with formula C48H28O30. It is found in pomegranates and exhibits potent antiinflammatory, antiatherogenic, anticancer, and antioxidant activities. agr:IND608581801|cas:65995-63-3|chemspider:29272136|foodb.food:FDB016425|hmdb:HMDB0005795|kegg.compound:C22601|knapsack:C00035378|pmc:PMC10915914|pubmed:38085406|pubmed:38266943|pubmed:38455601|pubmed:38609050|pubmed:38625605|pubmed:38731737|pubmed:38846010|pubmed:38874578|pubmed:38897439|pubmed:38952775|pubmed:39133816|pubmed:39330819|pubmed:39345747|pubmed:39364871|pubmed:39408858|pubmed:39508604|pubmed:39752744|pubmed:39756314|pubmed:39823794|pubmed:39970756|pubmed:39994845|pubmed:40018013|pubmed:9720629|wikipedia.en:Punicalagin Graph (1R,35R,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo[33.20.0.0(4,9).0(10,19).0(13,18).0(16,25).0(17,22).0(26,31).0(38,55).0(41,46).0(47,52)]pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone (non-preferred name) (1R,35R,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo[33.20.0.0(4,9).0(10,19).0(13,18).0(16,25).0(17,22).0(26,31).0(38,55).0(41,46).0(47,52)]pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone (non-preferred name) (1R,35R,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo[33.20.0.0(4,9).0(10,19).0(13,18).0(16,25).0(17,22).0(26,31).0(38,55).0(41,46).0(47,52)]pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone (non-preferred name) http://purl.obolibrary.org/obo/CHEBI_167695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16770 biolink:ChemicalEntity N(5)-(L-1-carboxyethyl)-L-ornithine The N5-[(S)-1-carboxyethyl] derivative of L-ornithine. kegg.compound:C04210 Graph N(5)-[(1S)-1-carboxyethyl]-L-ornithine|N5-(L-1-Carboxyethyl)-L-ornithine N(5)-[(1S)-1-carboxyethyl]-L-ornithine N(5)-[(1S)-1-carboxyethyl]-L-ornithine|N5-(L-1-Carboxyethyl)-L-ornithine http://purl.obolibrary.org/obo/CHEBI_16770 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167704 biolink:ChemicalEntity necroptosis inhibitor Any substance that inhibits the process of necroptosis (programmed form of necrosis) in organisms. Graph necroptosis inhibitors necroptosis inhibitors http://purl.obolibrary.org/obo/CHEBI_167704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167707 biolink:ChemicalEntity acalabrutinib A member of the class of imidazopyrazines that is imidazo[1,5-a]pyrazine substituted by 4-(pyridin-2-ylcarbamoyl)phenyl, (2S)-1-(but-2-ynoyl)pyrrolidin-2-yl, and amino groups at positions 1, 3 and 8, respectively. It is an irreversible second-generation Bruton's tyrosine kinase (BTK) inhibitor that is approved by the FDA for the treatment of adult patients with mantle cell lymphoma (MCL) who have received at least one prior therapy. cas:1420477-60-6|chemspider:36764951|drugbank:DB11703|drugcentral:5260|kegg.drug:D10893|pubmed:26641137|pubmed:26957112|pubmed:28642301|pubmed:28882879|pubmed:30664965|pubmed:30681658|pubmed:30967367|pubmed:31306750|pubmed:31355927|pubmed:31686856|pubmed:31738609|pubmed:31866282|pubmed:31915195|pubmed:32202637|pubmed:32256115|pubmed:32305083|pubmed:32358576|pubmed:32675912|pubmed:32678359|pubmed:32757302|pubmed:33032842|pubmed:33216986|pubmed:33322571|pubmed:33427570|pubmed:33441177|pubmed:33486852|pubmed:33491779|pubmed:33526860|pubmed:33613932|pubmed:33728735|pubmed:33730844|wikipedia.en:Acalabrutinib Graph (S)-4-(8-amino-3-(1-(but-2-ynoyl)pyrrolidin-2-yl)imidazo[1,5-a]pyrazin-1-yl)-N-(pyridin-2-yl)benzamide|4-[8-amino-3-[(2S)-1-but-2-ynoylpyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-(2-pyridyl)benzamide|4-{8-amino-3-[(2S)-1-(but-2-ynoyl)pyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl}-N-(pyridin-2-yl)benzamide|ACP-196|Calquence|acalabrutinib|acalabrutinibum 4-{8-amino-3-[(2S)-1-(but-2-ynoyl)pyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl}-N-(pyridin-2-yl)benzamide (S)-4-(8-amino-3-(1-(but-2-ynoyl)pyrrolidin-2-yl)imidazo[1,5-a]pyrazin-1-yl)-N-(pyridin-2-yl)benzamide|4-[8-amino-3-[(2S)-1-but-2-ynoylpyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-(2-pyridyl)benzamide|4-{8-amino-3-[(2S)-1-(but-2-ynoyl)pyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl}-N-(pyridin-2-yl)benzamide|ACP-196|Calquence|acalabrutinib|acalabrutinibum http://purl.obolibrary.org/obo/CHEBI_167707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167708 biolink:ChemicalEntity 2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol An aminoalcohol that is benzene substituted by a 3-amino-3-(hydroxymethyl)-4-methoxybutyl group at position 1 and an octyl group at position 4. Graph 2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|FTY720 methyl ether|FTY720-OMe 2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol 2-amino-2-(methoxymethyl)-4-(4-octylphenyl)butan-1-ol|FTY720 methyl ether|FTY720-OMe http://purl.obolibrary.org/obo/CHEBI_167708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16771 biolink:ChemicalEntity adenosine 5'-phosphoramidate The phosphoramadite analogue of AMP. cas:6154-31-0|kegg.compound:C03851|metacyc.compound:CPD-487|reaxys:54615 Graph AMP-NH2|Adenosine 5'-phosphoramidate|adenosine 5'-(hydrogen phosphoramidate) Adenosine 5'-phosphoramidate|adenosine 5'-(hydrogen phosphoramidate) AMP-NH2|Adenosine 5'-phosphoramidate|adenosine 5'-(hydrogen phosphoramidate) http://purl.obolibrary.org/obo/CHEBI_16771 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16772 biolink:ChemicalEntity xylitol 5-phosphate drugbank:DB01904|kegg.compound:C02895 Graph D-Xylitol 5-phosphate|D-xylitol 5-(dihydrogen phosphate)|Xylitol 5-phosphate D-xylitol 5-(dihydrogen phosphate) D-Xylitol 5-phosphate|D-xylitol 5-(dihydrogen phosphate)|Xylitol 5-phosphate http://purl.obolibrary.org/obo/CHEBI_16772 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167729 biolink:ChemicalEntity Methanandamide cas:157182-49-5|chemspider:4881984|lincs.smallmolecule:LSM-44079|lipidmaps:LMFA08020040 Graph (5Z,8Z,11Z,14Z)-N-[(2R)-1-hydroxypropan-2-yl]icosa-5,8,11,14-tetraenamide (5Z,8Z,11Z,14Z)-N-[(2R)-1-hydroxypropan-2-yl]icosa-5,8,11,14-tetraenamide (5Z,8Z,11Z,14Z)-N-[(2R)-1-hydroxypropan-2-yl]icosa-5,8,11,14-tetraenamide http://purl.obolibrary.org/obo/CHEBI_167729 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16773 biolink:ChemicalEntity trans-2-chloro-4-carboxymethylenebut-2-en-1,4-olide The trans-isomer of 2-chloro-4-carboxymethylenebut-2-en-1,4-olide. cas:22752-93-8|kegg.compound:C04729|umbbd.compound:c0291 Graph (2Z)-(4-chloro-5-oxofuran-2(5H)-ylidene)acetic acid|trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide|trans-2-Chlorodienelactone|trans-2-chloro-4-carboxymethylenebut-2-en-1,4-olide|trans-2-chlorodienelactone (2Z)-(4-chloro-5-oxofuran-2(5H)-ylidene)acetic acid (2Z)-(4-chloro-5-oxofuran-2(5H)-ylidene)acetic acid|trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide|trans-2-Chlorodienelactone|trans-2-chloro-4-carboxymethylenebut-2-en-1,4-olide|trans-2-chlorodienelactone http://purl.obolibrary.org/obo/CHEBI_16773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16774 biolink:ChemicalEntity (2-cis,6-trans)-farnesol beilstein:1723038|cas:3790-71-4|kegg.compound:C03220 Graph (2-cis,6-trans)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2Z,6E)-farnesol|(Z,E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|(Z,E)-farnesol|2-cis,6-trans-Farnesol|cis,trans-farnesol (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol (2-cis,6-trans)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol|(2Z,6E)-farnesol|(Z,E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|(Z,E)-farnesol|2-cis,6-trans-Farnesol|cis,trans-farnesol http://purl.obolibrary.org/obo/CHEBI_16774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16775 biolink:ChemicalEntity 3-aci-nitropropanoic acid An aci-nitro compound resulting from the tautomerisation of the nitro group of 3-nitropropanoic acid. kegg.compound:C03071 Graph 3-(hydroxynitrorylidene)propanoic acid|3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoic acid|3-[hydroxy(oxido)imino]propanoic acid|3-aci-Nitoropropionic acid|3-aci-Nitropropionic acid|3-aci-nitropropanoic acid 3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoic acid|3-aci-nitropropanoic acid 3-(hydroxynitrorylidene)propanoic acid|3-[hydroxy(oxido)-lambda(5)-azanylidene]propanoic acid|3-[hydroxy(oxido)imino]propanoic acid|3-aci-Nitoropropionic acid|3-aci-Nitropropionic acid|3-aci-nitropropanoic acid http://purl.obolibrary.org/obo/CHEBI_16775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16776 biolink:ChemicalEntity tabersonine A monoterpenoid indole alkaloid with cytotoxic activity. cas:4429-63-4|kegg.compound:C09244|knapsack:C00001773|pubmed:16667836|pubmed:23137274|reaxys:50163 Graph (5alpha,12beta,19alpha)-2,3,6,7-tetradehydroaspidospermidine-3-carboxylic acid, methyl ester|Tabersonin|Tabersonine|methyl (5alpha,12beta,19alpha)-2,3,6,7-tetradehydroaspidospermidine-3-carboxylate|methyl 2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate methyl 2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate (5alpha,12beta,19alpha)-2,3,6,7-tetradehydroaspidospermidine-3-carboxylic acid, methyl ester|Tabersonin|Tabersonine|methyl (5alpha,12beta,19alpha)-2,3,6,7-tetradehydroaspidospermidine-3-carboxylate|methyl 2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate http://purl.obolibrary.org/obo/CHEBI_16776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16777 biolink:ChemicalEntity berbamunine cas:485-18-7|kegg.compound:C05177|knapsack:C00025262|knapsack:C00027522 Graph (1S)-1,2,3,4-Tetrahydro-1-[[4-[2-hydroxy-5-[[(1R)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1S)-1,2,3,4-tetrahydro-1-[[4-[2-hydroxy-5-[[(1R)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1S)-1-[4-(2-hydroxy-5-{[(1R)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)benzyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|Berbamunine (1S)-1-[4-(2-hydroxy-5-{[(1R)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)benzyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (1S)-1,2,3,4-Tetrahydro-1-[[4-[2-hydroxy-5-[[(1R)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1S)-1,2,3,4-tetrahydro-1-[[4-[2-hydroxy-5-[[(1R)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-2-methyl-1-isoquinolinyl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1S)-1-[4-(2-hydroxy-5-{[(1R)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}phenoxy)benzyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|Berbamunine http://purl.obolibrary.org/obo/CHEBI_16777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16778 biolink:ChemicalEntity apigenin 7-O-beta-D-glucoside A glycosyloxyflavone that is apigenin substituted by a β-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. cas:578-74-5|hmdb:HMDB0037340|kegg.compound:C04608|knapsack:C00001017|lincs.smallmolecule:LSM-2286|metacyc.compound:APIGENIN-7-O-BETA-D-GLUCOSIDE|pubmed:17186490|pubmed:19112896|pubmed:21656359|pubmed:21756194|reaxys:65669|wikipedia.en:Apigetrin Graph 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone|Apigenin 7-O-glucoside|Apigetrin|Cosmetin|Cosmosiin|Cosmosioside|apigenin 7-O-beta-D-glucoside 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone|Apigenin 7-O-glucoside|Apigetrin|Cosmetin|Cosmosiin|Cosmosioside|apigenin 7-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_16778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16780 biolink:ChemicalEntity N-(6-aminohexanoyl)-6-aminohexanoate kegg.compound:C01255 Graph 6-(6-aminohexanamido)hexanoate|6-[(6-aminohexanoyl)amino]hexanoate|N-(6-Aminohexanoyl)-6-aminohexanoate 6-(6-aminohexanamido)hexanoate 6-(6-aminohexanamido)hexanoate|6-[(6-aminohexanoyl)amino]hexanoate|N-(6-Aminohexanoyl)-6-aminohexanoate http://purl.obolibrary.org/obo/CHEBI_16780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16782 biolink:ChemicalEntity (S)-2-hydroxyglutarate(2-) A 2-hydroxyglutarate(2−) that has (2S)-configuration. kegg.compound:C03196|metacyc.compound:CPD-381|reaxys:5257108 Graph (2S)-2-hydroxypentanedioate|(S)-2-hydroxyglutarate (2S)-2-hydroxypentanedioate (2S)-2-hydroxypentanedioate|(S)-2-hydroxyglutarate http://purl.obolibrary.org/obo/CHEBI_16782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16783 biolink:ChemicalEntity 1D-myo-inositol 1,3,4,5-tetrakisphosphate A myo-inositol tetrakisphosphate having the four phosphates placed in the 1-, 3-, 4- and 5-positions. beilstein:4342568|drugbank:DB01863|kegg.compound:C01272|pdb-ccd:4IP Graph 1D-myo-Inositol 1,3,4,5-tetrakisphosphate|1D-myo-inositol 1,3,4,5-tetrakis(dihydrogen phosphate)|1D-myo-inositol 1,3,4,5-tetrakisphosphate|D-myo-Inositol 1,3,4,5-tetrakisphosphate|Inositol 1,3,4,5-tetrakisphosphate 1D-myo-inositol 1,3,4,5-tetrakis(dihydrogen phosphate) 1D-myo-Inositol 1,3,4,5-tetrakisphosphate|1D-myo-inositol 1,3,4,5-tetrakis(dihydrogen phosphate)|1D-myo-inositol 1,3,4,5-tetrakisphosphate|D-myo-Inositol 1,3,4,5-tetrakisphosphate|Inositol 1,3,4,5-tetrakisphosphate http://purl.obolibrary.org/obo/CHEBI_16783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167830 biolink:ChemicalEntity isorhapontigenin A stilbenol that is trans-stilbene in which one of the phenyl groups is substituted by hydroxy groups at positions 3 and 5, while the other phenyl group is substituted by a methoxy group at position 3 and a hydroxy group at position 4. It natural product isolated from the seeds of Aïphanes aculeata and has antioxidant, anti-tumour, and anti-inflammatory effects. chemspider:4477172|foodb.food:FDB008478|hmdb:HMDB0303171|knapsack:C00015797|metacyc.compound:CPD-27168|pubmed:11440571|pubmed:31461638|pubmed:31512108|pubmed:32178518|pubmed:33777675|pubmed:33798789|pubmed:34102010|pubmed:34332039|pubmed:35532178|pubmed:35720190|pubmed:35960477|pubmed:36039137|pubmed:36045117|pubmed:36214721|pubmed:36325776|pubmed:36367849|pubmed:37619952|pubmed:37624928|pubmed:38002023|pubmed:38339062|pubmed:38728614|pubmed:38837389|pubmed:38879516|pubmed:39046236|pubmed:39067404|pubmed:39326106|wikipedia.en:Isorhapontigenin Graph (E)-isorhapontigenin|3'-methoxyresveratrol|5-[(1E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-1,3-benzenediol|5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol|ISO|isorhapontigenin|isorhapotigenin|isorhapotogenin 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol (E)-isorhapontigenin|3'-methoxyresveratrol|5-[(1E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-1,3-benzenediol|5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol|ISO|isorhapontigenin|isorhapotigenin|isorhapotogenin http://purl.obolibrary.org/obo/CHEBI_167830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16784 biolink:ChemicalEntity 6beta-hydroxy-17beta-estradiol kegg.compound:C03935|lipidmaps:LMST02010031 Graph 6-beta-hydroxyestradiol-17-beta|6beta-Hydroxyestradiol-17beta|6beta-hydroxyestradiol-17beta|estra-1,3,5(10)-triene-3,6beta,17beta-triol estra-1,3,5(10)-triene-3,6beta,17beta-triol 6-beta-hydroxyestradiol-17-beta|6beta-Hydroxyestradiol-17beta|6beta-hydroxyestradiol-17beta|estra-1,3,5(10)-triene-3,6beta,17beta-triol http://purl.obolibrary.org/obo/CHEBI_16784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16785 biolink:ChemicalEntity diisopropyl hydrogen phosphate cas:1611-31-0|kegg.compound:C03113 Graph Diisopropyl phosphate|Diisopropylphosphate|Phosphoric acid, bis(1-methylethyl) ester|diisopropyl hydrogen phosphate Diisopropyl phosphate|diisopropyl hydrogen phosphate Diisopropyl phosphate|Diisopropylphosphate|Phosphoric acid, bis(1-methylethyl) ester|diisopropyl hydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_16785 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16786 biolink:ChemicalEntity vestitone A hydroxyisoflavanone that is isoflavanone substituted by hydroxy groups at positions 7 and 2' and a methoxy group at position 4'. cas:158112-50-6|cas:66211-83-4|hmdb:HMDB0031620|kegg.compound:C00786|knapsack:C00002584|lipidmaps:LMPK12050462|metacyc.compound:VESTITONE|pubmed:20079815|pubmed:22117168|reaxys:19983204 Graph (3R)-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(3R)-vestitol|(3R)-vestitone|2,3-Dihydro-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|7,2'-Dihydroxy-4'-methoxyisoflavanone|Vestitone (3R)-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one (3R)-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(3R)-vestitol|(3R)-vestitone|2,3-Dihydro-7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|7,2'-Dihydroxy-4'-methoxyisoflavanone|Vestitone http://purl.obolibrary.org/obo/CHEBI_16786 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167868 biolink:ChemicalEntity morpholinium A secondary ammonium ion that is the conjugate acid of morpholine resulting from the protonation of the NH group. Major microspecies at pH 7.3. chemspider:4199185|metacyc.compound:MORPHOLINE|pubmed:19586072|pubmed:25681783|pubmed:26099357|pubmed:26744296|pubmed:28407378|pubmed:28707619|pubmed:32149213|pubmed:32272314 Graph morpholin-4-ium morpholin-4-ium morpholin-4-ium http://purl.obolibrary.org/obo/CHEBI_167868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16787 biolink:ChemicalEntity 1-phospho-alpha-D-glucuronic acid The 1-O-phospho derivative of α-D-glucuronic acid. kegg.compound:C05385 Graph 1-O-phosphono-alpha-D-glucopyranuronic acid|1-Phospho-alpha-D-glucuronate 1-O-phosphono-alpha-D-glucopyranuronic acid 1-O-phosphono-alpha-D-glucopyranuronic acid|1-Phospho-alpha-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_16787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16788 biolink:ChemicalEntity CMP-N-acyl-beta-neuraminic acid A CMP-sugar in which the sugar component consists of any N-acyl-β-neuraminic acid. kegg.compound:C01064 Graph CMP-N-acylneuraminate CMP-N-acylneuraminate http://purl.obolibrary.org/obo/CHEBI_16788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167885 biolink:ChemicalEntity primary fluorescent dioxobilin-type chlorophyll catabolite(1-) Graph pFDCC(1-)|primary FDCC(1-)|primary fluorescent dioxobilin-type chlorophyll catabolite pFDCC(1-)|primary FDCC(1-)|primary fluorescent dioxobilin-type chlorophyll catabolite http://purl.obolibrary.org/obo/CHEBI_167885 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:167889 biolink:ChemicalEntity O13(4)-desmethyl primary fluorescent dioxobilin-type chlorophyll catabolite(2-) pubmed:22147518|pubmed:27109476 Graph O13(4)-desmethyl pFDCC O13(4)-desmethyl pFDCC http://purl.obolibrary.org/obo/CHEBI_167889 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16789 biolink:ChemicalEntity aldehydo-D-lyxose A D-lyxose in open-chain aldehyde form. cas:1114-34-7|glytoucan:G88438YV|kegg.compound:C00476 Graph D-Lyx|D-Lyxose|D-lyxo-pentose|D-lyxose D-Lyxose|D-lyxo-pentose|D-lyxose D-Lyx|D-Lyxose|D-lyxo-pentose|D-lyxose http://purl.obolibrary.org/obo/CHEBI_16789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:167890 biolink:ChemicalEntity glycyl-L-glutamate(1-) residue pubmed:28576883 Graph glycyl-L-glutamate residue glycyl-L-glutamate residue http://purl.obolibrary.org/obo/CHEBI_167890 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16790 biolink:ChemicalEntity 15,16-dihydrobiliverdin cas:137429-14-2|kegg.compound:C11630 Graph 15,16-Dihydrobiliverdin|15,16-Dihydrobiliverdin IXalpha|8,12-bis(2-carboxyethyl)-3,18-ethenyl-2,7,13,17-tetramethyl-15,16-dihydrobilin-1,19(21H,24H)-dione 8,12-bis(2-carboxyethyl)-3,18-ethenyl-2,7,13,17-tetramethyl-15,16-dihydrobilin-1,19(21H,24H)-dione 15,16-Dihydrobiliverdin|15,16-Dihydrobiliverdin IXalpha|8,12-bis(2-carboxyethyl)-3,18-ethenyl-2,7,13,17-tetramethyl-15,16-dihydrobilin-1,19(21H,24H)-dione http://purl.obolibrary.org/obo/CHEBI_16790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16791 biolink:ChemicalEntity vinorine kegg.compound:C11807 Graph 22-norajmala-1,19-dien-17alpha-yl acetate|Vinorine|vinorine 22-norajmala-1,19-dien-17alpha-yl acetate 22-norajmala-1,19-dien-17alpha-yl acetate|Vinorine|vinorine http://purl.obolibrary.org/obo/CHEBI_16791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16792 biolink:ChemicalEntity oxidized Photinus luciferin beilstein:919274|drugbank:DB08326|kegg.compound:C03797 Graph 2-(6-hydroxy-1,3-benzothiazol-2-yl)-1,3-thiazol-4(5H)-one|Oxidized Photinus luciferin|firefly oxyluciferin 2-(6-hydroxy-1,3-benzothiazol-2-yl)-1,3-thiazol-4(5H)-one 2-(6-hydroxy-1,3-benzothiazol-2-yl)-1,3-thiazol-4(5H)-one|Oxidized Photinus luciferin|firefly oxyluciferin http://purl.obolibrary.org/obo/CHEBI_16792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16793 biolink:ChemicalEntity mercury(2+) kegg.compound:C00703|pdb-ccd:HG|umbbd.compound:c0096 Graph Hg(2+)|Hg2+|MERCURY (II) ION|Mercuric ion|mercuric ion|mercury(2+)|mercury(2+) ion|mercury(II)|mercury(II) cation mercury(2+)|mercury(2+) ion|mercury(II) cation Hg(2+)|Hg2+|MERCURY (II) ION|Mercuric ion|mercuric ion|mercury(2+)|mercury(2+) ion|mercury(II)|mercury(II) cation http://purl.obolibrary.org/obo/CHEBI_16793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16794 biolink:ChemicalEntity scopolamine A tropane alkaloid that is the (S)-tropic acid ester of 6β,7β-epoxy-1αH,5αH-tropan-3α-ol. cas:51-34-3|drugbank:DB00747|hmdb:HMDB0003573|kegg.compound:C01851|kegg.drug:D00138|knapsack:C00002292|metacyc.compound:SCOPOLAMINE|pubmed:11718188|pubmed:23334071|reaxys:91904|wikipedia.en:Scopolamine Graph (-)-Hyoscine|(-)-hyoscine|(-)-scopolamine|(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate|(1S,3S,5R,6R,7S)-6,7-epoxytropan-3-yl (2S)-3-hydroxy-2-phenylpropanoate|6,7-Epoxytropine tropate|6-beta,7-beta-Epoxy-3-alpha-tropanyl S-(-)-tropate|Hyoscine|Scopolamine|Transderm-Scop|alpha-(Hydroxymethyl)benzeneacetic acid 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2.4))non-7-yl ester|scopine (-)-tropate|scopolamine (1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate (-)-Hyoscine|(-)-hyoscine|(-)-scopolamine|(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate|(1S,3S,5R,6R,7S)-6,7-epoxytropan-3-yl (2S)-3-hydroxy-2-phenylpropanoate|6,7-Epoxytropine tropate|6-beta,7-beta-Epoxy-3-alpha-tropanyl S-(-)-tropate|Hyoscine|Scopolamine|Transderm-Scop|alpha-(Hydroxymethyl)benzeneacetic acid 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2.4))non-7-yl ester|scopine (-)-tropate|scopolamine http://purl.obolibrary.org/obo/CHEBI_16794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16795 biolink:ChemicalEntity L-threo-3-phenylserine A L-phenylalanine derivative carrying a hydroxy substituent at position 3. cas:6254-48-4|hmdb:HMDB0002184|kegg.compound:C03290|metacyc.compound:CPD-644|pdb-ccd:BB8|pubmed:13566053|pubmed:13596376|pubmed:22770225|reaxys:3201138 Graph (2S,3S)-2-amino-3-hydroxy-3-phenylpropanoic acid|(betaS)-beta-hydroxy-L-phenylalanine|L-threo-3-Phenylserine|L-threo-beta-phenylserine (2S,3S)-2-amino-3-hydroxy-3-phenylpropanoic acid|(betaS)-beta-hydroxy-L-phenylalanine (2S,3S)-2-amino-3-hydroxy-3-phenylpropanoic acid|(betaS)-beta-hydroxy-L-phenylalanine|L-threo-3-Phenylserine|L-threo-beta-phenylserine http://purl.obolibrary.org/obo/CHEBI_16795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16796 biolink:ChemicalEntity melatonin A member of the class of acetamides that is acetamide in which one of the hydrogens attached to the nitrogen atom is replaced by a 2-(5-methoxy-1H-indol-3-yl)ethyl group. It is a hormone secreted by the pineal gland in humans. cas:73-31-4|drugbank:DB01065|drugcentral:1672|hmdb:HMDB0001389|kegg.compound:C01598|kegg.drug:D08170|lincs.smallmolecule:LSM-4779|metacyc.compound:N-ACETYL-5-METHOXY-TRYPTAMINE|pdb-ccd:ML1|pubmed:16678784|pubmed:18212404|pubmed:18485664|pubmed:8290600|reaxys:205542|wikipedia.en:Melatonin Graph 5-methoxy-N-acetyltryptamine|Melatonin|N-Acetyl-5-methoxytryptamine|N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide|N-[2-(5-methoxyindol-3-yl)ethyl]acetamide|melatonin|melatonine N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide 5-methoxy-N-acetyltryptamine|Melatonin|N-Acetyl-5-methoxytryptamine|N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide|N-[2-(5-methoxyindol-3-yl)ethyl]acetamide|melatonin|melatonine http://purl.obolibrary.org/obo/CHEBI_16796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16797 biolink:ChemicalEntity 1-methylnicotinamide A pyridinium ion comprising nicotinamide having a methyl group at the 1-position. It is a metabolite of nicotinamide which was initially considered to be biologically inactive but has emerged as an anti-thrombotic and anti-inflammatory agent. cas:3106-60-3|chemspider:444|foodb.food:FDB022188|hmdb:HMDB0000699|kegg.compound:C02918|knapsack:C00052106|metacyc.compound:CPD-396|pdb-ccd:8GC|pubmed:10644906|pubmed:11199218|pubmed:11952169|pubmed:12829005|pubmed:12856834|pubmed:145178|pubmed:160917|pubmed:16197374|pubmed:17641676|pubmed:17826027|pubmed:18373238|pubmed:18953089|pubmed:19307696|pubmed:22770225|pubmed:22932811|pubmed:25129409|pubmed:25552403|pubmed:26066674|pubmed:26115505|pubmed:28443021|pubmed:28720493|pubmed:33317539|pubmed:33442746|pubmed:33523930|pubmed:6215856|pubmed:6448542|reaxys:3540351|wikipedia.en:1-Methylnicotinamide Graph 1-Methylnicotinamide|1-methyl nicotinamide|1-methylnicotinamide|1-methylnicotinamide cation|3-(aminocarbonyl)-1-methylpyridinium|3-carbamoyl-1-methylpyridin-1-ium|3-carbamoyl-1-methylpyridinium|N(1)-Methylnicotinamide|N(1)-methylnicotinamide|N-1-methylnicotinamide|Trigonellinamide 3-carbamoyl-1-methylpyridinium 1-Methylnicotinamide|1-methyl nicotinamide|1-methylnicotinamide|1-methylnicotinamide cation|3-(aminocarbonyl)-1-methylpyridinium|3-carbamoyl-1-methylpyridin-1-ium|3-carbamoyl-1-methylpyridinium|N(1)-Methylnicotinamide|N(1)-methylnicotinamide|N-1-methylnicotinamide|Trigonellinamide http://purl.obolibrary.org/obo/CHEBI_16797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16799 biolink:ChemicalEntity 16alpha-hydroxy steroid A 16-hydroxy steroid in which the hydroxy group at position 16 has α-configuration. kegg.compound:C01090 Graph 16alpha-Hydroxysteroid|16alpha-hydroxy steroids|a 16-alpha-hydroxysteroid 16alpha-Hydroxysteroid|16alpha-hydroxy steroids|a 16-alpha-hydroxysteroid http://purl.obolibrary.org/obo/CHEBI_16799 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16802 biolink:ChemicalEntity sedoheptulose cas:3019-74-7|kegg.compound:C02076|metacyc.compound:SEDOHEPTULOSE|pubmed:27308197|pubmed:33257730|wikipedia.en:Sedoheptulose Graph D-Altro-2-heptulose|D-altro-hept-2-ulose|D-sedoheptulose|Sedoheptulose|Volemulose|altro-Heptulose|sedoheptulose D-altro-hept-2-ulose D-Altro-2-heptulose|D-altro-hept-2-ulose|D-sedoheptulose|Sedoheptulose|Volemulose|altro-Heptulose|sedoheptulose http://purl.obolibrary.org/obo/CHEBI_16802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16803 biolink:ChemicalEntity N-acetylanthranilate An amidobenzoate consisting of anthranilate carrying an N-acetyl group. kegg.compound:C06332 Graph 2-(acetylamino)benzoate|2-acetamidobenzoate|N-Acetylanthranilate|N-acetylanthranilate 2-acetamidobenzoate 2-(acetylamino)benzoate|2-acetamidobenzoate|N-Acetylanthranilate|N-acetylanthranilate http://purl.obolibrary.org/obo/CHEBI_16803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16804 biolink:ChemicalEntity (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline cas:19716-56-4|kegg.compound:C05201 Graph (R,S)-Tetrahydrobenzylisoquinoline|(RS)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline|1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline|1BnTIQ|rac-(1R)-1-benzyl-1,2,3,4-tetrahydroisoquinoline rac-(1R)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (R,S)-Tetrahydrobenzylisoquinoline|(RS)-1-Benzyl-1,2,3,4-tetrahydroisoquinoline|1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinoline|1BnTIQ|rac-(1R)-1-benzyl-1,2,3,4-tetrahydroisoquinoline http://purl.obolibrary.org/obo/CHEBI_16804 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16805 biolink:ChemicalEntity [1-(5-phosphoribosyl)imidazol-4-yl]acetic acid kegg.compound:C04437 Graph 1-(5-Phosphoribosyl)imidazole-4-acetate|[1-(5-phosphoribofuranosyl)imidazol-4-yl]acetic acid [1-(5-phosphoribofuranosyl)imidazol-4-yl]acetic acid 1-(5-Phosphoribosyl)imidazole-4-acetate|[1-(5-phosphoribofuranosyl)imidazol-4-yl]acetic acid http://purl.obolibrary.org/obo/CHEBI_16805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16806 biolink:ChemicalEntity xanthine-8-carboxylate kegg.compound:C03314 Graph 2,6-dioxo-2,3,6,7-tetrahydro-1H-purine-8-carboxylate|xanthine-8-carboxylate 2,6-dioxo-2,3,6,7-tetrahydro-1H-purine-8-carboxylate 2,6-dioxo-2,3,6,7-tetrahydro-1H-purine-8-carboxylate|xanthine-8-carboxylate http://purl.obolibrary.org/obo/CHEBI_16806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16808 biolink:ChemicalEntity 2-dehydro-D-gluconate A keto-D-gluconate that is the conjugate base of 2-dehydro-D-gluconic acid, obtained by deprotonation of the carboxy group. beilstein:3907127 Graph 2-Dehydro-D-gluconate|2-dehydro-D-gluconate|2-ketogluconate|2-ketolactonate|D-arabino-hex-2-ulosonate D-arabino-hex-2-ulosonate 2-Dehydro-D-gluconate|2-dehydro-D-gluconate|2-ketogluconate|2-ketolactonate|D-arabino-hex-2-ulosonate http://purl.obolibrary.org/obo/CHEBI_16808 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16810 biolink:ChemicalEntity 2-oxoglutarate(2-) An oxo dicarboxylate obtained by deprotonation of both carboxy groups of 2-oxoglutaric acid. cas:64-15-3|gmelin:602479|kegg.compound:C00026|metacyc.compound:2-KETOGLUTARATE|pubmed:11913971|pubmed:15612731|pubmed:17190852|pubmed:19376872|pubmed:21184277|pubmed:21196226|pubmed:21791173|pubmed:24828042|reaxys:3664503 Graph 2-ketoglutarate|2-oxoglutarate|2-oxopentanedioate|2-oxopentanedioic acid, ion(2-)|alpha-ketoglutarate 2-oxopentanedioate 2-ketoglutarate|2-oxoglutarate|2-oxopentanedioate|2-oxopentanedioic acid, ion(2-)|alpha-ketoglutarate http://purl.obolibrary.org/obo/CHEBI_16810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16811 biolink:ChemicalEntity methionine A sulfur-containing amino acid that is butyric acid bearing an amino substituent at position 2 and a methylthio substituent at position 4. cas:59-51-8|gmelin:3117|kegg.compound:C01733|kegg.drug:D04983|pubmed:16702333|pubmed:22264337|pubmed:2543976|reaxys:636185|umbbd.compound:c0094|wikipedia.en:Methionine Graph 2-Amino-4-(methylthio)butyric acid|2-amino-4-(methylsulfanyl)butanoic acid|2-amino-4-(methylthio)butanoic acid|DL-Methionine|Hmet|M|Met|Methionin|Methionine|Racemethionine|alpha-amino-gamma-methylmercaptobutyric acid|methionine|metionina Methionine|methionine 2-Amino-4-(methylthio)butyric acid|2-amino-4-(methylsulfanyl)butanoic acid|2-amino-4-(methylthio)butanoic acid|DL-Methionine|Hmet|M|Met|Methionin|Methionine|Racemethionine|alpha-amino-gamma-methylmercaptobutyric acid|methionine|metionina http://purl.obolibrary.org/obo/CHEBI_16811 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16812 biolink:ChemicalEntity (S,S)-butane-2,3-diol The (S,S) diastereoisomer of butane-2,3-diol. beilstein:1718899|cas:19132-06-0|gmelin:600810|kegg.compound:C03046 Graph (2S,3S)-butane-2,3-diol|(S,S)-(+)-2,3-butanediol|(S,S)-2,3-Butanediol|(S,S)-2,3-Butylene glycol|(S,S)-Butane-2,3-diol|(S,S)-butane-2,3-diol (2S,3S)-butane-2,3-diol (2S,3S)-butane-2,3-diol|(S,S)-(+)-2,3-butanediol|(S,S)-2,3-Butanediol|(S,S)-2,3-Butylene glycol|(S,S)-Butane-2,3-diol|(S,S)-butane-2,3-diol http://purl.obolibrary.org/obo/CHEBI_16812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16813 biolink:ChemicalEntity galactitol An optically inactive hexitol having meso-configuration. cas:608-66-2|gmelin:83163|hmdb:HMDB0000107|kegg.compound:C01697|knapsack:C00001160|pubmed:16664750|pubmed:16901854|pubmed:17336832|pubmed:17979222|pubmed:21501963|pubmed:22155165|pubmed:22628202|pubmed:22654107|pubmed:23830453|pubmed:24643482|reaxys:1721903|wikipedia.en:Galactitol Graph (2R,3S,4R,5S)-hexane-1,2,3,4,5,6-hexol|D-Dulcitol|D-galactitol|Dulcitol|Dulcose|Euonymit|Galactitol|L-galactitol|Melampyrin|Melampyrit|galactitol|meso-galactitol meso-galactitol (2R,3S,4R,5S)-hexane-1,2,3,4,5,6-hexol|D-Dulcitol|D-galactitol|Dulcitol|Dulcose|Euonymit|Galactitol|L-galactitol|Melampyrin|Melampyrit|galactitol|meso-galactitol http://purl.obolibrary.org/obo/CHEBI_16813 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16814 biolink:ChemicalEntity dehydroepiandrosterone sulfate A steroid sulfate that is the 3-sulfooxy derivative of dehydroepiandrosterone. cas:651-48-9|drugcentral:4049|hmdb:HMDB0001032|kegg.compound:C04555|lipidmaps:LMST05020010|metacyc.compound:DEHYDRO-EPIANDROSTERONE-SULFATE|pubmed:15374110|pubmed:18307294|pubmed:20797618|pubmed:22770225|pubmed:9661815|reaxys:2227078|wikipedia.en:Dehydroepiandrosterone_sulfate Graph (3-beta)-3-(Sulfooxy)androst-5-en-17-one|17-Ketoandrost-5-en-3beta-yl sulfate|17-oxoandrost-5-en-3beta-yl hydrogen sulfate|17-oxoandrost-5-en-3beta-yl hydrogen sulphate|3-O-Sulfodehydroepiandrosterone|3beta-Hydroxyandrost-5-en-17-one 3-sulfate|3beta-hydroxyandrost-5-en-17-one 3-sulfate|Androst-5-en-17-on-3beta-yl sulfuric acid|DHEA sulfate|DHEA-S|DHEAS|Dehydroepiandrosterone 3-sulfate|Dehydroepiandrosterone monosulfate|Dehydroepiandrosterone sulfate|Dehydroepiandrosterone sulphate|Dehydroisoandrosterone sulfate|Dehydroisoandrosterone-3-sulfate|Prasterone sulfate 17-oxoandrost-5-en-3beta-yl hydrogen sulfate (3-beta)-3-(Sulfooxy)androst-5-en-17-one|17-Ketoandrost-5-en-3beta-yl sulfate|17-oxoandrost-5-en-3beta-yl hydrogen sulfate|17-oxoandrost-5-en-3beta-yl hydrogen sulphate|3-O-Sulfodehydroepiandrosterone|3beta-Hydroxyandrost-5-en-17-one 3-sulfate|3beta-hydroxyandrost-5-en-17-one 3-sulfate|Androst-5-en-17-on-3beta-yl sulfuric acid|DHEA sulfate|DHEA-S|DHEAS|Dehydroepiandrosterone 3-sulfate|Dehydroepiandrosterone monosulfate|Dehydroepiandrosterone sulfate|Dehydroepiandrosterone sulphate|Dehydroisoandrosterone sulfate|Dehydroisoandrosterone-3-sulfate|Prasterone sulfate http://purl.obolibrary.org/obo/CHEBI_16814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16815 biolink:ChemicalEntity enol-phenylpyruvate kegg.compound:C02763 Graph 2-Hydroxy-3-phenylpropenoate|2-hydroxy-3-phenylacrylate|2-hydroxy-3-phenylprop-2-enoate|enol-Phenylpyruvate|enol-phenylpyruvate 2-hydroxy-3-phenylprop-2-enoate 2-Hydroxy-3-phenylpropenoate|2-hydroxy-3-phenylacrylate|2-hydroxy-3-phenylprop-2-enoate|enol-Phenylpyruvate|enol-phenylpyruvate http://purl.obolibrary.org/obo/CHEBI_16815 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16816 biolink:ChemicalEntity flavonol 3-O-beta-D-glucoside Any glycosyloxyflavone that consists of a flavonol attached to a β-D-glucosyl residue at position 3 via a glycosidic linkage. kegg.compound:C03946|kegg.compound:C15555 Graph Flavonol 3-O-D-glucoside|Flavonol 3-O-D-glycoside|Flavonol 3-O-beta-D-glucoside|Flavonol 3-O-beta-D-glycoside|a flavonol 3-O-beta-D-glucoside|flavonol 3-O-beta-D-glucosides Flavonol 3-O-D-glucoside|Flavonol 3-O-D-glycoside|Flavonol 3-O-beta-D-glucoside|Flavonol 3-O-beta-D-glycoside|a flavonol 3-O-beta-D-glucoside|flavonol 3-O-beta-D-glucosides http://purl.obolibrary.org/obo/CHEBI_16816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16817 biolink:ChemicalEntity trans-4-hydroxycyclohexanecarboxylic acid kegg.compound:C04404 Graph trans-4-hydroxycyclohexanecarboxylic acid trans-4-hydroxycyclohexanecarboxylic acid http://purl.obolibrary.org/obo/CHEBI_16817 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16818 biolink:ChemicalEntity all-trans-pentaprenyl diphosphate beilstein:6163199|kegg.compound:C04217|kegg.compound:C16689 Graph (2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-yl trihydrogen diphosphate|(2E,6E,10E,14E)-geranylfarnesyl diphosphate|2-trans,6-trans,10-trans,14-trans-geranylfarnesyl diphosphate|all-trans-Pentaprenyl diphosphate|all-trans-farnesylgeranyl diphosphate|all-trans-farnesylgeranyl pyrophosphate|all-trans-geranylfarnesyl diphosphate|all-trans-geranylfarnesyl pyrophosphate|geranylfarnesyl diphosphate (2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-yl trihydrogen diphosphate (2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-yl trihydrogen diphosphate|(2E,6E,10E,14E)-geranylfarnesyl diphosphate|2-trans,6-trans,10-trans,14-trans-geranylfarnesyl diphosphate|all-trans-Pentaprenyl diphosphate|all-trans-farnesylgeranyl diphosphate|all-trans-farnesylgeranyl pyrophosphate|all-trans-geranylfarnesyl diphosphate|all-trans-geranylfarnesyl pyrophosphate|geranylfarnesyl diphosphate http://purl.obolibrary.org/obo/CHEBI_16818 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16820 biolink:ChemicalEntity N-benzoyl-D-arginine A member of the class of N-benzoyl-D-arginines that is D-arginine in which one of the hydrogens of attached to the α-amino group has been replaced by a benzoyl group. kegg.compound:C03001 Graph N(alpha)-benzoyl-D-arginine|N-Benzoyl-D-arginine N(alpha)-benzoyl-D-arginine N(alpha)-benzoyl-D-arginine|N-Benzoyl-D-arginine http://purl.obolibrary.org/obo/CHEBI_16820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16821 biolink:ChemicalEntity 4-oxo-L-proline The L-enantiomer of 4-oxoproline. cas:2002-02-0|kegg.compound:C01877|pdb-ccd:DPL|reaxys:82135 Graph (2S)-4-oxopyrrolidine-2-carboxylic acid|4-Oxo-L-proline|4-ketoproline|4-oxo-L-proline (2S)-4-oxopyrrolidine-2-carboxylic acid|4-oxo-L-proline (2S)-4-oxopyrrolidine-2-carboxylic acid|4-Oxo-L-proline|4-ketoproline|4-oxo-L-proline http://purl.obolibrary.org/obo/CHEBI_16821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16822 biolink:ChemicalEntity choline sulfate An ammonium betaine that is the conjugate base of choline hydrogen sulfate, obtained by deprotonation of the sulfate OH group. cas:4858-96-2|kegg.compound:C00919|knapsack:C00001530|pubmed:13584416|pubmed:13718099|pubmed:16655967|pubmed:17779079|pubmed:7397169|pubmed:871964|reaxys:3905491 Graph 2-(trimethylammonio)ethyl sulfate|Choline sulfate|choline sulfate|choline sulfate betaine 2-(trimethylammonio)ethyl sulfate 2-(trimethylammonio)ethyl sulfate|Choline sulfate|choline sulfate|choline sulfate betaine http://purl.obolibrary.org/obo/CHEBI_16822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16823 biolink:ChemicalEntity kanamycin A 3'-phosphate beilstein:5197199|cas:17029-36-6|kegg.compound:C03281 Graph (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-3-O-phosphono-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside|Kanamycin 3'-phosphate (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-3-O-phosphono-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-3-O-phosphono-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside|Kanamycin 3'-phosphate http://purl.obolibrary.org/obo/CHEBI_16823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16824 biolink:ChemicalEntity D-fuconic acid kegg.compound:C01680 Graph 6-deoxy-D-galactonic acid 6-deoxy-D-galactonic acid 6-deoxy-D-galactonic acid http://purl.obolibrary.org/obo/CHEBI_16824 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16825 biolink:ChemicalEntity (R)-2-methylimino-1-phenylpropan-1-ol kegg.compound:C04351 Graph (1R)-2-(methylimino)-1-phenylpropan-1-ol|(R)-2-Methylimino-1-phenylpropan-1-ol|(R)-2-methylimino-1-phenylpropan-1-ol (1R)-2-(methylimino)-1-phenylpropan-1-ol (1R)-2-(methylimino)-1-phenylpropan-1-ol|(R)-2-Methylimino-1-phenylpropan-1-ol|(R)-2-methylimino-1-phenylpropan-1-ol http://purl.obolibrary.org/obo/CHEBI_16825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16826 biolink:ChemicalEntity acyl monophosphate An organic phosphate ester or anhydride formed by condensation of phosphoric acid with a carboxylic acid. kegg.compound:C02133 Graph Acyl phosphate|acyl monophosphate ester|acyl monophosphate esters|acyl monophosphates|acyl phosphates Acyl phosphate|acyl monophosphate ester|acyl monophosphate esters|acyl monophosphates|acyl phosphates http://purl.obolibrary.org/obo/CHEBI_16826 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168262 biolink:ChemicalEntity Ganoderic acid A cas:81907-62-2|chemspider:413668|chemspider:78443571 Graph (2R,6R)-6-[(5R,7S,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid|(6R)-6-[(5R,7R,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid (2R,6R)-6-[(5R,7S,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid|(6R)-6-[(5R,7R,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid (2R,6R)-6-[(5R,7S,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid|(6R)-6-[(5R,7R,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid http://purl.obolibrary.org/obo/CHEBI_168262 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16827 biolink:ChemicalEntity corticosterone A 21-hydroxy steroid that consists of pregn-4-ene substituted by hydroxy groups at positions 11 and 21 and oxo groups at positions 3 and 20. Corticosterone is a 21-carbon steroid hormone of the corticosteroid type produced in the cortex of the adrenal glands. beilstein:2339601|cas:50-22-6|hmdb:HMDB0001547|kegg.compound:C02140|lincs.smallmolecule:LSM-5814|lipidmaps:LMST02030186|metacyc.compound:CORTICOSTERONE|pdb-ccd:C0R|pubmed:10438974|pubmed:11448093|pubmed:16817814|pubmed:24446162|wikipedia.en:Corticosterone Graph (11beta)-11,21-dihydroxypregn-4-ene-3,20-dione|11beta,21-Dihydroxy-4-pregnene-3,20-dione|11beta,21-dihydroxypregn-4-ene-3,20-dione|11beta,21-dihydroxyprogesterone|17-deoxycortisol|CORTICOSTERONE|Corticosterone|Kendall's compound B|Reichstein's substance H|corticosterone 11beta,21-dihydroxypregn-4-ene-3,20-dione (11beta)-11,21-dihydroxypregn-4-ene-3,20-dione|11beta,21-Dihydroxy-4-pregnene-3,20-dione|11beta,21-dihydroxypregn-4-ene-3,20-dione|11beta,21-dihydroxyprogesterone|17-deoxycortisol|CORTICOSTERONE|Corticosterone|Kendall's compound B|Reichstein's substance H|corticosterone http://purl.obolibrary.org/obo/CHEBI_16827 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16828 biolink:ChemicalEntity L-tryptophan The L-enantiomer of tryptophan. cas:73-22-3|drugbank:DB00150|drugcentral:2780|ecmdb:ECMDB00929|gmelin:51434|hmdb:HMDB0000929|kegg.compound:C00078|kegg.drug:D00020|knapsack:C00001396|metacyc.compound:TRP|pdb-ccd:TRP|pubmed:11395471|pubmed:11750787|pubmed:11888576|pubmed:12766158|pubmed:12830226|pubmed:12871129|pubmed:15206750|pubmed:16740930|pubmed:16934873|pubmed:17127472|pubmed:17177562|pubmed:17430113|pubmed:17585690|pubmed:17690425|pubmed:17826001|pubmed:18234569|pubmed:18419734|pubmed:18949702|pubmed:19896323|pubmed:21856896|pubmed:22071091|pubmed:22162421|pubmed:22299628|pubmed:22386992|pubmed:22402312|pubmed:22415302|pubmed:22415306|pubmed:2917974|reaxys:86197|wikipedia.en:Tryptophan|ymdb:YMDB00126 Graph (2S)-2-amino-3-(1H-indol-3-yl)propanoic acid|(S)-alpha-Amino-beta-(3-indolyl)-propionic acid|(S)-alpha-amino-1H-indole-3-propanoic acid|(S)-tryptophan|L-(-)-tryptophan|L-Tryptophan|L-beta-3-indolylalanine|L-tryptophan|TRYPTOPHAN|Trp|Tryptophan|W|tryptophan L-Tryptophan|L-tryptophan|Tryptophan (2S)-2-amino-3-(1H-indol-3-yl)propanoic acid|(S)-alpha-Amino-beta-(3-indolyl)-propionic acid|(S)-alpha-amino-1H-indole-3-propanoic acid|(S)-tryptophan|L-(-)-tryptophan|L-Tryptophan|L-beta-3-indolylalanine|L-tryptophan|TRYPTOPHAN|Trp|Tryptophan|W|tryptophan http://purl.obolibrary.org/obo/CHEBI_16828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16829 biolink:ChemicalEntity polyneuridine aldehyde foodb.food:FDB031124|kegg.compound:C11632|knapsack:C00051791|metacyc.compound:POLYNEURIDINE-ALDEHYDE|pubmed:20392128|pubmed:29942076 Graph Polyneuridine aldehyde|methyl (15alpha,16R,19E)-17-oxosarpagan-16-carboxylate|polyneuridine aldehyde methyl (15alpha,16R,19E)-17-oxosarpagan-16-carboxylate Polyneuridine aldehyde|methyl (15alpha,16R,19E)-17-oxosarpagan-16-carboxylate|polyneuridine aldehyde http://purl.obolibrary.org/obo/CHEBI_16829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16830 biolink:ChemicalEntity methylamine The simplest of the methylamines, consisting of ammonia bearing a single methyl substituent. cas:74-89-5|drugbank:DB01828|gmelin:145|hmdb:HMDB0000164|kegg.compound:C00218|metacyc.compound:METHYLAMINE|pdb-ccd:NME|pubmed:11580915|pubmed:11991665|pubmed:18312416|reaxys:741851|umbbd.compound:c0137|wikipedia.en:Methylamine Graph CH3-NH2|METHYLAMINE|MMA|MeNH2|Methanamine|Methylamine|aminomethane|methanamine|monomethylamine Methanamine|methanamine CH3-NH2|METHYLAMINE|MMA|MeNH2|Methanamine|Methylamine|aminomethane|methanamine|monomethylamine http://purl.obolibrary.org/obo/CHEBI_16830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16831 biolink:ChemicalEntity 3-hydroxy-3-methylglutaric acid A dicarboxylic acid that is glutaric acid in which one of the two hydrogens at position 3 is substituted by a hydroxy group, while the other is substituted by a methyl group. It has been found to accumulate in urine of patients suffering from HMG-CoA lyase (3-hydroxy-3-methylglutaryl-CoA lyase, EC 4.1.3.4) deficiency. It occurs as a plant metabolite in Crotalaria dura. cas:503-49-1|drugbank:DB04377|drugcentral:1670|hmdb:HMDB0000355|kegg.compound:C03761|kegg.drug:D04897|knapsack:C00001187|metacyc.compound:CPD-547|pdb-ccd:MAH|pubmed:10916782|pubmed:17941049|pubmed:3063529|pubmed:4717513|pubmed:6083597|pubmed:9658458|reaxys:1769194 Graph (S)-3-Hydroxy-3-methylglutaric acid|(S)-Meglutol|3-HYDROXY-3-METHYL-GLUTARIC ACID|3-Hydroxy-3-methylpentanedioic acid|3-hydroxy-3-methylpentanedioic acid|Dicrotalic acid|beta-Hydroxy-beta-methylglutaric acid|beta-hydroxy-beta-methylglutaric acid|meglutol|meglutolum 3-Hydroxy-3-methylpentanedioic acid|3-hydroxy-3-methylpentanedioic acid (S)-3-Hydroxy-3-methylglutaric acid|(S)-Meglutol|3-HYDROXY-3-METHYL-GLUTARIC ACID|3-Hydroxy-3-methylpentanedioic acid|3-hydroxy-3-methylpentanedioic acid|Dicrotalic acid|beta-Hydroxy-beta-methylglutaric acid|beta-hydroxy-beta-methylglutaric acid|meglutol|meglutolum http://purl.obolibrary.org/obo/CHEBI_16831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16832 biolink:ChemicalEntity kievitone A hydroxyisoflavanone that is isoflavanone with hydroxy substituents at positions 5, 7, 2' and 4' and a prenyl group at position 8. agr:IND23253127|agr:IND44293716|cas:40105-60-0|hmdb:HMDB0034213|kegg.compound:C01590|knapsack:C00002541|lipidmaps:LMPK12050479|metacyc.compound:KIEVITONE-CPD|pubmed:16665944|pubmed:21133423|pubmed:7794275 Graph 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one|Kievitone|kievitone 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one|Kievitone|kievitone http://purl.obolibrary.org/obo/CHEBI_16832 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16834 biolink:ChemicalEntity L-gamma-glutamyl-D-alanine beilstein:1728786|kegg.compound:C03738 Graph L-gamma-Glutamyl-D-alanine|L-gamma-glutamyl-D-alanine|gamma-L-Glutamyl-D-alanine L-gamma-glutamyl-D-alanine L-gamma-Glutamyl-D-alanine|L-gamma-glutamyl-D-alanine|gamma-L-Glutamyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_16834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16836 biolink:ChemicalEntity 4-nitrophenol A member of the class of 4-nitrophenols that is phenol in which the hydrogen that is para to the hydroxy group has been replaced by a nitro group. cas:100-02-7|drugbank:DB04417|gmelin:3311|hmdb:HMDB0001232|kegg.compound:C00870|metacyc.compound:P-NITROPHENOL|pdb-ccd:NPO|pubmed:19365648|reaxys:1281877|umbbd.compound:c0086|wikipedia.en:4-Nitrophenol Graph 4-Hydroxynitrobenzene|4-Nitrophenol|4-nitrophenol|Niphen|P-NITROPHENOL|PNP|p-Nitrophenol|p-hydroxynitrobenzene|paranitrophenol 4-Nitrophenol|4-nitrophenol 4-Hydroxynitrobenzene|4-Nitrophenol|4-nitrophenol|Niphen|P-NITROPHENOL|PNP|p-Nitrophenol|p-hydroxynitrobenzene|paranitrophenol http://purl.obolibrary.org/obo/CHEBI_16836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16837 biolink:ChemicalEntity alpha-ribazole 5'-phosphate beilstein:627989|cas:975-91-7|drugbank:DB02030|kegg.compound:C04778|pdb-ccd:RBZ Graph 5,6-Dimethyl-1-alpha-D-ribofuranosylbenzimidazole 5'-phosphate|5,6-dimethyl-1-(5-O-phosphono-alpha-D-ribofuranosyl)-1H-benzimidazole|ALPHA-RIBAZOLE-5'-PHOSPHATE|N(1)-(5-phosphoribosyl)-5,6-dimethylbenzimidazole|N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole|PHOSPHORIC ACID MONO-[5-(5,6-DIMETHYL-BENZOIMIDAZOL-1-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2YLMETHYL] ESTER|alpha-Ribazole 5'-phosphate|alpha-ribazole 5'-phosphate|alpha-ribazole-5'-P 5,6-dimethyl-1-(5-O-phosphono-alpha-D-ribofuranosyl)-1H-benzimidazole 5,6-Dimethyl-1-alpha-D-ribofuranosylbenzimidazole 5'-phosphate|5,6-dimethyl-1-(5-O-phosphono-alpha-D-ribofuranosyl)-1H-benzimidazole|ALPHA-RIBAZOLE-5'-PHOSPHATE|N(1)-(5-phosphoribosyl)-5,6-dimethylbenzimidazole|N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole|PHOSPHORIC ACID MONO-[5-(5,6-DIMETHYL-BENZOIMIDAZOL-1-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2YLMETHYL] ESTER|alpha-Ribazole 5'-phosphate|alpha-ribazole 5'-phosphate|alpha-ribazole-5'-P http://purl.obolibrary.org/obo/CHEBI_16837 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16838 biolink:ChemicalEntity polyphosphate The phosphorus oxoanion formed from polyphosphoric acid by proton loss from each of the phosphate units. The major species at pH 7.3. kegg.compound:C00404|metacyc.compound:Polyphosphates Graph (Phosphate)n|(Phosphate)n+1|(Phosphate)n-1|polyphosphate (Phosphate)n|(Phosphate)n+1|(Phosphate)n-1|polyphosphate http://purl.obolibrary.org/obo/CHEBI_16838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168396 biolink:ChemicalEntity mycophenolic acid A member of the class of 2-benzofurans that is 2-benzofuran-1(3H)-one which is substituted at positions 4, 5, 6, and 7 by methyl, methoxy, (2E)-5-carboxy-3-methylpent-2-en-1-yl, and hydroxy groups, respectively. It is an antibiotic produced by Penicillium brevi-compactum, P. stoloniferum, P. echinulatum and related species. An immunosuppressant, it is widely used (partiularly as its sodium salt and as the 2-(morpholin-4-yl)ethyl ester prodrug, mycophenolate mofetil) to prevent tissue rejection following organ transplants and for the treatment of certain autoimmune diseases. cas:24280-93-1|drugbank:DB01024|drugcentral:1860|kegg.drug:D05096|patent:US4753935|pdb-ccd:MOA|pubmed:11272311|pubmed:15470161|pubmed:16629948|pubmed:16640327|pubmed:17482154|pubmed:17498396|pubmed:18194117|pubmed:18611107|pubmed:18996104|pubmed:19689217|reaxys:318158|wikipedia.en:Mycophenolic_acid Graph (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid|(E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid|Micofenolico acido|Mycophenolate|Mycophenolsaeure|acide mycophenolique|acido micofenolico|acidum mycophenolicum|mycophenolic acid (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid|(E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid|Micofenolico acido|Mycophenolate|Mycophenolsaeure|acide mycophenolique|acido micofenolico|acidum mycophenolicum|mycophenolic acid http://purl.obolibrary.org/obo/CHEBI_168396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16840 biolink:ChemicalEntity 4-CDP-2-C-methyl-D-erythritol 2-phosphate beilstein:8528909|kegg.compound:C11436|knapsack:C00007621|pdb-ccd:SUD Graph 2-Phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol|4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol 2-(dihydrogen phosphate) 4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol 2-(dihydrogen phosphate) 2-Phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol|4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol 2-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16840 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16841 biolink:ChemicalEntity bis(3-aminopropyl)amine beilstein:1071254|cas:56-18-8|foodb.food:FDB028332|gmelin:26839|hmdb:HMDB0011634|kegg.compound:C03375|knapsack:C00053577|pubmed:116684|pubmed:16666576|pubmed:23418450|pubmed:24529384|pubmed:25549879|pubmed:25595767|pubmed:26350146|pubmed:26817804|pubmed:26894404|pubmed:27864804|pubmed:27922663|pubmed:29045455|pubmed:29232652|pubmed:31628357|pubmed:32903416|pubmed:901512|wikipedia.en:Norspermidine Graph 1,7-diamino-4-azaheptane|3,3'-Iminobispropylamine|3,3'-azanediyldi(propanamine)|3,3'-diaminodipropylamine|3,3'-iminobis(propylamine)|3,3'-iminodi(propylamine)|3,3-diaminodipropylamine|4-aza-1,7-diaminoheptane|4-azaheptane-1,7-diamine|Bis(3-aminopropyl)amine|N(1)-(3-aminopropyl)-1,3-propanediamine|N-(3-aminopropyl)-1,3-propandiamine|N-(3-aminopropyl)-1,3-propanediamine|N-(3-aminopropyl)propane-1,3-diamine|N-3-aminopropyl-1,3-diaminopropane|bis(trimethylene)triamine|di(3-aminopropyl)amine|di(trimethylene)triamine|dipropylenetriamine|norspermidine|sym-norspermidine 3,3'-azanediyldi(propanamine) 1,7-diamino-4-azaheptane|3,3'-Iminobispropylamine|3,3'-azanediyldi(propanamine)|3,3'-diaminodipropylamine|3,3'-iminobis(propylamine)|3,3'-iminodi(propylamine)|3,3-diaminodipropylamine|4-aza-1,7-diaminoheptane|4-azaheptane-1,7-diamine|Bis(3-aminopropyl)amine|N(1)-(3-aminopropyl)-1,3-propanediamine|N-(3-aminopropyl)-1,3-propandiamine|N-(3-aminopropyl)-1,3-propanediamine|N-(3-aminopropyl)propane-1,3-diamine|N-3-aminopropyl-1,3-diaminopropane|bis(trimethylene)triamine|di(3-aminopropyl)amine|di(trimethylene)triamine|dipropylenetriamine|norspermidine|sym-norspermidine http://purl.obolibrary.org/obo/CHEBI_16841 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16842 biolink:ChemicalEntity formaldehyde An aldehyde resulting from the formal oxidation of methanol. cas:50-00-0|drugbank:DB03843|drugcentral:3244|gmelin:445|hmdb:HMDB0001426|kegg.compound:C00067|kegg.drug:D00017|metacyc.compound:FORMALDEHYDE|pdb-ccd:FOR|ppdb:359|pubmed:110589|pubmed:12686735|pubmed:15091529|pubmed:16423181|pubmed:17618393|pubmed:18837732|pubmed:25042713|pubmed:7381846|pubmed:7548723|pubmed:7689168|pubmed:7896413|pubmed:9686972|reaxys:1209228|umbbd.compound:c0122|wikipedia.en:Formaldehyde Graph FORMALDEHYDE|FORMALIN|Formaldehyd|Formaldehyde|Formalin|Methanal|Methylene oxide|Oxomethane|Oxomethylene|formaldehyde Formaldehyde|formaldehyde FORMALDEHYDE|FORMALIN|Formaldehyd|Formaldehyde|Formalin|Methanal|Methylene oxide|Oxomethane|Oxomethylene|formaldehyde http://purl.obolibrary.org/obo/CHEBI_16842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16843 biolink:ChemicalEntity cis-1,2-dihydro-3-ethylcatechol cas:66008-19-3|kegg.compound:C06727|umbbd.compound:c0273 Graph Cis-1,2-dihydro-3-ethylcatechol|cis-1,2-Dihydro-3-ethylcatechol|cis-1,2-dihydro-3-ethylcatechol|cis-2,3-Dihydroxy-2,3-dihydroethylbenzene|cis-2,3-dihydroxy-2,3-dihydro-ethylbenzene|cis-2,3-dihydroxy-2,3-dihydroethylbenzene|cis-3-Ethyl-cyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-3-ethylcyclohexa-3,5-diene-1,2-diol rel-(1R,2S)-3-ethylcyclohexa-3,5-diene-1,2-diol Cis-1,2-dihydro-3-ethylcatechol|cis-1,2-Dihydro-3-ethylcatechol|cis-1,2-dihydro-3-ethylcatechol|cis-2,3-Dihydroxy-2,3-dihydroethylbenzene|cis-2,3-dihydroxy-2,3-dihydro-ethylbenzene|cis-2,3-dihydroxy-2,3-dihydroethylbenzene|cis-3-Ethyl-cyclohexa-3,5-diene-1,2-diol|rel-(1R,2S)-3-ethylcyclohexa-3,5-diene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16844 biolink:ChemicalEntity N(3)-acetyl-2-deoxystreptamine antibiotic kegg.compound:C04504 Graph N(3')-acetyl-2-deoxystreptamine antibiotic N(3')-acetyl-2-deoxystreptamine antibiotic http://purl.obolibrary.org/obo/CHEBI_16844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16845 biolink:ChemicalEntity (S)-2,3,4,5-tetrahydrodipicolinate(2-) kegg.compound:C03972 Graph (2S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|(S)-2,3,4,5-Tetrahydropyridine-2,6-dicarboxylate|(S)-2,3,4,5-tetrahydrodipicolinate|(S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|L-2,3,4,5-Tetrahydrodipicolinate (2S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate (2S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|(S)-2,3,4,5-Tetrahydropyridine-2,6-dicarboxylate|(S)-2,3,4,5-tetrahydrodipicolinate|(S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate|L-2,3,4,5-Tetrahydrodipicolinate http://purl.obolibrary.org/obo/CHEBI_16845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16846 biolink:ChemicalEntity UDP-alpha-D-galactosamine A UDP-amino sugar having α-D-galactosamine as the amino-sugar component. kegg.compound:C02467 Graph UDPgalactosamine|uridine 5'-[3-(2-amino-2-deoxygalactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-amino-2-deoxygalactopyranosyl) dihydrogen diphosphate] UDPgalactosamine|uridine 5'-[3-(2-amino-2-deoxygalactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16846 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16848 biolink:ChemicalEntity coenzyme gamma-F420-2 The amide obtained by formal condensation of the carboxylic acid group of F420-0 with the amino group of L-γ-glutamyl-L-glutamic acid. beilstein:878051|cas:64885-97-8|drugbank:DB03913|kegg.compound:C00876|pdb-ccd:F42|pubmed:11888293|pubmed:14593448|pubmed:16585745|pubmed:18252724 Graph COENZYME F420|Coenzyme F420|F420|F420-2|F4202|N-(N-{O-[1-(8-hydroxy-2,4-dioxo-2,3,4,10-tetrahydropyrimido[4,5-b]quinolin-10-yl)-1-deoxy-D-ribityl-5-phospho]-(S)-lactyl}-gamma-L-glutamyl)-L-glutamic acid|N-{N-[O-(7,8-didemethyl-8-hydroxy-5-deazariboflavin phospho)-(S)-lactyl]-gamma-L-glutamyl}-L-glutamate|coenzyme gamma-F420-2|factor F420 N-(N-{O-[1-(8-hydroxy-2,4-dioxo-2,3,4,10-tetrahydropyrimido[4,5-b]quinolin-10-yl)-1-deoxy-D-ribityl-5-phospho]-(S)-lactyl}-gamma-L-glutamyl)-L-glutamic acid COENZYME F420|Coenzyme F420|F420|F420-2|F4202|N-(N-{O-[1-(8-hydroxy-2,4-dioxo-2,3,4,10-tetrahydropyrimido[4,5-b]quinolin-10-yl)-1-deoxy-D-ribityl-5-phospho]-(S)-lactyl}-gamma-L-glutamyl)-L-glutamic acid|N-{N-[O-(7,8-didemethyl-8-hydroxy-5-deazariboflavin phospho)-(S)-lactyl]-gamma-L-glutamyl}-L-glutamate|coenzyme gamma-F420-2|factor F420 http://purl.obolibrary.org/obo/CHEBI_16848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16849 biolink:ChemicalEntity D-fructuronate Graph D-fructuronate D-fructuronate D-fructuronate http://purl.obolibrary.org/obo/CHEBI_16849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16851 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate kegg.compound:C11556 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,5-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,5-bisphosphate|PtsIns(3,5)P2|PtsIns-3,5-P2 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,5-bis(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3,5-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3,5-bisphosphate|PtsIns(3,5)P2|PtsIns-3,5-P2 http://purl.obolibrary.org/obo/CHEBI_16851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16852 biolink:ChemicalEntity L-dopaquinone An L-phenylalanine derivative in which the phenyl group of L-phenylalanine is replaced by a 3,4-dioxocyclohexa-1,5-dien-1-yl group. cas:25520-73-4|hmdb:HMDB0001229|kegg.compound:C00822|metacyc.compound:DOPAQUINONE|reaxys:4182522|wikipedia.en:L-Dopaquinone Graph (S)-2-amino-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)propanoate|3-(3,4-dioxocyclohexa-1,5-dien-1-yl)-L-alanine|DOPAquinone|Dopaquinone|L-dopaquinone 3-(3,4-dioxocyclohexa-1,5-dien-1-yl)-L-alanine (S)-2-amino-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)propanoate|3-(3,4-dioxocyclohexa-1,5-dien-1-yl)-L-alanine|DOPAquinone|Dopaquinone|L-dopaquinone http://purl.obolibrary.org/obo/CHEBI_16852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16853 biolink:ChemicalEntity tetrathionic acid cas:13760-29-7|gmelin:164963|kegg.compound:C02084|umbbd.compound:c0571 Graph 1,6-dihydrido-2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catena|H2S4O6|Tetrathionic acid|Tetrathionsaeure|[(HO)(O)2SSSS(O)2(OH)]|tetrathionic acid 1,6-dihydrido-2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catena|Tetrathionic acid|tetrathionic acid 1,6-dihydrido-2,2,5,5-tetraoxido-1,6-dioxy-2,3,4,5-tetrasulfy-[6]catena|H2S4O6|Tetrathionic acid|Tetrathionsaeure|[(HO)(O)2SSSS(O)2(OH)]|tetrathionic acid http://purl.obolibrary.org/obo/CHEBI_16853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16854 biolink:ChemicalEntity 3-fumarylpyruvate(2-) kegg.compound:C02514|umbbd.compound:c0751 Graph (2E)-4,6-dioxohept-2-enedioate|3-fumarylpyruvate (2E)-4,6-dioxohept-2-enedioate (2E)-4,6-dioxohept-2-enedioate|3-fumarylpyruvate http://purl.obolibrary.org/obo/CHEBI_16854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16855 biolink:ChemicalEntity D-lysine The D-enantiomer of the α-amino acid lysine. cas:923-27-3|drugbank:DB03252|gmelin:1926332|hmdb:HMDB0003405|kegg.compound:C00739|metacyc.compound:CPD-219|pdb-ccd:DLY|pubmed:10571145|pubmed:10930630|pubmed:125972|pubmed:15561717|pubmed:15914930|pubmed:16595662|pubmed:17259313|pubmed:22569959|pubmed:23023754|pubmed:23090865|pubmed:2435906|pubmed:2493343|pubmed:2503300|pubmed:2510957|pubmed:4359655|pubmed:4391118|pubmed:4710063|pubmed:5128165|pubmed:6448848|pubmed:7563967|pubmed:77880|pubmed:8063049|pubmed:8234494|pubmed:8405749|pubmed:9163947|pubmed:9430472|reaxys:1722530 Graph (2R)-2,6-diaminohexanoic acid|(R)-2,6-diaminohexanoic acid|D-2,6-Diaminohexanoic acid|D-LYSINE|D-Lysin|D-Lysine|D-lysine|DLY (2R)-2,6-diaminohexanoic acid|D-LYSINE|D-Lysine|D-lysine (2R)-2,6-diaminohexanoic acid|(R)-2,6-diaminohexanoic acid|D-2,6-Diaminohexanoic acid|D-LYSINE|D-Lysin|D-Lysine|D-lysine|DLY http://purl.obolibrary.org/obo/CHEBI_16855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16856 biolink:ChemicalEntity glutathione A tripeptide compound consisting of glutamic acid attached via its side chain to the N-terminus of cysteinylglycine. cas:70-18-8|chemspider:111188|drugbank:DB00143|drugcentral:1312|foodb.food:FDB001498|hmdb:HMDB0000125|kegg.compound:C00051|kegg.drug:D00014|knapsack:C00001518|metacyc.compound:GLUTATHIONE|pdb-ccd:GSH|pubmed:10577998|pubmed:1362956|pubmed:14988435|pubmed:16112416|pubmed:16316931|pubmed:16391576|pubmed:16404476|pubmed:16621738|pubmed:16650398|pubmed:16780237|pubmed:16877380|pubmed:17439666|pubmed:19580823|pubmed:4200890|pubmed:4745654|pubmed:8207209|reaxys:1729812|wikipedia.en:Glutathione Graph 5-L-Glutamyl-L-cysteinylglycine|GSH|Glutathione|Glutathione-SH|L-gamma-glutamyl-L-cysteinylglycine|N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine|Reduced glutathione|gamma-L-Glutamyl-L-cysteinyl-glycine L-gamma-glutamyl-L-cysteinylglycine 5-L-Glutamyl-L-cysteinylglycine|GSH|Glutathione|Glutathione-SH|L-gamma-glutamyl-L-cysteinylglycine|N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine|Reduced glutathione|gamma-L-Glutamyl-L-cysteinyl-glycine http://purl.obolibrary.org/obo/CHEBI_16856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16857 biolink:ChemicalEntity L-threonine An optically active form of threonine having L-configuration. cas:72-19-5|drugbank:DB00156|drugcentral:4254|ecmdb:ECMDB00167|gmelin:82510|hmdb:HMDB0000167|kegg.compound:C00188|kegg.drug:D00041|knapsack:C00001394|pdb-ccd:THR|pubmed:11964235|pubmed:12523390|pubmed:16659349|pubmed:17379183|pubmed:22289691|pubmed:22342587|pubmed:22513921|pubmed:22770225|pubmed:24671569|reaxys:1721646|umbbd.compound:c0413|wikipedia.en:Threonine|ymdb:YMDB00214 Graph (2S)-threonine|(2S,3R)-(-)-Threonine|(2S,3R)-2-amino-3-hydroxybutanoic acid|2-Amino-3-hydroxybutyric acid|L-(-)-Threonine|L-2-Amino-3-hydroxybutyric acid|L-Threonin|L-Threonine|L-alpha-amino-beta-hydroxybutyric acid|L-threonine|T|THREONINE|Thr L-Threonine|L-threonine (2S)-threonine|(2S,3R)-(-)-Threonine|(2S,3R)-2-amino-3-hydroxybutanoic acid|2-Amino-3-hydroxybutyric acid|L-(-)-Threonine|L-2-Amino-3-hydroxybutyric acid|L-Threonin|L-Threonine|L-alpha-amino-beta-hydroxybutyric acid|L-threonine|T|THREONINE|Thr http://purl.obolibrary.org/obo/CHEBI_16857 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16858 biolink:ChemicalEntity pantetheine 4'-phosphate cas:2226-71-3|drugbank:DB03912|kegg.compound:C01134 Graph 4'-Phosphopantetheine|N(3)-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide|Pantetheine 4'-phosphate|Phosphopantetheine|Psh-4'-P|pantotheine-4'-phosphate N(3)-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide 4'-Phosphopantetheine|N(3)-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide|Pantetheine 4'-phosphate|Phosphopantetheine|Psh-4'-P|pantotheine-4'-phosphate http://purl.obolibrary.org/obo/CHEBI_16858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168585 biolink:ChemicalEntity 2-Propenyl phenylacetate cas:1797-74-6|chemspider:14946|hmdb:HMDB0036905 Graph prop-2-enyl 2-phenylacetate prop-2-enyl 2-phenylacetate prop-2-enyl 2-phenylacetate http://purl.obolibrary.org/obo/CHEBI_168585 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16859 biolink:ChemicalEntity oxaloacetic acid 4-methyl ester A dicarboxylic acid monoester comprising succinic acid having an oxo group at the 2-position and the methyl ester at the 4-position. cas:13192-05-7|kegg.compound:C03716 Graph 4-methoxy-2,4-dioxobutanoic acid|Oxaloacetate 4-methyl ester 4-methoxy-2,4-dioxobutanoic acid 4-methoxy-2,4-dioxobutanoic acid|Oxaloacetate 4-methyl ester http://purl.obolibrary.org/obo/CHEBI_16859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16860 biolink:ChemicalEntity 3',4',5,7-tetrahydroxy-3-methoxyflavone A tetrahydroxyflavone having the 4-hydroxy groups located at the 3'- 4'- 5- and 7-positions as well as a methoxy group at the 2-position. cas:1486-70-0|kegg.compound:C04443|knapsack:C00004632|metacyc.compound:3457-TETRAHYDROXY-3-METHOXYFLAVONE|pubmed:16213685|pubmed:22418930|pubmed:23207251|pubmed:9396391|reaxys:324509 Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H-chromen-4-one|3',4',5,7-Tetrahydroxy-3-methoxyflavone|3-Methoxy-5,7,3',4'-tetrahydroxyflavone|3-O-Methylquercetin|3-methoxy-5,7,3',4'-tetrahydroxyflavone 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-4H-chromen-4-one|3',4',5,7-Tetrahydroxy-3-methoxyflavone|3-Methoxy-5,7,3',4'-tetrahydroxyflavone|3-O-Methylquercetin|3-methoxy-5,7,3',4'-tetrahydroxyflavone http://purl.obolibrary.org/obo/CHEBI_16860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16861 biolink:ChemicalEntity 7''-O-phosphohygromycin B kegg.compound:C03368 Graph (1S,2S,3R,4S,6R)-6-amino-2-[6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranosyloxy]-3-hydroxy-4-(methylamino)cyclohexyl dihydrogen phosphate|7''-O-Phosphohygromycin|7''-O-phosphohygromycin B (1S,2S,3R,4S,6R)-6-amino-2-[6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranosyloxy]-3-hydroxy-4-(methylamino)cyclohexyl dihydrogen phosphate (1S,2S,3R,4S,6R)-6-amino-2-[6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranosyloxy]-3-hydroxy-4-(methylamino)cyclohexyl dihydrogen phosphate|7''-O-Phosphohygromycin|7''-O-phosphohygromycin B http://purl.obolibrary.org/obo/CHEBI_16861 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16862 biolink:ChemicalEntity nucleoside 5'-diphosphate kegg.compound:C00454 Graph NDP|Nucleoside diphosphate|nucleoside diphosphates NDP|Nucleoside diphosphate|nucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_16862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16863 biolink:ChemicalEntity 6-phospho-D-gluconate A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of 6-phospho-D-gluconic acid. reaxys:4517000 Graph 6-O-phosphono-D-gluconate 6-O-phosphono-D-gluconate 6-O-phosphono-D-gluconate http://purl.obolibrary.org/obo/CHEBI_16863 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168630 biolink:ChemicalEntity Chlorin E6 Graph (17S,18S)-18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid (17S,18S)-18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid (17S,18S)-18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_168630 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16864 biolink:ChemicalEntity D-ribofuranosyl-ADP An ADP-aldose having ribose as the aldose fragment. kegg.compound:C01882 Graph ADP-D-ribose|adenosine 5'-[3-(D-ribofuranosyl) dihydrogen diphosphate] adenosine 5'-[3-(D-ribofuranosyl) dihydrogen diphosphate] ADP-D-ribose|adenosine 5'-[3-(D-ribofuranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16865 biolink:ChemicalEntity gamma-aminobutyric acid A γ-amino acid that is butanoic acid with the amino substituent located at C-4. bpdb:2298|cas:56-12-2|drugbank:DB02530|drugcentral:1262|gmelin:49775|hmdb:HMDB0000112|kegg.compound:C00334|kegg.drug:D00058|knapsack:C00001337|lipidmaps:LMFA01100039|metacyc.compound:4-AMINO-BUTYRATE|pdb-ccd:ABU|pubmed:10630630|pubmed:10930630|pubmed:16276116|pubmed:21614609|pubmed:22770225|reaxys:906818|wikipedia.en:Gamma-Aminobutyric_acid Graph 4-Aminobutanoic acid|4-Aminobutyric acid|4-aminobutanoic acid|4-aminobutyric acid|4Abu|GABA|GAMMA-AMINO-BUTANOIC ACID|gamma-Aminobuttersaeure|gamma-Aminobutyric acid|gamma-amino-n-butyric acid|gamma-aminobutanoic acid|gamma-aminobutyric acid|omega-aminobutyric acid|piperidic acid|piperidinic acid 4-Aminobutanoic acid|4-aminobutanoic acid 4-Aminobutanoic acid|4-Aminobutyric acid|4-aminobutanoic acid|4-aminobutyric acid|4Abu|GABA|GAMMA-AMINO-BUTANOIC ACID|gamma-Aminobuttersaeure|gamma-Aminobutyric acid|gamma-amino-n-butyric acid|gamma-aminobutanoic acid|gamma-aminobutyric acid|omega-aminobutyric acid|piperidic acid|piperidinic acid http://purl.obolibrary.org/obo/CHEBI_16865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16866 biolink:ChemicalEntity alizarin A dihydroxyanthraquinone that is anthracene-9,10-dione in which the two hydroxy groups are located at positions 1 and 2. cas:72-48-0|gmelin:34541|kegg.compound:C01474|knapsack:C00002785|lincs.smallmolecule:LSM-25636|metacyc.compound:ALIZARIN|pubmed:14500876|pubmed:1650428|pubmed:16851024|pubmed:23225693|pubmed:25025314|pubmed:25497981|pubmed:25651191|pubmed:26178874|pubmed:26763935|reaxys:1914037|wikipedia.en:Alizarin Graph 1,2-Anthraquinonediol|1,2-Dihydroxyanthraquinone|1,2-dihydroxy-9,10-anthraquinone|1,2-dihydroxyanthra-9,10-quinone|1,2-dihydroxyanthracene-9,10-dione|Alizarin|Alizarin B|Alizarin Red|Az|C.I. 58000|Dihydroxy-9,10-anthracenedione|Dihydroxyanthraquinone|Mordant Red 11|Turkey Red|alizarin|pigment red 83 1,2-dihydroxyanthracene-9,10-dione 1,2-Anthraquinonediol|1,2-Dihydroxyanthraquinone|1,2-dihydroxy-9,10-anthraquinone|1,2-dihydroxyanthra-9,10-quinone|1,2-dihydroxyanthracene-9,10-dione|Alizarin|Alizarin B|Alizarin Red|Az|C.I. 58000|Dihydroxy-9,10-anthracenedione|Dihydroxyanthraquinone|Mordant Red 11|Turkey Red|alizarin|pigment red 83 http://purl.obolibrary.org/obo/CHEBI_16866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16867 biolink:ChemicalEntity D-methionine An optically active form of methionine having D-configuration. cas:348-67-4|drugbank:DB02893|ecmdb:ECMDB21203|gmelin:26934|kegg.compound:C00855|metacyc.compound:CPD-218|pdb-ccd:MED|pubmed:15375647|pubmed:20431016|pubmed:20872028|pubmed:21480759|pubmed:21750343|pubmed:21924333|pubmed:22192214|pubmed:22304623|pubmed:318639|reaxys:1722293|ymdb:YMDB00816 Graph (2R)-2-amino-4-(methylsulfanyl)butanoic acid|(R)-2-amino-4-(methylthio)butanoic acid|(R)-methionine|D-2-Amino-4-(methylthio)butyric acid|D-METHIONINE|D-Methionin|D-Methionine|D-methionine|MED D-METHIONINE|D-Methionine|D-methionine (2R)-2-amino-4-(methylsulfanyl)butanoic acid|(R)-2-amino-4-(methylthio)butanoic acid|(R)-methionine|D-2-Amino-4-(methylthio)butyric acid|D-METHIONINE|D-Methionin|D-Methionine|D-methionine|MED http://purl.obolibrary.org/obo/CHEBI_16867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16869 biolink:ChemicalEntity oleandomycin beilstein:74476|cas:3922-90-5|drugcentral:1983|kegg.compound:C01946|lipidmaps:LMPK04000007|metacyc.compound:OLEANDOMYCIN Graph (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside|Amimycin|Landomycin|Matromycin|Oleandomycin|Romicil (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside|Amimycin|Landomycin|Matromycin|Oleandomycin|Romicil http://purl.obolibrary.org/obo/CHEBI_16869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168693 biolink:ChemicalEntity Melanostatin cas:2002-44-0|chemspider:83871|hmdb:HMDB0005764 Graph (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_168693 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16870 biolink:ChemicalEntity choline alfoscerate A member of the class of phosphocholines that is the choline ester of sn-glycero-3-phosphate. It is one of the major osmolyte in the renal medullary cells. beilstein:6062450|cas:28319-77-9|drugbank:DB04660|drugcentral:627|hmdb:HMDB0000086|kegg.compound:C00670|kegg.drug:D07349|metacyc.compound:L-1-GLYCERO-PHOSPHORYLCHOLINE|pdb-ccd:CH5|pubmed:21165396|pubmed:21195433|pubmed:22191561|pubmed:22677751|pubmed:22679745|pubmed:22959283|pubmed:23013274|pubmed:23244432|pubmed:23268258|pubmed:23314552|pubmed:23387341|pubmed:23528493|pubmed:24156263|pubmed:24166560|pubmed:6420466|reaxys:3908444|wikipedia.en:Alpha-GPC Graph (2R)-2,3-dihydroxypropyl 2-(trimethylammonio)ethyl phosphate|(2R)-2,3-dihydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate|2-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryloxy}-N,N,N-trimethylethanaminium|Choline alphoscerate|Choline glycerophosphate|Cholini glycerophosphas|GPCho|Glicerofosfato de colina|Glycerol phosphorylcholine|Glycerol-3-phosphatidylcholine|Glycerophosphate de choline|Glycerophosphocholine|Glycerophosphorylcholine|L-Choline hydroxide 2,3-dihydroxypropyl hydrogen phosphate inner salt|L-alpha-Glycerophosphocholine|L-alpha-Glycerophosphorylcholine|alfoscerate de choline|alfoscerato de colina|alpha-Glycerophosphorylcholine|choline alfoscerate|cholini alfosceras|glycerol-3-phosphocholine|sn-3-GPC|sn-Glycero-3-phosphocholine|sn-glycero-3-phosphocholine|sn-glycerol 3-phosphocholine (2R)-2,3-dihydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate|2-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryloxy}-N,N,N-trimethylethanaminium (2R)-2,3-dihydroxypropyl 2-(trimethylammonio)ethyl phosphate|(2R)-2,3-dihydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate|2-{[(2R)-2,3-dihydroxypropoxy](hydroxy)phosphoryloxy}-N,N,N-trimethylethanaminium|Choline alphoscerate|Choline glycerophosphate|Cholini glycerophosphas|GPCho|Glicerofosfato de colina|Glycerol phosphorylcholine|Glycerol-3-phosphatidylcholine|Glycerophosphate de choline|Glycerophosphocholine|Glycerophosphorylcholine|L-Choline hydroxide 2,3-dihydroxypropyl hydrogen phosphate inner salt|L-alpha-Glycerophosphocholine|L-alpha-Glycerophosphorylcholine|alfoscerate de choline|alfoscerato de colina|alpha-Glycerophosphorylcholine|choline alfoscerate|cholini alfosceras|glycerol-3-phosphocholine|sn-3-GPC|sn-Glycero-3-phosphocholine|sn-glycero-3-phosphocholine|sn-glycerol 3-phosphocholine http://purl.obolibrary.org/obo/CHEBI_16870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16871 biolink:ChemicalEntity 4-pyridoxolactone beilstein:140752|cas:4753-19-9|kegg.compound:C00971 Graph 4-Pyridoxic acid lactone|4-Pyridoxolactone|4-pyridoxic acid lactone|4-pyridoxolactone|7-hydroxy-6-methylfuro[3,4-c]pyridin-1(3H)-one 7-hydroxy-6-methylfuro[3,4-c]pyridin-1(3H)-one 4-Pyridoxic acid lactone|4-Pyridoxolactone|4-pyridoxic acid lactone|4-pyridoxolactone|7-hydroxy-6-methylfuro[3,4-c]pyridin-1(3H)-one http://purl.obolibrary.org/obo/CHEBI_16871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16872 biolink:ChemicalEntity N-malonylanthranilate kegg.compound:C03147 Graph 2-[(carboxylatoacetyl)amino]benzoate|N-Malonylanthranilate|N-malonylanthranilate 2-[(carboxylatoacetyl)amino]benzoate 2-[(carboxylatoacetyl)amino]benzoate|N-Malonylanthranilate|N-malonylanthranilate http://purl.obolibrary.org/obo/CHEBI_16872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:168721 biolink:ChemicalEntity Ethylene brassylate cas:105-95-3|chemspider:54974|hmdb:HMDB0040459 Graph 1,4-dioxacycloheptadecane-5,17-dione 1,4-dioxacycloheptadecane-5,17-dione 1,4-dioxacycloheptadecane-5,17-dione http://purl.obolibrary.org/obo/CHEBI_168721 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16874 biolink:ChemicalEntity psychosine A glycosylsphingoid consisting of sphingosine having a β-D-galactosyl residue attached at the 1-position. cas:2238-90-6|hmdb:HMDB0000648|kegg.compound:C01747|lipidmaps:LMSP07000001|metacyc.compound:PSYCHOSINE|pubmed:20209561|pubmed:21259322|pubmed:29351991|pubmed:7542630|reaxys:52571|wikipedia.en:Psychosine Graph (2S,3R,4E)-2-amino-1-(beta-D-galactopyranosyloxy)-3-hydroxyoctadec-4-ene|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside|1-O-beta-D-galactopyranosylsphingosine|1-O-beta-D-galactosylsphingosine|1-beta-D-galactosphingosine|1-beta-D-galactosylsphingosine|Galactosylsphingosine|O-Galactosylsphingosine|O-galactosylsphingosine|Psychosine|beta-psychosine|sphingosine galactoside (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside (2S,3R,4E)-2-amino-1-(beta-D-galactopyranosyloxy)-3-hydroxyoctadec-4-ene|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside|1-O-beta-D-galactopyranosylsphingosine|1-O-beta-D-galactosylsphingosine|1-beta-D-galactosphingosine|1-beta-D-galactosylsphingosine|Galactosylsphingosine|O-Galactosylsphingosine|O-galactosylsphingosine|Psychosine|beta-psychosine|sphingosine galactoside http://purl.obolibrary.org/obo/CHEBI_16874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16875 biolink:ChemicalEntity 5,6-dihydroxyindole-2-carboxylate Graph 5,6-dihydroxy-1H-indole-2-carboxylate|5,6-dihydroxyindole-2-carboxylate 5,6-dihydroxy-1H-indole-2-carboxylate 5,6-dihydroxy-1H-indole-2-carboxylate|5,6-dihydroxyindole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_16875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16877 biolink:ChemicalEntity oxidized Watasenia luciferin A member of the class of pyrazines in which the pyrazine ring is substituted at positions 2, 3, and 5 by [4-(sulfooxy)phenyl]acetamido, benzyl, and 4-(sulfooxy)phenyl groups, respectively. kegg.compound:C03888|metacyc.compound:OXIDIZED-WATASEMIA-LUCIFERIN|reaxys:773217 Graph 4-(6-benzyl-5-{[4-(sulfooxy)phenyl]acetamido}pyrazin-2-yl)phenyl hydrogen sulfate|Oxidized Watasenia luciferin 4-(6-benzyl-5-{[4-(sulfooxy)phenyl]acetamido}pyrazin-2-yl)phenyl hydrogen sulfate 4-(6-benzyl-5-{[4-(sulfooxy)phenyl]acetamido}pyrazin-2-yl)phenyl hydrogen sulfate|Oxidized Watasenia luciferin http://purl.obolibrary.org/obo/CHEBI_16877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16878 biolink:ChemicalEntity N-acetyl-L-gamma-glutamyl phosphate kegg.compound:C04133|pdb-ccd:X2W Graph (2S)-2-acetamido-5-oxo-5-(phosphonooxy)pentanoic acid|N-Acetyl-L-glutamate 5-phosphate|N-Acetyl-L-glutamyl 5-phosphate|N-acetyl-5-glutamyl phosphate|N-acetyl-5-oxo-5-(phosphonooxy)-L-norvaline|N-acetyl-L-glutamate 5-phosphate|N-acetyl-L-glutamyl 5-phosphate (2S)-2-acetamido-5-oxo-5-(phosphonooxy)pentanoic acid (2S)-2-acetamido-5-oxo-5-(phosphonooxy)pentanoic acid|N-Acetyl-L-glutamate 5-phosphate|N-Acetyl-L-glutamyl 5-phosphate|N-acetyl-5-glutamyl phosphate|N-acetyl-5-oxo-5-(phosphonooxy)-L-norvaline|N-acetyl-L-glutamate 5-phosphate|N-acetyl-L-glutamyl 5-phosphate http://purl.obolibrary.org/obo/CHEBI_16878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16879 biolink:ChemicalEntity diethyl 2-methyl-3-oxosuccinate cas:759-65-9|kegg.compound:C04067 Graph Diethyl 2-methyl-3-oxosuccinate|Diethyl 2-methyloxosuccinate|Diethyl 3-methyl-2-oxosuccinate|Diethyl methyloxobutanedioate|Diethyl oxalpropionate|Ethyl alpha-ethoxalylpropionate|diethyl 2-methyl-3-oxobutanedioate|diethyl 2-methyl-3-oxosuccinate diethyl 2-methyl-3-oxobutanedioate Diethyl 2-methyl-3-oxosuccinate|Diethyl 2-methyloxosuccinate|Diethyl 3-methyl-2-oxosuccinate|Diethyl methyloxobutanedioate|Diethyl oxalpropionate|Ethyl alpha-ethoxalylpropionate|diethyl 2-methyl-3-oxobutanedioate|diethyl 2-methyl-3-oxosuccinate http://purl.obolibrary.org/obo/CHEBI_16879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16880 biolink:ChemicalEntity L-ribulose cas:2042-27-5|kegg.compound:C00508|knapsack:C00019634 Graph L-Arabinoketose|L-Arabinulose|L-Riboketose|L-Ribulose|L-Rul|L-erythro-Pentulose|L-erythro-pent-2-ulose|L-ribulose L-Ribulose|L-erythro-pent-2-ulose|L-ribulose L-Arabinoketose|L-Arabinulose|L-Riboketose|L-Ribulose|L-Rul|L-erythro-Pentulose|L-erythro-pent-2-ulose|L-ribulose http://purl.obolibrary.org/obo/CHEBI_16880 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16881 biolink:ChemicalEntity 1H-indole beilstein:107693|cas:120-72-9|drugbank:DB04532|gmelin:3477|kegg.compound:C00463|knapsack:C00001418|pdb-ccd:IND Graph 1H-indole|2,3-Benzopyrrole|INDOLE|Indol|Indole|indole 1H-indole|INDOLE|Indole 1H-indole|2,3-Benzopyrrole|INDOLE|Indol|Indole|indole http://purl.obolibrary.org/obo/CHEBI_16881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16885 biolink:ChemicalEntity 1-kestose A trisaccharide found in vegetables consisting of β-D-fructofuranose having β-D-fructofuranosyl and α-D-glucopyranosyl residues attached at the 1- and 2-positions respectively. cas:470-69-9|hmdb:HMDB0011729|kegg.compound:C03661|kegg.glycan:G02515|metacyc.compound:1-KESTOTRIOSE|pdb-ccd:DQR|pubmed:1663421|reaxys:63973 Graph 1(F)-beta-D-fructosylsucrose|1-kestotriose|1F-beta-D-Fructosylsucrose|O-beta-D-fructofuranosyl-(2->1)-O-beta-D-fructofuranosyl-(2->1)-alpha-D-glucopyranoside|[beta-D-Fru-(2->1)]2-alpha-D-Glup|beta-D-Fru-(2->1)-beta-D-Fru-(2->1)-alpha-D-Glup|beta-D-Fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside|beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside 1(F)-beta-D-fructosylsucrose|1-kestotriose|1F-beta-D-Fructosylsucrose|O-beta-D-fructofuranosyl-(2->1)-O-beta-D-fructofuranosyl-(2->1)-alpha-D-glucopyranoside|[beta-D-Fru-(2->1)]2-alpha-D-Glup|beta-D-Fru-(2->1)-beta-D-Fru-(2->1)-alpha-D-Glup|beta-D-Fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside|beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_16885 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16886 biolink:ChemicalEntity 2-aminomuconic acid The 2-amino derivative of muconic acid. cas:4548-99-6|chemspider:27|foodb.food:FDB022507|kegg.compound:C02220|knapsack:C00007493|pubmed:14275130|pubmed:35732192 Graph 2-Aminomuconic acid|2-amino-2,4-hexadienedioic acid|2-aminohexa-2,4-dienedioic acid|alpha-aminomuconic acid 2-aminohexa-2,4-dienedioic acid 2-Aminomuconic acid|2-amino-2,4-hexadienedioic acid|2-aminohexa-2,4-dienedioic acid|alpha-aminomuconic acid http://purl.obolibrary.org/obo/CHEBI_16886 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16887 biolink:ChemicalEntity 5-(4-hydroxybut-1-ynyl)-2,2'-bithiophene beilstein:1285354|cas:1137-87-7|kegg.compound:C04486 Graph 4-(2,2'-bithien-5-yl)but-3-yn-1-ol|4-(5-(2-Thienyl)-2-thienyl)-3-butyn-1-ol|5-(4-Hydroxy-but-1-ynyl)-2,2'-bithiophene|5-(4-hydroxy-but-1-ynyl)-2,2'-bithiophene 4-(2,2'-bithien-5-yl)but-3-yn-1-ol 4-(2,2'-bithien-5-yl)but-3-yn-1-ol|4-(5-(2-Thienyl)-2-thienyl)-3-butyn-1-ol|5-(4-Hydroxy-but-1-ynyl)-2,2'-bithiophene|5-(4-hydroxy-but-1-ynyl)-2,2'-bithiophene http://purl.obolibrary.org/obo/CHEBI_16887 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16889 biolink:ChemicalEntity trans-3-hydroxy-L-proline The (3S)-trans-diastereomer of 3-hydroxy-L-proline. hmdb:HMDB0059659|kegg.compound:C05147|metacyc.compound:CPD-664|pdb-ccd:HY3|pubmed:22770225|reaxys:471959 Graph (2S,3S)-3-hydroxypyrrolidine-2-carboxylic acid|(3S)-3-hydroxy-L-proline|3-trans-hydroxy-L-proline|L-threo-3-hydroxyproline|trans-3-hydroxy-L-proline|trans-L-3-Hydroxyproline|trans-L-3-hydroxyproline (3S)-3-hydroxy-L-proline (2S,3S)-3-hydroxypyrrolidine-2-carboxylic acid|(3S)-3-hydroxy-L-proline|3-trans-hydroxy-L-proline|L-threo-3-hydroxyproline|trans-3-hydroxy-L-proline|trans-L-3-Hydroxyproline|trans-L-3-hydroxyproline http://purl.obolibrary.org/obo/CHEBI_16889 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16890 biolink:ChemicalEntity glycerol monophosphate cas:27082-31-1|kegg.compound:C03189 Graph glycerol dihydrogen phosphate|glycerophosphoric acid|sn-Glyceryl phosphate glycerol dihydrogen phosphate glycerol dihydrogen phosphate|glycerophosphoric acid|sn-Glyceryl phosphate http://purl.obolibrary.org/obo/CHEBI_16890 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16891 biolink:ChemicalEntity glyoxylic acid A 2-oxo monocarboxylic acid that is acetic acid bearing an oxo group at the α carbon atom. cas:298-12-4|drugbank:DB04343|gmelin:25752|hmdb:HMDB0000119|kegg.compound:C00048|knapsack:C00001186|metacyc.compound:GLYOX|pdb-ccd:GLV|pubmed:11479160|pubmed:16396466|pubmed:22580421|pubmed:23790896|reaxys:741891|wikipedia.en:Glyoxylic_acid Graph GLYOXYLIC ACID|Glyoxalate|Glyoxalsaeure|Glyoxylate|Glyoxylic acid|Glyoxylsaeure|alpha-ketoacetic acid|formylformic acid|oxalaldehydic acid|oxoacetic acid|oxoethanoic acid oxoacetic acid GLYOXYLIC ACID|Glyoxalate|Glyoxalsaeure|Glyoxylate|Glyoxylic acid|Glyoxylsaeure|alpha-ketoacetic acid|formylformic acid|oxalaldehydic acid|oxoacetic acid|oxoethanoic acid http://purl.obolibrary.org/obo/CHEBI_16891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16892 biolink:ChemicalEntity 4-amino-5-hydroxymethyl-2-methylpyrimidine An aminopyrimidine that is pyrimidine in which the hydrogens at positions 2, 4, and 5 are replaced by methyl, amino, and hydroxymethyl substituents, respectively. cas:73-67-6|drugbank:DB02022|kegg.compound:C01279|knapsack:C00007494|metacyc.compound:HMP|pdb-ccd:HMH|pubmed:16497163|reaxys:126858 Graph (4-amino-2-methylpyrimidin-5-yl)methanol|2-methyl-4-amino-5-hydroxymethylpyrimidine|4-Amino-2-methyl-5-pyrimidinemethanol|4-Amino-5-hydroxymethyl-2-methylpyrimidine|4-amino-2-methyl-5-hydroxymethylpyrimidine|4-amino-2-methyl-5-pyrimidinemethanol|4-amino-5-hydroxymethyl-2-methylpyrimidine|Atoxopyrimidine|Pyramin|Pyramine|Toxopyrimidine (4-amino-2-methylpyrimidin-5-yl)methanol (4-amino-2-methylpyrimidin-5-yl)methanol|2-methyl-4-amino-5-hydroxymethylpyrimidine|4-Amino-2-methyl-5-pyrimidinemethanol|4-Amino-5-hydroxymethyl-2-methylpyrimidine|4-amino-2-methyl-5-hydroxymethylpyrimidine|4-amino-2-methyl-5-pyrimidinemethanol|4-amino-5-hydroxymethyl-2-methylpyrimidine|Atoxopyrimidine|Pyramin|Pyramine|Toxopyrimidine http://purl.obolibrary.org/obo/CHEBI_16892 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16893 biolink:ChemicalEntity sphinganine 1-phosphate A sphingoid 1-phosphate that is the monophosphorylated derivative of sphinganine. cas:19794-97-9|foodb.food:FDB022594|hmdb:HMDB0001383|kegg.compound:C01120|knapsack:C00007541|lipidmaps:LMSP01050002|pubmed:16278291|pubmed:16529909|pubmed:17060094|pubmed:18482992|pubmed:19119142|pubmed:20309867|pubmed:22016110|pubmed:23373542|pubmed:2754341|pubmed:27585475|pubmed:30557628|pubmed:32278008|pubmed:33535437|pubmed:7897327|pubmed:8192648|pubmed:9353337|reaxys:6780476 Graph (2S,3R)-2-amino-3-hydroxyoctadecyl dihydrogen phosphate|DHS-1P|DHS1P|Dihydrosphingosine 1-phosphate|Sphinganine 1-phosphate|dihydrosphingosine-1-phosphate|sphinganine 1-(dihydrogen phosphate) sphinganine 1-(dihydrogen phosphate) (2S,3R)-2-amino-3-hydroxyoctadecyl dihydrogen phosphate|DHS-1P|DHS1P|Dihydrosphingosine 1-phosphate|Sphinganine 1-phosphate|dihydrosphingosine-1-phosphate|sphinganine 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_16893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16894 biolink:ChemicalEntity 3-sulfopyruvic acid A carboxyalkanesulfonic acid comprising pyruvic acid with a sulfo group attached at the C-3 position. beilstein:1775450|cas:98022-26-5|drugbank:DB02156|kegg.compound:C05528|knapsack:C00000764|pdb-ccd:SPV Graph 2-carboxy-2-oxoethanesulfonic acid|2-oxo-3-sulfopropanoic acid|3-Sulfopyruvate|3-Sulfopyruvic acid|SULFOPYRUVATE|beta-sulfopyruvic acid 2-oxo-3-sulfopropanoic acid 2-carboxy-2-oxoethanesulfonic acid|2-oxo-3-sulfopropanoic acid|3-Sulfopyruvate|3-Sulfopyruvic acid|SULFOPYRUVATE|beta-sulfopyruvic acid http://purl.obolibrary.org/obo/CHEBI_16894 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16897 biolink:ChemicalEntity D-erythrose 4-phosphate(2-) beilstein:9129751 Graph (2R,3R)-2,3-dihydroxy-4-oxobutyl phosphate|4-O-phosphonato-D-erythrose|D-erythrose 4-phosphate (2R,3R)-2,3-dihydroxy-4-oxobutyl phosphate|D-erythrose 4-phosphate (2R,3R)-2,3-dihydroxy-4-oxobutyl phosphate|4-O-phosphonato-D-erythrose|D-erythrose 4-phosphate http://purl.obolibrary.org/obo/CHEBI_16897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16899 biolink:ChemicalEntity D-mannitol The D-enantiomer of mannitol. cas:69-65-8|drugbank:DB00742|drugcentral:935|gmelin:83161|hmdb:HMDB0000765|kegg.compound:C00392|kegg.drug:D00062|knapsack:C00001165|metacyc.compound:MANNITOL|pdb-ccd:MTL|pubmed:11784135|pubmed:12646037|pubmed:15658873|pubmed:15863337|pubmed:16854081|pubmed:16901854|pubmed:17336832|pubmed:17420133|pubmed:17827020|pubmed:17973471|pubmed:17979222|pubmed:17983214|pubmed:18207412|pubmed:18220330|pubmed:22770225|pubmed:24643482|pubmed:25108762|reaxys:1721898|wikipedia.en:Mannitol Graph (2R,3R,4R,5R)-Hexane-1,2,3,4,5,6-hexaol|(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexaol|(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol|D-(-)-Mannitol|D-Mannitol|D-mannitol|E 421|E-421|E421|Mannitol|Osmitrol|dulcite|manna sugar|mannite|mannitol D-Mannitol|D-mannitol|Mannitol|mannitol (2R,3R,4R,5R)-Hexane-1,2,3,4,5,6-hexaol|(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexaol|(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol|D-(-)-Mannitol|D-Mannitol|D-mannitol|E 421|E-421|E421|Mannitol|Osmitrol|dulcite|manna sugar|mannite|mannitol http://purl.obolibrary.org/obo/CHEBI_16899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16900 biolink:ChemicalEntity chlorophyllide a beilstein:5801116|cas:14897-06-4|kegg.compound:C02139|knapsack:C00007316 Graph Chlorophyllid a|Chlorophyllide a Chlorophyllid a|Chlorophyllide a http://purl.obolibrary.org/obo/CHEBI_16900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16905 biolink:ChemicalEntity keto-D-fructose 1,6-bisphosphate A ketohexose bisphosphate that is D-fructose substituted by phosphate groups at positions 1 and 6. cas:488-69-7|chemspider:76632|drugbank:DB13863|hmdb:HMDB0001058|kegg.compound:C00354|knapsack:C00007386|metacyc.compound:FRUCTOSE-16-DIPHOSPHATE|pdb-ccd:P6F|pubmed:13150027|pubmed:16233003|pubmed:19049602|pubmed:19236002|pubmed:21983965|pubmed:25206915|pubmed:26011931|pubmed:28972169|pubmed:29593097|pubmed:4610358|reaxys:1729954 Graph 1,6-di-O-phosphono-D-fructose|D-Fructose 1,6-bisphosphate|D-fructose 1,6-bis(dihydrogen phosphate)|D-fructose-1,6-diphosphate|Harden-Young ester|fructose-1,6-diphosphate D-fructose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-D-fructose|D-Fructose 1,6-bisphosphate|D-fructose 1,6-bis(dihydrogen phosphate)|D-fructose-1,6-diphosphate|Harden-Young ester|fructose-1,6-diphosphate http://purl.obolibrary.org/obo/CHEBI_16905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16907 biolink:ChemicalEntity 4-nitroquinoline N-oxide A quinoline N-oxide carrying a nitro substituent at position 4. cas:56-57-5|kegg.compound:C03474|pubmed:16448841|pubmed:24105297|reaxys:165756|wikipedia.en:4-Nitroquinoline_1-oxide Graph 4-Nitroquinoline 1-oxide|4-Nitroquinoline N-oxide|4-Nitroquinoline-1-oxide|4-Nitroquinoline-N-oxide|4-nitroquinoline 1-oxide|4-nitroquinoline N-oxide|Nitrochin 4-Nitroquinoline 1-oxide|4-nitroquinoline 1-oxide 4-Nitroquinoline 1-oxide|4-Nitroquinoline N-oxide|4-Nitroquinoline-1-oxide|4-Nitroquinoline-N-oxide|4-nitroquinoline 1-oxide|4-nitroquinoline N-oxide|Nitrochin http://purl.obolibrary.org/obo/CHEBI_16907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16908 biolink:ChemicalEntity NADH A coenzyme found in all living cells; consists of two nucleotides joined through their 5'-phosphate groups, with one nucleotide containing an adenine base and the other containing nicotinamide. beilstein:79324|cas:58-68-4|drugbank:DB00157|gmelin:544241|hmdb:HMDB0001487|kegg.compound:C00004|knapsack:C00019343|pdb-ccd:NAI|pubmed:11259315|pubmed:19459318|reaxys:79324|wikipedia.en:Nicotinamide_adenine_dinucleotide Graph 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE|DPNH|NADH|Reduced nicotinamide adenine dinucleotide|adenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|nicotinamide adenine dinucleotide (reduced) adenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate} 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE|DPNH|NADH|Reduced nicotinamide adenine dinucleotide|adenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|nicotinamide adenine dinucleotide (reduced) http://purl.obolibrary.org/obo/CHEBI_16908 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16910 biolink:ChemicalEntity mandelonitrile A cyanohydrin that is phenylacetonitrile in which one of the methylene hydrogens is replaced by a hydroxy group. cas:532-28-5|gmelin:1684586|hmdb:HMDB0034666|metacyc.compound:MANDELONITRILE|pubmed:25248440|pubmed:25652193|pubmed:26014754|pubmed:26564406|pubmed:26577409|reaxys:2207122|wikipedia.en:Mandelonitrile Graph Benzaldehyde cyanohydrin|Mandelonitrile|alpha-hydroxybenzeneacetonitrile|hydroxy(phenyl)acetonitrile|mandelic acid nitrile|mandelonitrile|phenylglycolonitrile hydroxy(phenyl)acetonitrile Benzaldehyde cyanohydrin|Mandelonitrile|alpha-hydroxybenzeneacetonitrile|hydroxy(phenyl)acetonitrile|mandelic acid nitrile|mandelonitrile|phenylglycolonitrile http://purl.obolibrary.org/obo/CHEBI_16910 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16912 biolink:ChemicalEntity trans-1,2-dithiane-4,5-diol beilstein:4125743|cas:14193-38-5|cas:51621-02-4|kegg.compound:C01119 Graph Oxidized dithiothreitol|rel-(4R,5R)-1,2-dithiane-4,5-diol|trans-1,2-dithiane-4,5-diol|trans-4,5-dihydroxy-1,2-dithiane rel-(4R,5R)-1,2-dithiane-4,5-diol Oxidized dithiothreitol|rel-(4R,5R)-1,2-dithiane-4,5-diol|trans-1,2-dithiane-4,5-diol|trans-4,5-dihydroxy-1,2-dithiane http://purl.obolibrary.org/obo/CHEBI_16912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16913 biolink:ChemicalEntity N-methylphenylethanolamine An alkaloid that is ethanolamine having the phenyl group at the 1-position and a methyl group attached to the nitrogen. It has been isolated from Halostachys caspica. cas:68579-60-2|hmdb:HMDB0001387|kegg.compound:C03711|lincs.smallmolecule:LSM-36938|metacyc.compound:N-METHYLPHENYLETHANOLAMINE|pubmed:6435178|pubmed:6775642|pubmed:7229979|reaxys:1072841|wikipedia.en:Halostachine Graph (+-)-Halostachine|(+-)-alpha-((Methylamino)methyl)benzenemethanol|2-(methylamino)-1-phenylethanol|Benzyl alcohol, alpha-((methylamino)methyl)-, dl-|N-Methylphenylethanolamine 2-(methylamino)-1-phenylethanol (+-)-Halostachine|(+-)-alpha-((Methylamino)methyl)benzenemethanol|2-(methylamino)-1-phenylethanol|Benzyl alcohol, alpha-((methylamino)methyl)-, dl-|N-Methylphenylethanolamine http://purl.obolibrary.org/obo/CHEBI_16913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16914 biolink:ChemicalEntity salicylic acid A monohydroxybenzoic acid that is benzoic acid with a hydroxy group at the ortho position. It is obtained from the bark of the white willow and wintergreen leaves. cas:69-72-7|drugbank:DB00936|drugcentral:2416|gmelin:3418|hmdb:HMDB0001895|kegg.compound:C00805|kegg.drug:D00097|knapsack:C00000206|lincs.smallmolecule:LSM-4763|metacyc.compound:CPD-110|pdb-ccd:SAL|pubmed:11016405|pubmed:12865403|pubmed:1650428|pubmed:19400653|pubmed:19816125|pubmed:22770225|pubmed:29079364|pubmed:32807953|pubmed:3425858|reaxys:774890|wikipedia.en:Salicylic_Acid Graph 2-HYDROXYBENZOIC ACID|2-carboxyphenol|2-hydroxybenzoic acid|Salicylic acid|o-Hydroxybenzoic acid|o-carboxyphenol|o-hydroxybenzoic acid 2-HYDROXYBENZOIC ACID|2-hydroxybenzoic acid 2-HYDROXYBENZOIC ACID|2-carboxyphenol|2-hydroxybenzoic acid|Salicylic acid|o-Hydroxybenzoic acid|o-carboxyphenol|o-hydroxybenzoic acid http://purl.obolibrary.org/obo/CHEBI_16914 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16916 biolink:ChemicalEntity oligosaccharide phosphate An oligosaccharide derivative in which at least one hydroxy group has been phosphorylated. Graph oligosaccharide phosphates oligosaccharide phosphates http://purl.obolibrary.org/obo/CHEBI_16916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16918 biolink:ChemicalEntity gallate A trihydroxybenzoate that is the conjugate base of gallic acid. gmelin:328003|kegg.compound:C01424|metacyc.compound:CPD-183|reaxys:3907457|umbbd.compound:c0006 Graph 3,4,5-trihydroxybenzoate 3,4,5-trihydroxybenzoate 3,4,5-trihydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_16918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16919 biolink:ChemicalEntity creatine A glycine derivative having methyl and amidino groups attached to the nitrogen. cas:57-00-1|chemspider:566|drugbank:DB00148|drugcentral:4661|gmelin:240513|hmdb:HMDB0000064|kegg.compound:C00300|metacyc.compound:CREATINE|pdb-ccd:CRN|pubmed:11356982|pubmed:11483809|pubmed:11867929|pubmed:12085493|pubmed:12184144|pubmed:12878267|pubmed:16445883|pubmed:17190852|pubmed:17253521|pubmed:17416441|pubmed:18555535|pubmed:19082141|pubmed:19651674|pubmed:19741514|pubmed:19968328|pubmed:21556832|pubmed:21660517|pubmed:21698493|pubmed:22038587|pubmed:22101931|pubmed:22196490|pubmed:22252611|pubmed:22347384|pubmed:22386973|pubmed:22422801|pubmed:22429992|pubmed:22465051|pubmed:22521466|pubmed:7752905|reaxys:907175|wikipedia.en:Creatine Graph ((amino(imino)methyl)(methyl)amino)acetic acid|(N-methylcarbamimidamido)acetic acid|(alpha-methylguanido)acetic acid|Creatin|Creatine|Kreatin|Methylglycocyamine|N-(aminoiminomethyl)-N-methylglycine|N-Methyl-N-guanylglycine|N-[(E)-AMINO(IMINO)METHYL]-N-METHYLGLYCINE|N-[amino(imino)methyl]-N-methylglycine|N-amidinosarcosine|N-carbamimidoyl-N-methylglycine|N-methyl-N-guanylglycine|alpha-Methylguanidino acetic acid N-[amino(imino)methyl]-N-methylglycine ((amino(imino)methyl)(methyl)amino)acetic acid|(N-methylcarbamimidamido)acetic acid|(alpha-methylguanido)acetic acid|Creatin|Creatine|Kreatin|Methylglycocyamine|N-(aminoiminomethyl)-N-methylglycine|N-Methyl-N-guanylglycine|N-[(E)-AMINO(IMINO)METHYL]-N-METHYLGLYCINE|N-[amino(imino)methyl]-N-methylglycine|N-amidinosarcosine|N-carbamimidoyl-N-methylglycine|N-methyl-N-guanylglycine|alpha-Methylguanidino acetic acid http://purl.obolibrary.org/obo/CHEBI_16919 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16923 biolink:ChemicalEntity N-formyl-L-aspartate(2-) A doubly-charged N-acyl-L-α-amino acid anion resulting from deprotonation of both carboxy groups of N-formyl-L-aspartic acid. pubmed:3308850|pubmed:5823108 Graph (2S)-2-(formylamino)butanedioate|N-formyl-L-aspartate (2S)-2-(formylamino)butanedioate|N-formyl-L-aspartate (2S)-2-(formylamino)butanedioate|N-formyl-L-aspartate http://purl.obolibrary.org/obo/CHEBI_16923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16924 biolink:ChemicalEntity 5-oxo-D-proline The D-enantiomer of 5-oxoproline. cas:4042-36-8|drugbank:DB03088|gmelin:1473408|hmdb:HMDB0000267|kegg.compound:C02237|metacyc.compound:CPD-656|pubmed:22770225|reaxys:82133 Graph (2R)-5-oxopyrrolidine-2-carboxylic acid|5-Oxo-D-proline|5-oxo-D-proline|D-5-Pyrrolidone-2-carboxylic acid|D-Pyroglutamic acid (2R)-5-oxopyrrolidine-2-carboxylic acid|5-Oxo-D-proline|5-oxo-D-proline (2R)-5-oxopyrrolidine-2-carboxylic acid|5-Oxo-D-proline|5-oxo-D-proline|D-5-Pyrrolidone-2-carboxylic acid|D-Pyroglutamic acid http://purl.obolibrary.org/obo/CHEBI_16924 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16925 biolink:ChemicalEntity 6-phospho-5-dehydro-2-deoxy-D-gluconic acid A ketoaldonic acid phosphate comprising 5-dehydro-2-deoxy-D-gluconic acid having the phosphate group at the 6-position. kegg.compound:C06893|pubmed:18310071 Graph 2-deoxy-5-keto-D-gluconic acid 6-phosphate|2-deoxy-6-O-phosphono-D-threo-hex-5-ulosonic acid|DKHP 2-deoxy-6-O-phosphono-D-threo-hex-5-ulosonic acid 2-deoxy-5-keto-D-gluconic acid 6-phosphate|2-deoxy-6-O-phosphono-D-threo-hex-5-ulosonic acid|DKHP http://purl.obolibrary.org/obo/CHEBI_16925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16927 biolink:ChemicalEntity L-saccharopine The N6-(1,3-dicarboxypropan-1-yl) derivative of L-lysine. cas:997-68-2|hmdb:HMDB0000279|kegg.compound:C00449|knapsack:C00007227|metacyc.compound:SACCHAROPINE|pdb-ccd:SHR|pubmed:22449979|pubmed:22862918|reaxys:3063139|wikipedia.en:Saccharopine Graph L-Saccharopine|N-[(5S)-5-amino-5-carboxypentyl]-L-glutamic acid|N-[(S)-5-Amino-5-carboxypentyl]-L-glutamic acid|N6-(L-1,3-Dicarboxypropyl)-L-lysine|Saccharopine|epsilon-N-(L-Glutar-2-yl)-L-lysine N-[(5S)-5-amino-5-carboxypentyl]-L-glutamic acid L-Saccharopine|N-[(5S)-5-amino-5-carboxypentyl]-L-glutamic acid|N-[(S)-5-Amino-5-carboxypentyl]-L-glutamic acid|N6-(L-1,3-Dicarboxypropyl)-L-lysine|Saccharopine|epsilon-N-(L-Glutar-2-yl)-L-lysine http://purl.obolibrary.org/obo/CHEBI_16927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16929 biolink:ChemicalEntity sn-glycero-3-phosphoethanolamine kegg.compound:C01233 Graph 2-aminoethyl (2S)-2,3-dihydroxypropyl hydrogen phosphate|Glycerophosphoethanolamine|sn-glycero-3-Phosphoethanolamine 2-aminoethyl (2S)-2,3-dihydroxypropyl hydrogen phosphate 2-aminoethyl (2S)-2,3-dihydroxypropyl hydrogen phosphate|Glycerophosphoethanolamine|sn-glycero-3-Phosphoethanolamine http://purl.obolibrary.org/obo/CHEBI_16929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16931 biolink:ChemicalEntity trans-cyclohexane-1,2-diol A cyclohexane-1,2-diol with trans-configuration. It is a metabolite of cyclohexene oxide and other such compounds. cas:1460-57-7|kegg.compound:C03739|metacyc.compound:TRANS-CYCLOHEXANE-12-DIOL|pubmed:1687017|pubmed:4655821|pubmed:9300909|reaxys:1901343 Graph rel-(1R,2R)-cyclohexane-1,2-diol|trans-1,2-Cyclohexanediol|trans-1,2-Dihydroxycyclohexane|trans-Cyclohexane-1,2-diol|trans-cyclohexane-1,2-diol rel-(1R,2R)-cyclohexane-1,2-diol rel-(1R,2R)-cyclohexane-1,2-diol|trans-1,2-Cyclohexanediol|trans-1,2-Dihydroxycyclohexane|trans-Cyclohexane-1,2-diol|trans-cyclohexane-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16932 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanine beilstein:8249201 Graph uridine 5'-(3-{2-acetylamino-3-O-[2-(L-alaninocarboxy)ethyl]-2-deoxy-D-glucopyranosyl}dihydrogen diphosphate) uridine 5'-(3-{2-acetylamino-3-O-[2-(L-alaninocarboxy)ethyl]-2-deoxy-D-glucopyranosyl}dihydrogen diphosphate) uridine 5'-(3-{2-acetylamino-3-O-[2-(L-alaninocarboxy)ethyl]-2-deoxy-D-glucopyranosyl}dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_16932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16933 biolink:ChemicalEntity ergosterol A phytosterol consisting of ergostane having double bonds at the 5,6-, 7,8- and 22,23-positions as well as a 3β-hydroxy group. beilstein:2338604|cas:57-87-4|drugbank:DB04038|kegg.compound:C01694|knapsack:C00003652|knapsack:C00023755|lipidmaps:LMST01030093|pdb-ccd:ERG|reaxys:2338604 Graph (22E)-ergosta-5,7,22-trien-3beta-ol|(22E,24S)-24-methylcholesta-5,7,22-trien-3beta-ol|ERGOSTEROL|Ergosterol|Provitamin D2|ergosterol (22E)-ergosta-5,7,22-trien-3beta-ol (22E)-ergosta-5,7,22-trien-3beta-ol|(22E,24S)-24-methylcholesta-5,7,22-trien-3beta-ol|ERGOSTEROL|Ergosterol|Provitamin D2|ergosterol http://purl.obolibrary.org/obo/CHEBI_16933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16934 biolink:ChemicalEntity 3-cyano-L-alanine A cyanoamino acid that is the 3-cyano-derivative of L-alanine. cas:6232-19-5|kegg.compound:C02512|knapsack:C00001350|metacyc.compound:CPD-603|pubmed:1855644|reaxys:2410688 Graph 3-Cyano-L-alanine|3-cyano-L-alanine|L-3-Cyanoalanine|L-beta-Cyanoalanine 3-Cyano-L-alanine|3-cyano-L-alanine 3-Cyano-L-alanine|3-cyano-L-alanine|L-3-Cyanoalanine|L-beta-Cyanoalanine http://purl.obolibrary.org/obo/CHEBI_16934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16935 biolink:ChemicalEntity L-rhamnofuranose The furanose form of L-rhamnose. kegg.compound:C02431 Graph 6-deoxy-L-mannofuranose|L-Rhamnofuranose|L-rhamnofuranose 6-deoxy-L-mannofuranose 6-deoxy-L-mannofuranose|L-Rhamnofuranose|L-rhamnofuranose http://purl.obolibrary.org/obo/CHEBI_16935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16937 biolink:ChemicalEntity 5,6-dihydroxy-3-methylquinolin-2(1H)-one kegg.compound:C06725|umbbd.compound:c0073 Graph 5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline|5,6-dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline|5,6-dihydroxy-3-methylquinolin-2(1H)-one 5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline|5,6-dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline|5,6-dihydroxy-3-methylquinolin-2(1H)-one http://purl.obolibrary.org/obo/CHEBI_16937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16938 biolink:ChemicalEntity 6-O-phosphono-D-glucono-1,5-lactone An aldonolactone phosphate comprising D-glucono-1,5-lactone having the phosphate group at the 6-position. beilstein:7176900|cas:2641-81-8|kegg.compound:C01236 Graph 6-Phospho-D-glucono-1,5-lactone|6-phosphonoglucono-delta-lactone|D-Glucono-1,5-lactone 6-phosphate|D-gluconic acid, delta-lactone, 6-(dihydrogen phosphate)|[(2R,3S,4S,5R)-3,4,5-trihydroxy-6-oxooxan-2-yl]methyl dihydrogen phosphate|[(2R,3S,4S,5R)-3,4,5-trihydroxy-6-oxotetrahydro-2H-pyran-2-yl]methyl dihydrogen phosphate [(2R,3S,4S,5R)-3,4,5-trihydroxy-6-oxooxan-2-yl]methyl dihydrogen phosphate 6-Phospho-D-glucono-1,5-lactone|6-phosphonoglucono-delta-lactone|D-Glucono-1,5-lactone 6-phosphate|D-gluconic acid, delta-lactone, 6-(dihydrogen phosphate)|[(2R,3S,4S,5R)-3,4,5-trihydroxy-6-oxooxan-2-yl]methyl dihydrogen phosphate|[(2R,3S,4S,5R)-3,4,5-trihydroxy-6-oxotetrahydro-2H-pyran-2-yl]methyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_16938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16939 biolink:ChemicalEntity 3-amino-3-(4-hydroxyphenyl)propanoic acid A β-amino acid comprising propionic acid having amino and 4-hydroxyphenyl groups attached at the 3-position. hmdb:HMDB0003831|kegg.compound:C04368|pubmed:16793524|pubmed:17545150|reaxys:2097074 Graph 3-Amino-3-(4-hydroxyphenyl)propanoate|3-amino-3-(4-hydroxyphenyl)propanoic acid|3-amino-3-(4-hydroxyphenyl)propionic acid|beta-Tyrosine|beta-tyrosine 3-Amino-3-(4-hydroxyphenyl)propanoate|3-amino-3-(4-hydroxyphenyl)propanoic acid 3-Amino-3-(4-hydroxyphenyl)propanoate|3-amino-3-(4-hydroxyphenyl)propanoic acid|3-amino-3-(4-hydroxyphenyl)propionic acid|beta-Tyrosine|beta-tyrosine http://purl.obolibrary.org/obo/CHEBI_16939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16941 biolink:ChemicalEntity cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene kegg.compound:C06721|umbbd.compound:c0133 Graph Cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene|cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene|cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene|rel-(1R,2S)-1,2-dihydrodibenzo[b,d]thiophene-1,2-diol rel-(1R,2S)-1,2-dihydrodibenzo[b,d]thiophene-1,2-diol Cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene|cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene|cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene|rel-(1R,2S)-1,2-dihydrodibenzo[b,d]thiophene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16942 biolink:ChemicalEntity lipid X An N-acyl-D-glucosamine 1-phosphate where the N-acyl group is (R)-3-hydroxytetradecanoyl and carrying an additional (R)-3-hydroxytetradecanoyl group at the 3-position. beilstein:4629355|cas:86559-73-1|kegg.compound:C04824|lipidmaps:LMSL01020001|pdb-ccd:LP5 Graph 2,3-Bis(3-hydroxytetradecanoyl)-alpha-D-glucosaminyl 1-phosphate|2,3-Bis[(3R)-3-hydroxymyristoyl]-alpha-D-glucosaminyl 1-phosphate|2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-alpha-D-glucopyranose|Lipid X 2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-alpha-D-glucopyranose 2,3-Bis(3-hydroxytetradecanoyl)-alpha-D-glucosaminyl 1-phosphate|2,3-Bis[(3R)-3-hydroxymyristoyl]-alpha-D-glucosaminyl 1-phosphate|2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-alpha-D-glucopyranose|Lipid X http://purl.obolibrary.org/obo/CHEBI_16942 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16943 biolink:ChemicalEntity (R)-2,4-dihydroxy-3-oxobutanoic acid The 3-dehydro derivative of L-threonic acid. kegg.compound:C03064 Graph (2R)-2,4-dihydroxy-3-oxobutanoic acid|3-Dehydro-L-threonate|3-dehydro-L-threonate (2R)-2,4-dihydroxy-3-oxobutanoic acid (2R)-2,4-dihydroxy-3-oxobutanoic acid|3-Dehydro-L-threonate|3-dehydro-L-threonate http://purl.obolibrary.org/obo/CHEBI_16943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16944 biolink:ChemicalEntity L-2-amino-3-oxobutanoate kegg.compound:C03508 Graph (2S)-2-amino-3-oxobutanoate|L-2-Amino-3-oxobutanoate|L-2-Amino-acetoacetate (2S)-2-amino-3-oxobutanoate (2S)-2-amino-3-oxobutanoate|L-2-Amino-3-oxobutanoate|L-2-Amino-acetoacetate http://purl.obolibrary.org/obo/CHEBI_16944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16945 biolink:ChemicalEntity scytalone A cyclic ketone that is 3,4-dihydronaphthalen-1(2H)-one substituted by hydroxy groups at positions 3, 6, and 8. cas:49598-85-8|kegg.compound:C00779|reaxys:2050731 Graph 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone|3,6,8-trihydroxy-3,4-dihydronaphthalen-1(2H)-one|Scytalone|scytalone 3,6,8-trihydroxy-3,4-dihydronaphthalen-1(2H)-one 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone|3,6,8-trihydroxy-3,4-dihydronaphthalen-1(2H)-one|Scytalone|scytalone http://purl.obolibrary.org/obo/CHEBI_16945 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16946 biolink:ChemicalEntity L-kynurenine A kynurenine that has L configuration. cas:2922-83-0|drugbank:DB02070|hmdb:HMDB0000684|kegg.compound:C00328|knapsack:C00007604|metacyc.compound:CPD-14736|pdb-ccd:KYN|pubmed:22770225|reaxys:2942333|wikipedia.en:Kynurenine Graph (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid|3-(2-aminobenzoyl)-L-alanine|3-Anthraniloyl-L-alanine|KYNURENINE|L-Kynurenine 3-(2-aminobenzoyl)-L-alanine (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid|3-(2-aminobenzoyl)-L-alanine|3-Anthraniloyl-L-alanine|KYNURENINE|L-Kynurenine http://purl.obolibrary.org/obo/CHEBI_16946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16947 biolink:ChemicalEntity citrate(3-) A tricarboxylic acid trianion, obtained by deprotonation of the three carboxy groups of citric acid. cas:126-44-3|gmelin:4239|kegg.compound:C00158|pdb-ccd:FLC|reaxys:1884707 Graph 2-hydroxy-1,2,3-propanetricarboxylate|2-hydroxy-1,2,3-propanetricarboxylate(3-)|2-hydroxy-1,2,3-propanetricarboxylic acid, ion(3-)|2-hydroxypropane-1,2,3-tricarboxylate|2-hydroxytricarballylate|CITRATE ANION|cit|cit(3-)|citrate 2-hydroxypropane-1,2,3-tricarboxylate 2-hydroxy-1,2,3-propanetricarboxylate|2-hydroxy-1,2,3-propanetricarboxylate(3-)|2-hydroxy-1,2,3-propanetricarboxylic acid, ion(3-)|2-hydroxypropane-1,2,3-tricarboxylate|2-hydroxytricarballylate|CITRATE ANION|cit|cit(3-)|citrate http://purl.obolibrary.org/obo/CHEBI_16947 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16948 biolink:ChemicalEntity N-acetyl-D-glucosaminic acid The N-acetyl derivative of D-glucosaminic acid. cas:29024-90-6|cas:50257-06-2|cas:50257-10-8|kegg.compound:C01133 Graph (3R,4S,5R)-N-acetyl-3,4,5,6-tetrahydroxynorleucine|2-acetamido-2-deoxy-D-gluconic acid 2-acetamido-2-deoxy-D-gluconic acid (3R,4S,5R)-N-acetyl-3,4,5,6-tetrahydroxynorleucine|2-acetamido-2-deoxy-D-gluconic acid http://purl.obolibrary.org/obo/CHEBI_16948 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16950 biolink:ChemicalEntity 2-dehydro-3-deoxy-L-fuconic acid kegg.compound:C03827 Graph 3,6-dideoxy-L-threo-hex-2-ulosonic acid 3,6-dideoxy-L-threo-hex-2-ulosonic acid 3,6-dideoxy-L-threo-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_16950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16952 biolink:ChemicalEntity 5-hydroxymethyldeoxycytidylic acid A 2'-deoxycytidine phosphate compound having the phosphate group at the 5'-position and a hydroxymethyl substituent at the 5-position. beilstein:47896|cas:13009-95-5|kegg.compound:C03997 Graph 2'-Deoxy-5-hydroxymethylcytidine 5'-phosphate|2'-deoxy-5-(hydroxymethyl)cytidine 5'-(dihydrogen phosphate)|5-Hmdcyt|5-Hydroxymethyldeoxycytidylate|5-Hydroxymethyldeoxycytidylic acid 2'-deoxy-5-(hydroxymethyl)cytidine 5'-(dihydrogen phosphate) 2'-Deoxy-5-hydroxymethylcytidine 5'-phosphate|2'-deoxy-5-(hydroxymethyl)cytidine 5'-(dihydrogen phosphate)|5-Hmdcyt|5-Hydroxymethyldeoxycytidylate|5-Hydroxymethyldeoxycytidylic acid http://purl.obolibrary.org/obo/CHEBI_16952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16953 biolink:ChemicalEntity N-acetyl-L-aspartate(2-) A doubly-charged N-acyl-L-α-amino acid anion resulting from deprotonation of both carboxy groups of N-acetyl-L-aspartic acid. gmelin:2250815|kegg.compound:C01042|metacyc.compound:CPD-420|pubmed:12718449|pubmed:14645985|pubmed:15836629|pubmed:16524379|pubmed:17190852|pubmed:18002959|pubmed:18293939|pubmed:18355643|pubmed:18835755|pubmed:19091459|pubmed:19531109|pubmed:19850131|pubmed:20398713|pubmed:20421982|pubmed:4377221 Graph (2S)-2-acetamidobutanedioate|(S)-2-(acetylamino)succinate|N-Acetyl-L-aspartate|N-acetyl-L-aspartate (2S)-2-acetamidobutanedioate (2S)-2-acetamidobutanedioate|(S)-2-(acetylamino)succinate|N-Acetyl-L-aspartate|N-acetyl-L-aspartate http://purl.obolibrary.org/obo/CHEBI_16953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16954 biolink:ChemicalEntity vitexin An apigenin flavone glycoside, which is found in the passion flower, bamboo leaves and pearl millet cas:3681-93-4|kegg.compound:C01460|knapsack:C00001110|lipidmaps:LMPK12110194|metacyc.compound:VITEXIN|pubmed:21809948|pubmed:22408451|pubmed:22683902|pubmed:22941432|pubmed:23099258|reaxys:67796|wikipedia.en:Vitexin Graph (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol|Apigenin 8-C-glucoside|Vitexin|apigenin 8-C-glucoside (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol|Apigenin 8-C-glucoside|Vitexin|apigenin 8-C-glucoside http://purl.obolibrary.org/obo/CHEBI_16954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16955 biolink:ChemicalEntity GDP-4-dehydro-6-deoxy-alpha-D-mannose A GDP-sugar having 4-dehydro-6-deoxy-α-D-mannose as the sugar portion. cas:18186-48-6|hmdb:HMDB0001346|kegg.compound:C01222|knapsack:C00007244 Graph GDP-4-dehydro-6-deoxy-D-mannose|GDP-4-dehydro-6-deoxy-D-talose|GDP-4-dehydro-D-rhamnose|GDP-4-keto-6-deoxy-D-mannose|GDP-4-oxo-6-deoxy-D-mannose|Gdp-4-keto-6-deoxymannose|Guanosine 5'-(trihydrogen diphosphate), P'-(6-deoxy-alpha-D-lyxo-hexopyranos-4-ulos-1-yl) ester|Guanosine diphosphate-4-keto-6-deoxy-D-mannose|guanosine 5'-[3-(6-deoxy-alpha-D-lyxo-hexopyranosyl-4-ulose) dihydrogen diphosphate] guanosine 5'-[3-(6-deoxy-alpha-D-lyxo-hexopyranosyl-4-ulose) dihydrogen diphosphate] GDP-4-dehydro-6-deoxy-D-mannose|GDP-4-dehydro-6-deoxy-D-talose|GDP-4-dehydro-D-rhamnose|GDP-4-keto-6-deoxy-D-mannose|GDP-4-oxo-6-deoxy-D-mannose|Gdp-4-keto-6-deoxymannose|Guanosine 5'-(trihydrogen diphosphate), P'-(6-deoxy-alpha-D-lyxo-hexopyranos-4-ulos-1-yl) ester|Guanosine diphosphate-4-keto-6-deoxy-D-mannose|guanosine 5'-[3-(6-deoxy-alpha-D-lyxo-hexopyranosyl-4-ulose) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_16955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16957 biolink:ChemicalEntity deacetoxyvindoline kegg.compound:C02673|reaxys:21650527 Graph 16-Methoxy-2,3-dihydro-3-hydroxy-N-methyltabersonine|Deacetoxyvindoline|Desacetoxyvindoline|methyl 3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate methyl 3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate 16-Methoxy-2,3-dihydro-3-hydroxy-N-methyltabersonine|Deacetoxyvindoline|Desacetoxyvindoline|methyl 3beta-hydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate http://purl.obolibrary.org/obo/CHEBI_16957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169570 biolink:ChemicalEntity N-(3E-hexadecenoyl)-deoxysphing-4-enine-1-sulfonate chemspider:24823203|lipidmaps:LMSP00000003 Graph (E,2R,3R)-2-[[(E)-hexadec-3-enoyl]amino]-3-hydroxyoctadec-4-ene-1-sulonic acid (E,2R,3R)-2-[[(E)-hexadec-3-enoyl]amino]-3-hydroxyoctadec-4-ene-1-sulonic acid (E,2R,3R)-2-[[(E)-hexadec-3-enoyl]amino]-3-hydroxyoctadec-4-ene-1-sulonic acid http://purl.obolibrary.org/obo/CHEBI_169570 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16958 biolink:ChemicalEntity beta-alanine A naturally-occurring β-amino acid comprising propionic acid with the amino group in the 3-position. cas:107-95-9|drugbank:DB03107|gmelin:49614|hmdb:HMDB0000056|kegg.compound:C00099|kegg.drug:D07561|knapsack:C00001333|metacyc.compound:B-ALANINE|pdb-ccd:BAL|pubmed:11139233|pubmed:11850512|pubmed:12107759|pubmed:12887142|pubmed:14363188|pubmed:16934791|pubmed:18528519|pubmed:18613640|pubmed:19239140|pubmed:19955842|pubmed:20199122|pubmed:20386120|pubmed:20479615|pubmed:20994958|pubmed:22735334|reaxys:906793|wikipedia.en:Beta-Alanine Graph 3-Aminopropionic acid|3-aminopropanoic acid|BETA-ALANINE|H-beta-Ala-OH|bAla|beta-Alanine|beta-alanine|beta-aminopropionic acid|omega-aminopropionic acid 3-aminopropanoic acid|BETA-ALANINE|beta-Alanine|beta-alanine 3-Aminopropionic acid|3-aminopropanoic acid|BETA-ALANINE|H-beta-Ala-OH|bAla|beta-Alanine|beta-alanine|beta-aminopropionic acid|omega-aminopropionic acid http://purl.obolibrary.org/obo/CHEBI_16958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16959 biolink:ChemicalEntity albendazole S-oxide beilstein:677664|cas:54029-12-8|drugcentral:104|kegg.compound:C02809|kegg.drug:D07106 Graph (+-)-albendazole sulfoxide|Albendazole S-oxide|Ricobendazole|Rycobendazole|albendazole S-oxide|albendazole oxide|albendazole sulfoxide|methyl [5-(propylsulfinyl)-1H-benzimidazol-2-yl]carbamate methyl [5-(propylsulfinyl)-1H-benzimidazol-2-yl]carbamate (+-)-albendazole sulfoxide|Albendazole S-oxide|Ricobendazole|Rycobendazole|albendazole S-oxide|albendazole oxide|albendazole sulfoxide|methyl [5-(propylsulfinyl)-1H-benzimidazol-2-yl]carbamate http://purl.obolibrary.org/obo/CHEBI_16959 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16960 biolink:ChemicalEntity ADP-D-ribose A nucleotide-sugar having ADP as the nucleotide fragment and D-ribofuranos-5-yl as the sugar component. beilstein:1236193|beilstein:6081768|cas:20762-30-5|kegg.compound:C00301 Graph (Rib5)ppA|5-(adenosine 5'-pyrophosphoryl)-D-ribose|A5'pp5Rib|ADP ribose|ADP-D-ribose|ADP-Rib|ADP-riboses|ADPribose|Adenosine diphosphate ribose|AdoPPRib|D-ribofuranose, 5-5'-ester with adenosine 5'-(trihydrogen pyrophosphate)|adenosine 5'-(trihydrogen diphosphate), P'-5-ester with D-ribose|adenosine 5'-[3-(D-ribofuranos-5-O-yl) dihydrogen diphosphate]|adenosine 5'-diphosphoribose|adenosine 5'-pyrophosphate, 5'-5-ester with D-ribofuranose|adenosine diphosphate ribose|ribose adenosinediphosphate adenosine 5'-[3-(D-ribofuranos-5-O-yl) dihydrogen diphosphate] (Rib5)ppA|5-(adenosine 5'-pyrophosphoryl)-D-ribose|A5'pp5Rib|ADP ribose|ADP-D-ribose|ADP-Rib|ADP-riboses|ADPribose|Adenosine diphosphate ribose|AdoPPRib|D-ribofuranose, 5-5'-ester with adenosine 5'-(trihydrogen pyrophosphate)|adenosine 5'-(trihydrogen diphosphate), P'-5-ester with D-ribose|adenosine 5'-[3-(D-ribofuranos-5-O-yl) dihydrogen diphosphate]|adenosine 5'-diphosphoribose|adenosine 5'-pyrophosphate, 5'-5-ester with D-ribofuranose|adenosine diphosphate ribose|ribose adenosinediphosphate http://purl.obolibrary.org/obo/CHEBI_16960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16961 biolink:ChemicalEntity monoacylglycerol phosphate Derivatives of phosphoglycerols which have only one of the alcohol groups of the glycerol backbone ester-linked with a fatty acid. Graph Lysophospholipid|lysophospholipids|monoacylglycerol phosphates|monoacylglycerophosphate|monoacylglycerophosphates Lysophospholipid|lysophospholipids|monoacylglycerol phosphates|monoacylglycerophosphate|monoacylglycerophosphates http://purl.obolibrary.org/obo/CHEBI_16961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16962 biolink:ChemicalEntity cortisone A C21-steroid that is pregn-4-ene substituted by hydroxy groups at positions 17 and 21 and oxo group at positions 3, 11 and 20. cas:53-06-5|hmdb:HMDB0002802|kegg.compound:C00762|kegg.drug:D07749|lipidmaps:LMST02030090|metacyc.compound:CORTISONE|pubmed:11710540|pubmed:14874924|pubmed:2268561|pubmed:24391193|pubmed:8989250|reaxys:1356062|wikipedia.en:Cortisone Graph 11-dehydro-17-hydroxycorticosterone|17,21-dihydroxypregn-4-ene-3,11,20-trione|17-hydroxy-11-dehydrocorticosterone|17alpha,21-Dihydroxy-4-pregnene-3,11,20-trione|17alpha,21-dihydroxy-4-pregnene-3,11,20-trione|4-pregnene-17alpha,21-diol-3,11,20-trione|Cortison|Cortisone|Delta(4)-pregnene-17alpha,21-diol-3,11,20-trione|Kendall's compound E|Kortison|Reichstein's substance Fa|Wintersteiner's compound F|cortisone|pregn-4-en-17alpha,21-diol-3,11,20-trione 17,21-dihydroxypregn-4-ene-3,11,20-trione 11-dehydro-17-hydroxycorticosterone|17,21-dihydroxypregn-4-ene-3,11,20-trione|17-hydroxy-11-dehydrocorticosterone|17alpha,21-Dihydroxy-4-pregnene-3,11,20-trione|17alpha,21-dihydroxy-4-pregnene-3,11,20-trione|4-pregnene-17alpha,21-diol-3,11,20-trione|Cortison|Cortisone|Delta(4)-pregnene-17alpha,21-diol-3,11,20-trione|Kendall's compound E|Kortison|Reichstein's substance Fa|Wintersteiner's compound F|cortisone|pregn-4-en-17alpha,21-diol-3,11,20-trione http://purl.obolibrary.org/obo/CHEBI_16962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16964 biolink:ChemicalEntity 5-hydroxymethyluracil A primary alcohol that is uracil bearing a hydroxymethyl substituent at the 5-position. cas:4433-40-3|hmdb:HMDB0000469|kegg.compound:C03088|metacyc.compound:CPD-254|pdb-ccd:HMU|pubmed:11275423|pubmed:12361800|pubmed:15649624|pubmed:1807452|pubmed:3904829|pubmed:9639392|pubmed:9671541|reaxys:125482 Graph 5-(hydroxymethyl)-2,4(1H,3H)-pyrimidinedione|5-(hydroxymethyl)pyrimidine-2,4(1H,3H)-dione|5-(hydroxymethyl)uracil|5-HYDROXYMETHYL URACIL|5-Hydroxymethyluracil|5-hydroxymethyluracil 5-(hydroxymethyl)pyrimidine-2,4(1H,3H)-dione 5-(hydroxymethyl)-2,4(1H,3H)-pyrimidinedione|5-(hydroxymethyl)pyrimidine-2,4(1H,3H)-dione|5-(hydroxymethyl)uracil|5-HYDROXYMETHYL URACIL|5-Hydroxymethyluracil|5-hydroxymethyluracil http://purl.obolibrary.org/obo/CHEBI_16964 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16966 biolink:ChemicalEntity heteroglycan A polysaccharide composed of two or more different types of monosaccharides, kegg.compound:C01923 Graph Heteroglycan|Heteropolysaccharide|heteroglycans Heteroglycan|Heteropolysaccharide|heteroglycans http://purl.obolibrary.org/obo/CHEBI_16966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16968 biolink:ChemicalEntity 1,8-diazacyclotetradecane-2,9-dione kegg.compound:C04277 Graph 1,8-Diazacyclotetradecane-2,9-dione|1,8-diazacyclotetradecane-2,9-dione 1,8-Diazacyclotetradecane-2,9-dione|1,8-diazacyclotetradecane-2,9-dione 1,8-Diazacyclotetradecane-2,9-dione|1,8-diazacyclotetradecane-2,9-dione http://purl.obolibrary.org/obo/CHEBI_16968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16970 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-D-glutamic acid beilstein:8250679|kegg.compound:C00692 Graph UDP-Mur2Ac-L-Ala-D-Glu|UDP-MurNAc-L-Ala-D-Glu|UDP-N-acetylmuramoyl-L-alanyl-D-glutamate|uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-{[(2S)-1-D-glutamo-1-oxopropan-2-yl]amino}-1-oxopropan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-{[(2S)-1-D-glutamo-1-oxopropan-2-yl]amino}-1-oxopropan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) UDP-Mur2Ac-L-Ala-D-Glu|UDP-MurNAc-L-Ala-D-Glu|UDP-N-acetylmuramoyl-L-alanyl-D-glutamate|uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-{[(2S)-1-D-glutamo-1-oxopropan-2-yl]amino}-1-oxopropan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_16970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16971 biolink:ChemicalEntity benzene-1,2,4-triol A benzenetriol carrying hydroxy groups at positions 1, 2 and 4. cas:533-73-3|kegg.compound:C02814|knapsack:C00031480|metacyc.compound:CPD-8130|pdb-ccd:HQN|pubmed:21396889|pubmed:24578277|pubmed:24803113|umbbd.compound:c0264|wikipedia.en:Benzene-1,2,4-triol Graph 1,2,4-Benzenetriol|1,2,4-Trihydroxybenzene|1,2,4-benzenetriol|Benzene-1,2,4-triol|Hydroxyhydroquinone|Hydroxyquinol|benzene-1,2,4-triol Benzene-1,2,4-triol|benzene-1,2,4-triol 1,2,4-Benzenetriol|1,2,4-Trihydroxybenzene|1,2,4-benzenetriol|Benzene-1,2,4-triol|Hydroxyhydroquinone|Hydroxyquinol|benzene-1,2,4-triol http://purl.obolibrary.org/obo/CHEBI_16971 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16973 biolink:ChemicalEntity 11-deoxycorticosterone A mineralocorticoid that is progesterone substituted at position 21 by a hydroxy group. cas:64-85-7|drugcentral:820|kegg.compound:C03205|kegg.drug:D07792|lipidmaps:LMST02030087|metacyc.compound:11-DEOXYCORTICOSTERONE|pdb-ccd:1CA|pubmed:22770225|reaxys:2062123|wikipedia.en:Desoxycorticosterone Graph 11-Deoxycorticosterone|21-Hydroxy-4-pregnene-3,20-dione|21-hydroxypregn-4-ene-3,20-dione|21-hydroxyprogesterone|4-pregnen-21-ol-3,20-dione|Cortexone|DESOXYCORTICOSTERONE|DOC|Deoxycorticosterone|Desoxycortone|Kendall's desoxy compound B|Reichstein's substance Q|desoxycortone 21-hydroxypregn-4-ene-3,20-dione 11-Deoxycorticosterone|21-Hydroxy-4-pregnene-3,20-dione|21-hydroxypregn-4-ene-3,20-dione|21-hydroxyprogesterone|4-pregnen-21-ol-3,20-dione|Cortexone|DESOXYCORTICOSTERONE|DOC|Deoxycorticosterone|Desoxycortone|Kendall's desoxy compound B|Reichstein's substance Q|desoxycortone http://purl.obolibrary.org/obo/CHEBI_16973 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16974 biolink:ChemicalEntity imidazol-4-ylacetic acid A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by an imidazol-4-yl group. cas:645-65-8|hmdb:HMDB0002024|kegg.compound:C02835|metacyc.compound:4-IMIDAZOLEACETATE|pubmed:22770225|reaxys:3478 Graph 1H-Imidazole-4-acetic acid|1H-imidazol-4-ylacetic acid|4(5)-Imidazoleacetate|4-Imidazoleacetate|Imidazole-4-acetate|Imidazoleacetic acid 1H-imidazol-4-ylacetic acid 1H-Imidazole-4-acetic acid|1H-imidazol-4-ylacetic acid|4(5)-Imidazoleacetate|4-Imidazoleacetate|Imidazole-4-acetate|Imidazoleacetic acid http://purl.obolibrary.org/obo/CHEBI_16974 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16975 biolink:ChemicalEntity 1-acyl-sn-glycerol 3-phosphate kegg.compound:C00681|pubmed:21376640 Graph 1-Acyl-sn-glycerol 3-phosphate|1-acyl-sn-glycerol 3-phosphates|2-Lysophosphatidate|Lysophosphatidate|Lysophosphatidic acid|lysophosphatidic acid 1-Acyl-sn-glycerol 3-phosphate|1-acyl-sn-glycerol 3-phosphates|2-Lysophosphatidate|Lysophosphatidate|Lysophosphatidic acid|lysophosphatidic acid http://purl.obolibrary.org/obo/CHEBI_16975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16976 biolink:ChemicalEntity hygromycin B beilstein:6755837|cas:31282-04-9|kegg.compound:C01925|pdb-ccd:HYG Graph (1R,2S,3R,5S,6R)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl O-6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranoside|Antibiotic A-396-II|HYGROMYCIN B|Hygromycin B|O-6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-O-beta-D-talopyranosyl-(1->5)-2-deoxy-N(3)-methyl-D-streptamine (1R,2S,3R,5S,6R)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl O-6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranoside (1R,2S,3R,5S,6R)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl O-6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-beta-D-talopyranoside|Antibiotic A-396-II|HYGROMYCIN B|Hygromycin B|O-6-amino-6-deoxy-L-glycero-D-galacto-heptopyranosylidene-(1->2-3)-O-beta-D-talopyranosyl-(1->5)-2-deoxy-N(3)-methyl-D-streptamine http://purl.obolibrary.org/obo/CHEBI_16976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16977 biolink:ChemicalEntity L-alanine The L-enantiomer of alanine. cas:56-41-7|drugbank:DB00160|drugcentral:4255|ecmdb:ECMDB00161|gmelin:49628|hmdb:HMDB0000161|kegg.compound:C00041|kegg.drug:D00012|knapsack:C00001332|metacyc.compound:ALPHA-ALANINE|pdb-ccd:ALA_LFOH|pubmed:18235971|pubmed:22735334|pubmed:3275662|reaxys:1720248|wikipedia.en:Alanine|ymdb:YMDB00154 Graph (2S)-2-aminopropanoic acid|(S)-2-aminopropanoic acid|(S)-alanine|A|ALANINE|Ala|L-2-Aminopropionic acid|L-Alanin|L-Alanine|L-alanine|L-alpha-Alanine|L-alpha-alanine ALANINE|L-Alanine|L-alanine (2S)-2-aminopropanoic acid|(S)-2-aminopropanoic acid|(S)-alanine|A|ALANINE|Ala|L-2-Aminopropionic acid|L-Alanin|L-Alanine|L-alanine|L-alpha-Alanine|L-alpha-alanine http://purl.obolibrary.org/obo/CHEBI_16977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16978 biolink:ChemicalEntity leukotriene C4 A leukotriene that is (5S,7E,9E,11Z,14Z)-5-hydroxyicosa-7,9,11,14-tetraenoic acid in which a glutathionyl group is attached at position 6 via a sulfide linkage. cas:72025-60-6|drugbank:DB08855|foodb.food:FDB022484|hmdb:HMDB0001198|kegg.compound:C02166|lipidmaps:LMFA03020003|metacyc.compound:LEUKOTRIENE-C4|pdb-ccd:LTX|pubmed:10064732|pubmed:11156567|pubmed:12895596|pubmed:15243994|pubmed:15537867|pubmed:1652771|pubmed:2007712|pubmed:20671299|pubmed:2411760|pubmed:24244016|pubmed:2509375|pubmed:2512259|pubmed:2558123|pubmed:2633615|pubmed:26656251|pubmed:27124118|pubmed:28238471|pubmed:28667163|pubmed:31268744|pubmed:3153930|pubmed:33753496|pubmed:3418380|pubmed:3421265|pubmed:6440558|pubmed:7714683|pubmed:8415814|pubmed:8434868|pubmed:8608646|pubmed:8938552|pubmed:8939179|pubmed:9042024|pubmed:9051719|pubmed:9384524|pubmed:9642160|reaxys:4732117|wikipedia.en:Leukotriene_C4 Graph (R-(R*,S*-(E,E,Z,Z)))-N-(S-(1-(4-Carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)-N-L-gamma-glutamyl-L-cysteinyl)glycine|5S,6R-Ltc(sub 4)|5S-hydroxy,6R-(S-glutathionyl),7E,9E,11Z,14Z-eicosatetraenoic acid|L-gamma-glutamyl-S-[(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl]-L-cysteinylglycine|LTC (sub 4)|LTC4|Leukotriene C4 L-gamma-glutamyl-S-[(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl]-L-cysteinylglycine (R-(R*,S*-(E,E,Z,Z)))-N-(S-(1-(4-Carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)-N-L-gamma-glutamyl-L-cysteinyl)glycine|5S,6R-Ltc(sub 4)|5S-hydroxy,6R-(S-glutathionyl),7E,9E,11Z,14Z-eicosatetraenoic acid|L-gamma-glutamyl-S-[(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl]-L-cysteinylglycine|LTC (sub 4)|LTC4|Leukotriene C4 http://purl.obolibrary.org/obo/CHEBI_16978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16980 biolink:ChemicalEntity geranial A monoterpenoid that is (2E,6E)-octa-2,6-dienal substituted by methyl groups at positions 3 and 7. cas:141-27-5|cas:5392-40-5|hmdb:HMDB0035078|kegg.compound:C01499|knapsack:C00003035|lipidmaps:LMPR0102010003|metacyc.compound:GERANIAL|pubmed:23938144|pubmed:24682420|reaxys:1721873 Graph (2E)-3,7-dimethylocta-2,6-dienal|(2E)-geranial|(E)-Citral|(E)-Geranial|Geranial|alpha-Citral|citral A|lemonal|neral|trans-Citral (2E)-3,7-dimethylocta-2,6-dienal (2E)-3,7-dimethylocta-2,6-dienal|(2E)-geranial|(E)-Citral|(E)-Geranial|Geranial|alpha-Citral|citral A|lemonal|neral|trans-Citral http://purl.obolibrary.org/obo/CHEBI_16980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16982 biolink:ChemicalEntity (R,R)-butane-2,3-diol The (R,R) diastereoisomer of butane-2,3-diol. beilstein:1718901|cas:24347-58-8|drugbank:DB02418|gmelin:141781|kegg.compound:C03044|pdb-ccd:BU3 Graph (2R,3R)-butane-2,3-diol|(R,R)-(-)-butane-2,3-diol|(R,R)-2,3-BUTANEDIOL|(R,R)-2,3-Butanediol|(R,R)-2,3-Butylene glycol|(R,R)-Butane-2,3-diol|(R,R)-butane-2,3-diol (2R,3R)-butane-2,3-diol (2R,3R)-butane-2,3-diol|(R,R)-(-)-butane-2,3-diol|(R,R)-2,3-BUTANEDIOL|(R,R)-2,3-Butanediol|(R,R)-2,3-Butylene glycol|(R,R)-Butane-2,3-diol|(R,R)-butane-2,3-diol http://purl.obolibrary.org/obo/CHEBI_16982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16984 biolink:ChemicalEntity N-acetylimidazole cas:2466-76-4|kegg.compound:C02560 Graph 1-Acetylimidazole|1-acetyl-1H-imidazole|Acetylimidazole|N-Acetylimidazole|N-acetylimidazole 1-acetyl-1H-imidazole 1-Acetylimidazole|1-acetyl-1H-imidazole|Acetylimidazole|N-Acetylimidazole|N-acetylimidazole http://purl.obolibrary.org/obo/CHEBI_16984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16985 biolink:ChemicalEntity 5beta-androstane-3,17-dione An androstane-3,17-dione with a 5β-configuration. cas:1229-12-5|drugbank:DB07375|hmdb:HMDB0003769|kegg.compound:C03772|lipidmaps:LMST02020058|metacyc.compound:5-BETA-ANDROSTANE-317-DIONE|pdb-ccd:ANO|reaxys:2218897 Graph 5-beta-androstane-3,17-dione|5beta-Androstane-3,17-dione|5beta-androstane-3,17-dione|Etiocholane-3,17-dione|Etiocholanedione 5beta-Androstane-3,17-dione|5beta-androstane-3,17-dione 5-beta-androstane-3,17-dione|5beta-Androstane-3,17-dione|5beta-androstane-3,17-dione|Etiocholane-3,17-dione|Etiocholanedione http://purl.obolibrary.org/obo/CHEBI_16985 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16987 biolink:ChemicalEntity 1-piperideine-6-carboxylate A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of 1-piperideine-6-carboxylic acid. Graph 1-piperideine-6-carboxylate|2,3,4,5-tetrahydropyridine-2-carboxylate|delta-1-Piperideine-6-carboxylate 2,3,4,5-tetrahydropyridine-2-carboxylate 1-piperideine-6-carboxylate|2,3,4,5-tetrahydropyridine-2-carboxylate|delta-1-Piperideine-6-carboxylate http://purl.obolibrary.org/obo/CHEBI_16987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16988 biolink:ChemicalEntity D-ribose A ribose in which the chiral carbon atom furthest away from the aldehyde group (C4') has the same configuration as in D-glyceraldehyde. drugbank:DB01936|pubmed:24404872|pubmed:24752650 Graph D-Rib|D-ribo-pentose|D-ribose D-ribo-pentose|D-ribose D-Rib|D-ribo-pentose|D-ribose http://purl.obolibrary.org/obo/CHEBI_16988 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16989 biolink:ChemicalEntity 2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid kegg.compound:C04553 Graph 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-3-carboxylic acid|3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate|4-Carboxy-2,5-dihydro-2-oxofuran-5-acetate|4-carboxy-2,5-dihydro-2-oxofuran-5-acetate 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-3-carboxylic acid 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-3-carboxylic acid|3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate|4-Carboxy-2,5-dihydro-2-oxofuran-5-acetate|4-carboxy-2,5-dihydro-2-oxofuran-5-acetate http://purl.obolibrary.org/obo/CHEBI_16989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16990 biolink:ChemicalEntity bilirubin IXalpha A member of the class of biladienes that is a linear tetrapyrrole with the dipyrrole units being of both exovinyl and endovinyl type. A product of heme degradation, it is produced in the reticuloendothelial system by the reduction of biliverdin and transported to the liver as a complex with serum albumin. cas:635-65-4|gmelin:411033|hmdb:HMDB0000054|kegg.compound:C00486|knapsack:C00029828|metacyc.compound:BILIRUBIN|pdb-ccd:BLR|pubmed:12799017|pubmed:18442622|pubmed:23763371|pubmed:23768684|pubmed:30224965|pubmed:8605219|pubmed:9587403|reaxys:74376|wikipedia.en:Bilirubin Graph 1,10,19,22,23,24-hexahydro-2,7,13,17-tetramethyl-1,19-dioxo-3,18-divinylbiline-8,12-dipropionic acid|2,17-diethenyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-21H-biline-8,12-dipropanoic acid|2,7,13,17-tetramethyl-1,19-dioxo-3,18-divinyl-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid|3,18-diethenyl-2,7,13,17-tetramethyl-1,19-dioxo-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid|8,12-bis(2-carboxyethyl)-2,7,13,17-tetramethyl-3,18-divinylbiladiene-ac-1,19(21H,24H)-dione|Bilirubin|bilirubin|bilirubin(Z,Z)|bilirubin-IXalpha 3,18-diethenyl-2,7,13,17-tetramethyl-1,19-dioxo-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid|Bilirubin|bilirubin 1,10,19,22,23,24-hexahydro-2,7,13,17-tetramethyl-1,19-dioxo-3,18-divinylbiline-8,12-dipropionic acid|2,17-diethenyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-21H-biline-8,12-dipropanoic acid|2,7,13,17-tetramethyl-1,19-dioxo-3,18-divinyl-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid|3,18-diethenyl-2,7,13,17-tetramethyl-1,19-dioxo-1,10,19,22,23,24-hexahydro-21H-biline-8,12-dipropanoic acid|8,12-bis(2-carboxyethyl)-2,7,13,17-tetramethyl-3,18-divinylbiladiene-ac-1,19(21H,24H)-dione|Bilirubin|bilirubin|bilirubin(Z,Z)|bilirubin-IXalpha http://purl.obolibrary.org/obo/CHEBI_16990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16991 biolink:ChemicalEntity deoxyribonucleic acid High molecular weight, linear polymers, composed of nucleotides containing deoxyribose and linked by phosphodiester bonds; DNA contain the genetic information of organisms. cas:9007-49-2|kegg.compound:C00039 Graph (Deoxyribonucleotide)m|(Deoxyribonucleotide)n|(Deoxyribonucleotide)n+m|DNA|DNAn|DNAn+1|DNS|Deoxyribonucleic acid|Desoxyribonukleinsaeure|deoxyribonucleic acids|desoxyribose nucleic acid|thymus nucleic acid deoxyribonucleic acids (Deoxyribonucleotide)m|(Deoxyribonucleotide)n|(Deoxyribonucleotide)n+m|DNA|DNAn|DNAn+1|DNS|Deoxyribonucleic acid|Desoxyribonukleinsaeure|deoxyribonucleic acids|desoxyribose nucleic acid|thymus nucleic acid http://purl.obolibrary.org/obo/CHEBI_16991 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16992 biolink:ChemicalEntity 2-hydroxy-3-oxopropanoic acid cas:2480-77-5|kegg.compound:C01146 Graph 2-Hydroxy-3-oxopropanoate|2-hydroxy-3-oxopropanoic acid|Tartronate semialdehyde 2-Hydroxy-3-oxopropanoate|2-hydroxy-3-oxopropanoic acid 2-Hydroxy-3-oxopropanoate|2-hydroxy-3-oxopropanoic acid|Tartronate semialdehyde http://purl.obolibrary.org/obo/CHEBI_16992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16993 biolink:ChemicalEntity 2-(carboxymethyl)-5-oxo-2,5-dihydro-2-furoic acid A 5-oxo-2-furylacetic acid having a carboxy group at the 2-position. beilstein:1373472|cas:13249-46-2|kegg.compound:C01278 Graph 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-2-carboxylic acid|2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate|2-carboxy-2,5-dihydro-5-oxo-2-furanacetic acid|4-Carboxymuconolactone|4-carboxymuconolactone|5-Carboxy-2,5-dihydro-2-oxofuran-5-acetate|5-carboxy-2,5-dihydro-2-oxofuran-5-acetate|carboxymuconolactone|gamma-Carboxymuconolactone|gamma-carboxymuconolactone 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-2-carboxylic acid 2-(carboxymethyl)-5-oxo-2,5-dihydrofuran-2-carboxylic acid|2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate|2-carboxy-2,5-dihydro-5-oxo-2-furanacetic acid|4-Carboxymuconolactone|4-carboxymuconolactone|5-Carboxy-2,5-dihydro-2-oxofuran-5-acetate|5-carboxy-2,5-dihydro-2-oxofuran-5-acetate|carboxymuconolactone|gamma-Carboxymuconolactone|gamma-carboxymuconolactone http://purl.obolibrary.org/obo/CHEBI_16993 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169939 biolink:ChemicalEntity camostat(1+) A guanidinium ion resulting from the protonation of the guanidyl group of camostat. Major microspecies at pH 7.3. Graph amino{4-[(4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenoxy)carbonyl]anilino}methaniminium|camostat cation amino{4-[(4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenoxy)carbonyl]anilino}methaniminium amino{4-[(4-{2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl}phenoxy)carbonyl]anilino}methaniminium|camostat cation http://purl.obolibrary.org/obo/CHEBI_169939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169942 biolink:ChemicalEntity kaempferol 3-O-beta-D-glucoside(1-) metacyc.compound:CPD1F-453|pubmed:33770502 Graph kaempferol 3-O-beta-D-glucoside kaempferol 3-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_169942 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16995 biolink:ChemicalEntity oxalic acid An α,ω-dicarboxylic acid that is ethane substituted by carboxyl groups at positions 1 and 2. cas:144-62-7|drugbank:DB03902|gmelin:2208|hmdb:HMDB0002329|kegg.compound:C00209|knapsack:C00001198|lipidmaps:LMFA01170031|metacyc.compound:OXALATE|pdb-ccd:OXD|pubmed:15587083|pubmed:22735334|reaxys:385686|wikipedia.en:Oxalic_acid Graph Ethandisaeure|Ethanedioic acid|H2ox|HOOCCOOH|OXALIC ACID|Oxalic acid|Oxalsaeure|ethane-1,2-dioic acid|oxalic acid OXALIC ACID|Oxalic acid|oxalic acid Ethandisaeure|Ethanedioic acid|H2ox|HOOCCOOH|OXALIC ACID|Oxalic acid|Oxalsaeure|ethane-1,2-dioic acid|oxalic acid http://purl.obolibrary.org/obo/CHEBI_16995 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169952 biolink:ChemicalEntity 13-cis-retinoate pubmed:12576512 Graph (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate|13-cis-retinoate (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate|13-cis-retinoate http://purl.obolibrary.org/obo/CHEBI_169952 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16996 biolink:ChemicalEntity L-histidinol phosphate The O-phospho derivative of L-histidinol. beilstein:792319|cas:25679-93-0|drugbank:DB03997|kegg.compound:C01100|knapsack:C00007480|pdb-ccd:HSA Graph (2S)-2-amino-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate|L-Histidinol phosphate|PHOSPHORIC ACID MONO-[2-AMINO-3-(3H-IMIDAZOL-4-YL)-PROPYL]ESTER (2S)-2-amino-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate (2S)-2-amino-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate|L-Histidinol phosphate|PHOSPHORIC ACID MONO-[2-AMINO-3-(3H-IMIDAZOL-4-YL)-PROPYL]ESTER http://purl.obolibrary.org/obo/CHEBI_16996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:16997 biolink:ChemicalEntity propane-1,2-diol The simplest member of the class of propane-1,2-diols, consisting of propane in which a hydrogen at position 1 and a hydrogen at position 2 are substituted by hydroxy groups. A colourless, viscous, hygroscopic, low-melting (−59°C) and high-boiling (188°C) liquid with low toxicity, it is used as a solvent, emulsifying agent, and antifreeze. cas:57-55-6|drugbank:DB01839|drugcentral:4024|hmdb:HMDB0001881|kegg.compound:C00583|kegg.drug:D00078|knapsack:C00007410|lincs.smallmolecule:LSM-36856|ppdb:1304|pubmed:15665701|pubmed:16078503|pubmed:18346395|pubmed:18845115|pubmed:21616561|reaxys:1340498|vsdb:1304|wikipedia.en:Propylene_glycol Graph 1,2-Propanediol|1,2-Propylenglykol|1,2-dihydroxypropane|2-hydroxypropanol|CH3CH(OH)CH2OH|HOCH2CH(OH)CH3|HOCH2CH(OH)Me|MeCH(OH)CH2OH|PPD|Propane-1,2-diol|Propylene glycol|alpha-propyleneglycol|isopropylene glycol|methyl glycol|methylethyl glycol|methylethylene glycol|monopropylene glycol|propane-1,2-diol Propane-1,2-diol|propane-1,2-diol 1,2-Propanediol|1,2-Propylenglykol|1,2-dihydroxypropane|2-hydroxypropanol|CH3CH(OH)CH2OH|HOCH2CH(OH)CH3|HOCH2CH(OH)Me|MeCH(OH)CH2OH|PPD|Propane-1,2-diol|Propylene glycol|alpha-propyleneglycol|isopropylene glycol|methyl glycol|methylethyl glycol|methylethylene glycol|monopropylene glycol|propane-1,2-diol http://purl.obolibrary.org/obo/CHEBI_16997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169970 biolink:ChemicalEntity 2-hydroxy-ATP(4-) A nucleoside triphosphate(4−) obtained by global deprotonation of the triphosphate OH groups of 2-hydroxy-ATP; major species present at pH 7.3. Graph 2-hydroxy-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine|2-hydroxy-ATP|2-hydroxy-ATP tetraanion|2-hydroxyadenosine 5'-triphosphate tetraanion 2-hydroxy-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine 2-hydroxy-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine|2-hydroxy-ATP|2-hydroxy-ATP tetraanion|2-hydroxyadenosine 5'-triphosphate tetraanion http://purl.obolibrary.org/obo/CHEBI_169970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169971 biolink:ChemicalEntity 2-hydroxy-AMP(2-) A nucleoside 5'-monophosphate(2−) that results from the removal of two protons from the phosphate group of 2-hydroxy-AMP. Major microspecies at pH 7.3. Graph 2-hydroxy-5'-O-phosphonatoadenosine|2-hydroxy-AMP|2-hydroxy-AMP dianion|2-hydroxyadenosine 5'-phosphate dianion 2-hydroxy-5'-O-phosphonatoadenosine 2-hydroxy-5'-O-phosphonatoadenosine|2-hydroxy-AMP|2-hydroxy-AMP dianion|2-hydroxyadenosine 5'-phosphate dianion http://purl.obolibrary.org/obo/CHEBI_169971 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:169974 biolink:ChemicalEntity O(6)-methyl-dGTP(4-) pubmed:30304478 Graph O(6)-methyl-dGTP O(6)-methyl-dGTP http://purl.obolibrary.org/obo/CHEBI_169974 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:169975 biolink:ChemicalEntity O(6)-methyl-dGMP(2-) pubmed:30304478 Graph O(6)-methyl-dGMP O(6)-methyl-dGMP http://purl.obolibrary.org/obo/CHEBI_169975 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:169976 biolink:ChemicalEntity N(6)-methyl-dAMP(2-) Graph N(6)-methyl-dAMP N(6)-methyl-dAMP http://purl.obolibrary.org/obo/CHEBI_169976 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:169979 biolink:ChemicalEntity (+)-trans-isopiperitenol pubmed:15200648 Graph (1R,6S)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1R,6S)-isopiperitenol|(1R,6S)-p-mentha-1,8-dien-3-ol (1R,6S)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1R,6S)-p-mentha-1,8-dien-3-ol (1R,6S)-3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|(1R,6S)-isopiperitenol|(1R,6S)-p-mentha-1,8-dien-3-ol http://purl.obolibrary.org/obo/CHEBI_169979 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:16998 biolink:ChemicalEntity D-phenylalanine The D-enantiomer of phenylalanine. cas:673-06-3|drugbank:DB02556|ecmdb:ECMDB20144|gmelin:83219|kegg.compound:C02265|metacyc.compound:CPD-216|pdb-ccd:DPN|pubmed:22382026|pubmed:22397264|pubmed:24464217|pubmed:7114516|reaxys:2804068|ymdb:YMDB00995 Graph (2R)-2-amino-3-phenylpropanoic acid|D-PHENYLALANINE|D-Phe|D-Phenylalanine|D-alpha-Amino-beta-phenylpropionic acid|D-phenylalanine|DPN|phenylalanine D-form (2R)-2-amino-3-phenylpropanoic acid|D-PHENYLALANINE|D-Phenylalanine|D-phenylalanine (2R)-2-amino-3-phenylpropanoic acid|D-PHENYLALANINE|D-Phe|D-Phenylalanine|D-alpha-Amino-beta-phenylpropionic acid|D-phenylalanine|DPN|phenylalanine D-form http://purl.obolibrary.org/obo/CHEBI_16998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17000 biolink:ChemicalEntity tropate A hydroxy monocarboxylic acid anion that results from the deprotonation of the carboxylic acid group of tropic acid. cas:529-64-6|cas:552-63-6|gmelin:329096|kegg.compound:C01456|metacyc.compound:TROPATE Graph 3-hydroxy-2-phenylpropanoate|tropate 3-hydroxy-2-phenylpropanoate 3-hydroxy-2-phenylpropanoate|tropate http://purl.obolibrary.org/obo/CHEBI_17000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:170000 biolink:ChemicalEntity dilazep(2+) A tertiary ammonium ion that is the conjugate acid of dilazep resulting from the protonation of the two amino groups of the diazepane moiety. Graph 1,4-bis{3-[(3,4,5-trimethoxybenzoyl)oxy]propyl}-1,4-diazepane-1,4-diium|1,4-bis{3-[(3,4,5-trimethoxybenzoyl)oxy]propyl}-1,4-diazepanediium|dilazep dication 1,4-bis{3-[(3,4,5-trimethoxybenzoyl)oxy]propyl}-1,4-diazepanediium 1,4-bis{3-[(3,4,5-trimethoxybenzoyl)oxy]propyl}-1,4-diazepane-1,4-diium|1,4-bis{3-[(3,4,5-trimethoxybenzoyl)oxy]propyl}-1,4-diazepanediium|dilazep dication http://purl.obolibrary.org/obo/CHEBI_170000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:170005 biolink:ChemicalEntity 6-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine A member of the class of pyrrolopyrimidines that is 7H-pyrrolo[2,3-d]pyrimidine substituted by (1-phenylethyl)amino and 4-[(4-ethylpiperazin-1-yl)methyl]phenyl groups at positions 4 and 6, respectively. cas:1155336-34-7 Graph 6-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine 6-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine 6-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine http://purl.obolibrary.org/obo/CHEBI_170005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17001 biolink:ChemicalEntity 7,8-dihydroneopterin A neopterin where positions C-7 and C-8 have been hydrogenated. beilstein:7096689|beilstein:8572370|cas:1218-98-0|drugbank:DB04425|hmdb:HMDB0002275|kegg.compound:C04874|knapsack:C00007312|metacyc.compound:DIHYDRO-NEO-PTERIN|pdb-ccd:NPR|pubmed:12804528|pubmed:22770225|reaxys:2291612 Graph 2-AMINO-7,8-DIHYDRO-6-(1,2,3-TRIHYDROXYPROPYL)-4(1H)-PTERIDINONE|2-Amino-4-hydroxy-6-(D-erythro-1,2,3-trihydroxypropyl)-7,8-dihydropteridine|2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-7,8-dihydropteridin-4(3H)-one|7,8-Dihydroneopterin|7,8-dihydroneopterin|Dihydroneopterin 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-7,8-dihydropteridin-4(3H)-one 2-AMINO-7,8-DIHYDRO-6-(1,2,3-TRIHYDROXYPROPYL)-4(1H)-PTERIDINONE|2-Amino-4-hydroxy-6-(D-erythro-1,2,3-trihydroxypropyl)-7,8-dihydropteridine|2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-7,8-dihydropteridin-4(3H)-one|7,8-Dihydroneopterin|7,8-dihydroneopterin|Dihydroneopterin http://purl.obolibrary.org/obo/CHEBI_17001 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:170010 biolink:ChemicalEntity EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor A DNA polymerase inhibitor that interferes with the action of a RNA-directed RNA polymerase (EC 2.7.7.48). wikipedia.en:RNA-dependent_RNA_polymerase Graph 3D polymerase inhibitor|3D polymerase inhibitors|EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitors|EC 2.7.7.48 inhibitor|EC 2.7.7.48 inhibitors|PB1 proteins inhibitor|PB1 proteins inhibitors|PB2 proteins inhibitor|PB2 proteins inhibitors|Q-beta replicase inhibitor|Q-beta replicase inhibitors|RDRP inhibitor|RDRP inhibitors|RNA nucleotidyltransferase (RNA-directed) inhibitor|RNA nucleotidyltransferase (RNA-directed) inhibitors|RNA replicase inhibitor|RNA replicase inhibitors|RNA synthetase inhibitor|RNA synthetase inhibitors|RNA transcriptase inhibitor|RNA transcriptase inhibitors|RNA-dependent RNA polymerase inhibitor|RNA-dependent RNA polymerase inhibitors|RNA-dependent RNA replicase inhibitor|RNA-dependent RNA replicase inhibitors|RNA-dependent ribonucleate nucleotidyltransferase inhibitor|RNA-dependent ribonucleate nucleotidyltransferase inhibitors|RNA-directed RNA polymerase inhibitor|RNA-directed RNA polymerase inhibitors|phage f2 replicase inhibitor|phage f2 replicase inhibitors|polymerase L inhibitor|polymerase L inhibitors|ribonucleic acid replicas inhibitor|ribonucleic acid replicas inhibitors|ribonucleic acid-dependent ribonucleate nucleotidyltransferase inhibitor|ribonucleic acid-dependent ribonucleate nucleotidyltransferase inhibitors|ribonucleic acid-dependent ribonucleic acid polymeras inhibitor|ribonucleic acid-dependent ribonucleic acid polymeras inhibitors|ribonucleic replicase inhibitor|ribonucleic replicase inhibitors|ribonucleic synthetase inhibitor|ribonucleic synthetase inhibitors 3D polymerase inhibitor|3D polymerase inhibitors|EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitors|EC 2.7.7.48 inhibitor|EC 2.7.7.48 inhibitors|PB1 proteins inhibitor|PB1 proteins inhibitors|PB2 proteins inhibitor|PB2 proteins inhibitors|Q-beta replicase inhibitor|Q-beta replicase inhibitors|RDRP inhibitor|RDRP inhibitors|RNA nucleotidyltransferase (RNA-directed) inhibitor|RNA nucleotidyltransferase (RNA-directed) inhibitors|RNA replicase inhibitor|RNA replicase inhibitors|RNA synthetase inhibitor|RNA synthetase inhibitors|RNA transcriptase inhibitor|RNA transcriptase inhibitors|RNA-dependent RNA polymerase inhibitor|RNA-dependent RNA polymerase inhibitors|RNA-dependent RNA replicase inhibitor|RNA-dependent RNA replicase inhibitors|RNA-dependent ribonucleate nucleotidyltransferase inhibitor|RNA-dependent ribonucleate nucleotidyltransferase inhibitors|RNA-directed RNA polymerase inhibitor|RNA-directed RNA polymerase inhibitors|phage f2 replicase inhibitor|phage f2 replicase inhibitors|polymerase L inhibitor|polymerase L inhibitors|ribonucleic acid replicas inhibitor|ribonucleic acid replicas inhibitors|ribonucleic acid-dependent ribonucleate nucleotidyltransferase inhibitor|ribonucleic acid-dependent ribonucleate nucleotidyltransferase inhibitors|ribonucleic acid-dependent ribonucleic acid polymeras inhibitor|ribonucleic acid-dependent ribonucleic acid polymeras inhibitors|ribonucleic replicase inhibitor|ribonucleic replicase inhibitors|ribonucleic synthetase inhibitor|ribonucleic synthetase inhibitors http://purl.obolibrary.org/obo/CHEBI_170010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17002 biolink:ChemicalEntity cholesteryl ester A sterol ester obtained by formal condensation of the carboxy group of any carboxylic acid with the 3-hydroxy group of cholesterol. kegg.compound:C02530|pubmed:2474544 Graph Cholesterol ester|a cholesterol ester|cholesterol esters|cholesteryl esters Cholesterol ester|a cholesterol ester|cholesterol esters|cholesteryl esters http://purl.obolibrary.org/obo/CHEBI_17002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17008 biolink:ChemicalEntity N(2)-acyl-L-glutamine A N-acyl-L-amino acid that is L-glutamine in which one of the hydrogens attached to the α-amino group is replaced by an acyl group. kegg.compound:C02716 Graph http://purl.obolibrary.org/obo/CHEBI_17008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17009 biolink:ChemicalEntity GDP-L-fucose A GDP-fucose in which the fucosyl residue has L-configuration. chemspider:388350|foodb.food:FDB021816|hmdb:HMDB0001095|kegg.compound:C00325|kegg.glycan:G10615|knapsack:C00007245|pubmed:14686921|pubmed:17111133|pubmed:20035716|pubmed:21538115|pubmed:23774504|pubmed:27588459|pubmed:29050879|pubmed:29186469|pubmed:31134391 Graph GDP-L-fucose|guanosine 5'-[3-(6-deoxy-L-galactopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(6-deoxy-L-galactopyranosyl) dihydrogen diphosphate] GDP-L-fucose|guanosine 5'-[3-(6-deoxy-L-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17010 biolink:ChemicalEntity S-inosyl-L-homocysteine L-homocysteine substituted at sulfur by a 5'-deoxyinosin-5'-yl group. beilstein:1185800|kegg.compound:C03431|pdb-ccd:SIB Graph S-(5'-deoxyinosin-5'-yl)-L-homocysteine|S-Inosyl-L-homocysteine S-(5'-deoxyinosin-5'-yl)-L-homocysteine S-(5'-deoxyinosin-5'-yl)-L-homocysteine|S-Inosyl-L-homocysteine http://purl.obolibrary.org/obo/CHEBI_17010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17011 biolink:ChemicalEntity 5-dehydro-D-fructose A hexose obtained by selective dehydration at the 5-position of D-fructose. cas:1684-29-3|kegg.compound:C00273|reaxys:1709912 Graph 5-Dehydro-D-fructose|5-Ketofructose|5-dehydro-D-fructose|5-keto-D-fructose|D-threo-2,5-Hexodiulose|D-threo-hexo-2,5-diulose D-threo-hexo-2,5-diulose 5-Dehydro-D-fructose|5-Ketofructose|5-dehydro-D-fructose|5-keto-D-fructose|D-threo-2,5-Hexodiulose|D-threo-hexo-2,5-diulose http://purl.obolibrary.org/obo/CHEBI_17011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17012 biolink:ChemicalEntity N-acetylneuraminic acid An N-acylneuraminic acid where the N-acyl group is specified as acetyl. beilstein:2951361|cas:131-48-6|glygen:G81533KY|glytoucan:G81533KY|kegg.compound:C00270|knapsack:C00019584|pubmed:14960498|pubmed:16209099|pubmed:16624269|pubmed:18487279|pubmed:19329108|pubmed:7508418|pubmed:8448384|reaxys:1398688|wikipedia.en:N-acetylneuraminic_acid Graph 5-Acetamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|Aceneuramic acid|N-Acetylneuraminic acid|Neu5Ac|NeuAc|O-sialic acid|aceneuramic acid|acide aceneuramique|acidium aceneuramicum|acido aceneuramico 5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid 5-Acetamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosonic acid|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|Aceneuramic acid|N-Acetylneuraminic acid|Neu5Ac|NeuAc|O-sialic acid|aceneuramic acid|acide aceneuramique|acidium aceneuramicum|acido aceneuramico http://purl.obolibrary.org/obo/CHEBI_17012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17013 biolink:ChemicalEntity dTMP The neutral species of thymidine 5'-monophosphate (2'-deoxythymidine 5'-monophosphate). beilstein:47541|cas:365-07-1|drugbank:DB01643|hmdb:HMDB0001227|kegg.compound:C00364|knapsack:C00019637|pdb-ccd:TMPdF10|pdb-ccd:TdF10|pubmed:22512654|pubmed:22761426|pubmed:23149755|pubmed:23288848|pubmed:23362972|pubmed:23501933|pubmed:23518161|pubmed:2559771|pubmed:7110140|pubmed:8647821|reaxys:47541|wikipedia.en:Thymidine_monophosphate Graph (dT)1|2'-deoxy-5-methyluridine 5'-(dihydrogen phosphate)|5'-TMP|5'-Thymidylic acid|5'-thymidylic acid|5-methyl-dUMP|THYMIDINE-5'-PHOSPHATE|TMP|Thymidine 5'-phosphate|Thymidine monophosphate|Thymidylate|Thymidylic acid|deoxyribosylthymine monophosphate|ribothymidine 5'-monophosphate|thymidine 5'-(dihydrogen phosphate)|thymidine 5'-phosphoric acid|thymidine-5'-monophosphoric acid 2'-deoxy-5-methyluridine 5'-(dihydrogen phosphate)|5'-Thymidylic acid|5'-thymidylic acid (dT)1|2'-deoxy-5-methyluridine 5'-(dihydrogen phosphate)|5'-TMP|5'-Thymidylic acid|5'-thymidylic acid|5-methyl-dUMP|THYMIDINE-5'-PHOSPHATE|TMP|Thymidine 5'-phosphate|Thymidine monophosphate|Thymidylate|Thymidylic acid|deoxyribosylthymine monophosphate|ribothymidine 5'-monophosphate|thymidine 5'-(dihydrogen phosphate)|thymidine 5'-phosphoric acid|thymidine-5'-monophosphoric acid http://purl.obolibrary.org/obo/CHEBI_17013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17015 biolink:ChemicalEntity riboflavin D-Ribitol in which the hydroxy group at position 5 is substituted by a 7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl moiety. It is a nutritional factor found in milk, eggs, malted barley, liver, kidney, heart, and leafy vegetables, but the richest natural source is yeast. The free form occurs only in the retina of the eye, in whey, and in urine; its principal forms in tissues and cells are as flavin mononucleotide and flavin-adenine dinucleotide. cas:83-88-5|chemspider:431981|drugbank:DB00140|drugcentral:2834|foodb.food:FDB012160|hmdb:HMDB0000244|kegg.compound:C00255|kegg.drug:D00050|knapsack:C00001552|lincs.smallmolecule:LSM-4084|metacyc.compound:RIBOFLAVIN|patent:US2807611|patent:US2876169|pdb-ccd:RBF|pubmed:10566553|pubmed:11399071|pubmed:11606856|pubmed:12083520|pubmed:12354259|pubmed:12927541|pubmed:14963913|pubmed:16273338|pubmed:16460756|pubmed:16658098|pubmed:182198|pubmed:18832377|pubmed:19169240|pubmed:19212411|pubmed:19854891|pubmed:22770225|pubmed:2369885|pubmed:23818044|pubmed:24643482|pubmed:24816110|pubmed:25108762|pubmed:25468971|pubmed:25887755|pubmed:2631092|pubmed:29937405|pubmed:3142982|pubmed:33154451|pubmed:33304888|pubmed:33886098|pubmed:33892358|pubmed:34156642|pubmed:3592624|pubmed:3878498|pubmed:4019261|pubmed:6475825|pubmed:6546833|pubmed:6650303|pubmed:7101408|pubmed:7883462|pubmed:8487103|pubmed:8604671|pubmed:8678471|pubmed:8976642|pubmed:9184778|pubmed:9808225|pubmed:9874201|reaxys:97831|wikipedia.en:Riboflavin Graph 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)pentitol|5-deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|6,7-dimethyl-9-D-ribitylisoalloxazine|7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione|7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine|7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4(3H,10H)-dione|7,8-dimethyl-10-ribitylisoalloxazine|Aqua-Flave|Beflavin|Beflavine|Bisulase|Dermadram|E101|Fiboflavin|Flavaxin|Flavin Bb|Flaxain|Hyflavin|Vitamin B2|lactoflavin|riboflavin|riboflavin (vit B2)|riboflavina|riboflavine|riboflavinum|vitamin B2|vitamin G|vitasan B2 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)pentitol|5-deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|6,7-dimethyl-9-D-ribitylisoalloxazine|7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione|7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine|7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4(3H,10H)-dione|7,8-dimethyl-10-ribitylisoalloxazine|Aqua-Flave|Beflavin|Beflavine|Bisulase|Dermadram|E101|Fiboflavin|Flavaxin|Flavin Bb|Flaxain|Hyflavin|Vitamin B2|lactoflavin|riboflavin|riboflavin (vit B2)|riboflavina|riboflavine|riboflavinum|vitamin B2|vitamin G|vitasan B2 http://purl.obolibrary.org/obo/CHEBI_17015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17016 biolink:ChemicalEntity L-methionine S-oxide beilstein:1723794|cas:3226-65-1|kegg.compound:C02989 Graph (2S)-2-amino-4-(methylsulfinyl)butanoic acid|L-Methionine S-oxide|L-methionine S-oxide|L-methionine sulfoxide|methionine S-oxide (2S)-2-amino-4-(methylsulfinyl)butanoic acid|L-Methionine S-oxide|L-methionine S-oxide (2S)-2-amino-4-(methylsulfinyl)butanoic acid|L-Methionine S-oxide|L-methionine S-oxide|L-methionine sulfoxide|methionine S-oxide http://purl.obolibrary.org/obo/CHEBI_17016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17019 biolink:ChemicalEntity (R)-amygdalin An amygdalin in which the stereocentre on the cyanohydrin function has R-configuration. cas:29883-15-6|hmdb:HMDB0035030|kegg.compound:C08325|knapsack:C00001437|metacyc.compound:CPD-1125|pubmed:10670815|pubmed:12232058|pubmed:12372866|pubmed:12428943|pubmed:12975776|pubmed:16652960|pubmed:16880611|pubmed:17359643|pubmed:20191348|pubmed:25050339|pubmed:25237385|pubmed:26431391|pubmed:26719286|pubmed:27119432|pubmed:7092570|reaxys:66856|wikipedia.en:Amygdalin Graph (-)-D-mandelonitrile beta-D-gentiobioside|(2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile|(R)-Amygdalin|(R)-Amygdaloside|(R)-Laenitrile|(R)-amygdalin|D-(-)-mandelonitrile-beta-D-gentiobioside|D-amygdalin|D-mandelonitrile-beta-D-glucosido-6-beta-D-glucoside (2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile (-)-D-mandelonitrile beta-D-gentiobioside|(2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile|(R)-Amygdalin|(R)-Amygdaloside|(R)-Laenitrile|(R)-amygdalin|D-(-)-mandelonitrile-beta-D-gentiobioside|D-amygdalin|D-mandelonitrile-beta-D-glucosido-6-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_17019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17020 biolink:ChemicalEntity glucomannan A heteroglycan consisting of β-(1→4)-linked D-glucose (G) and D-mannose (M) in a proportion of 5:8. The basic polymeric repeating unit has the pattern: GGMMGMMMMMGGM, with branching through β-(1→3)- and β-(1→6)-glucosyl linkages. Acetate groups are present on C-6 every 9-19 units of the main chain. cas:76081-94-2|kegg.compound:C01810|kegg.compound:C02101|kegg.glycan:G11598|pubmed:12356785|pubmed:12569112|pubmed:14983741|pubmed:19108925|pubmed:2840365|pubmed:6096282|pubmed:7872224|pubmed:8365697|pubmed:9742462|reaxys:11315759|reaxys:8188346 Graph (Glucomannan)n|(Glucomannan)n+1|Glucomannan|Glucomannoglycan (Glucomannan)n|(Glucomannan)n+1|Glucomannan|Glucomannoglycan http://purl.obolibrary.org/obo/CHEBI_17020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17021 biolink:ChemicalEntity S-substituted glutathione A glutathione derivative that is glutathione in which the hydrogen of the thiol has been replaced by any other group. kegg.compound:C02320 Graph R-S-Glutathione R-S-Glutathione http://purl.obolibrary.org/obo/CHEBI_17021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17023 biolink:ChemicalEntity 2-hydroxyadipic acid An adipic acid derivative having a 2-hydroxy substituent. cas:18294-85-4|kegg.compound:C02360|lipidmaps:LMFA01170049 Graph 2-Hydroxyadipate|2-Hydroxyadipic acid|2-Hydroxyhexanedioic acid|2-hydroxyhexanedioic acid 2-hydroxyhexanedioic acid 2-Hydroxyadipate|2-Hydroxyadipic acid|2-Hydroxyhexanedioic acid|2-hydroxyhexanedioic acid http://purl.obolibrary.org/obo/CHEBI_17023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17025 biolink:ChemicalEntity (S)-dihydroorotic acid The (S)-enantiomer of dihydroorotic acid that is an intermediate in the metabolism of pyridine. cas:5988-19-2|gmelin:1473795|hmdb:HMDB0003349|kegg.compound:C00337|knapsack:C00007302|metacyc.compound:DI-H-OROTATE|patent:EP0933633|patent:EP1036319|patent:HK1033171|patent:RU2228932|patent:WO9930146|pdb-ccd:DOR|pubmed:3089167|reaxys:83957 Graph (4S)-2,6-dioxohexahydropyrimidine-4-carboxylic acid|(S)-4,5-dihydroorotic acid|Dihydro-L-orotic acid|L-Dihydroorotic acid (4S)-2,6-dioxohexahydropyrimidine-4-carboxylic acid (4S)-2,6-dioxohexahydropyrimidine-4-carboxylic acid|(S)-4,5-dihydroorotic acid|Dihydro-L-orotic acid|L-Dihydroorotic acid http://purl.obolibrary.org/obo/CHEBI_17025 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17026 biolink:ChemicalEntity progesterone A C21-steroid hormone in which a pregnane skeleton carries oxo substituents at positions 3 and 20 and is unsaturated at C(4)-C(5). As a hormone, it is involved in the female menstrual cycle, pregnancy and embryogenesis of humans and other species. cas:57-83-0|drugbank:DB00396|drugcentral:2279|gmelin:708590|hmdb:HMDB0001830|kegg.compound:C00410|kegg.drug:D00066|metacyc.compound:PROGESTERONE|pdb-ccd:STR|pubmed:10438974|pubmed:9506942|reaxys:1915950|wikipedia.en:Progesterone Graph (S)-4-Pregnene-3,20-dione|(S)-Pregn-4-en-3,20-dione|(S)-Progesterone|17alpha-progesterone|4-Pregnene-3,20-dione|Agolutin|Akrolutin|Crinone|Delta(4)-pregnene-3,20-dione|Gelbkoerperhormon|PROGESTERONE|Progesteron|Progesterone|corpus luteum hormone|luteohormone|pregn-4-ene-3,20-dione|progesterone pregn-4-ene-3,20-dione (S)-4-Pregnene-3,20-dione|(S)-Pregn-4-en-3,20-dione|(S)-Progesterone|17alpha-progesterone|4-Pregnene-3,20-dione|Agolutin|Akrolutin|Crinone|Delta(4)-pregnene-3,20-dione|Gelbkoerperhormon|PROGESTERONE|Progesteron|Progesterone|corpus luteum hormone|luteohormone|pregn-4-ene-3,20-dione|progesterone http://purl.obolibrary.org/obo/CHEBI_17026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17027 biolink:ChemicalEntity allysine An α-amino acid consisting of lysine having an oxo group in place of the side-chain amino group. beilstein:1857434|cas:1962-83-0 Graph 2-Aminoadipate 6-semialdehyde|2-amino-5-formylvaleric acid|2-amino-6-oxohexanoic acid|6-oxonorleucine|Allysine|HCO-[CH2]3-CH(NH2)-COOH|allysine|alpha-aminoadipic acid delta-semialdehyde|alpha-aminoadipic delta-semialdehyde 2-amino-6-oxohexanoic acid|Allysine|allysine 2-Aminoadipate 6-semialdehyde|2-amino-5-formylvaleric acid|2-amino-6-oxohexanoic acid|6-oxonorleucine|Allysine|HCO-[CH2]3-CH(NH2)-COOH|allysine|alpha-aminoadipic acid delta-semialdehyde|alpha-aminoadipic delta-semialdehyde http://purl.obolibrary.org/obo/CHEBI_17027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17028 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-galactonic acid The 2-dehydro-3-deoxy derivative of D-galactonic acid. kegg.compound:C01216 Graph 2-Dehydro-3-deoxy-D-galactonate|3-deoxy-D-threo-hex-2-ulosonic acid 3-deoxy-D-threo-hex-2-ulosonic acid 2-Dehydro-3-deoxy-D-galactonate|3-deoxy-D-threo-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_17028 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17029 biolink:ChemicalEntity chitin An aminoglycan consisting of β-(1→4)-linked N-acetyl-D-glucosamine residues. cas:1398-61-4|kegg.compound:C00461|kegg.glycan:G10483 Graph (1->4)-2-acetamido-2-deoxy-beta-D-glucan|Chitin|[1,4-(N-Acetyl-beta-D-glucosaminyl)]n|[4)-beta-D-GlcpNAc(1->]n|beta-1,4-Poly-N-acetyl-D-glucosamine|chitin (1->4)-2-acetamido-2-deoxy-beta-D-glucan (1->4)-2-acetamido-2-deoxy-beta-D-glucan|Chitin|[1,4-(N-Acetyl-beta-D-glucosaminyl)]n|[4)-beta-D-GlcpNAc(1->]n|beta-1,4-Poly-N-acetyl-D-glucosamine|chitin http://purl.obolibrary.org/obo/CHEBI_17029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17030 biolink:ChemicalEntity cycloartenol cas:469-38-5|foodb.food:FDB015503|hmdb:HMDB0036591|kegg.compound:C01902|knapsack:C00003650|lipidmaps:LMST01100008|metacyc.compound:CYCLOARTENOL|pubmed:12519197|pubmed:28710558|pubmed:28952245|pubmed:30610811|wikipedia.en:Cycloartenol Graph (3beta,9beta)-9,19-cyclolanost-24-en-3-ol|9beta,19-cyclo-24-lanosten-3beta-ol|Cycloartenol|cycloartenol (3beta,9beta)-9,19-cyclolanost-24-en-3-ol (3beta,9beta)-9,19-cyclolanost-24-en-3-ol|9beta,19-cyclo-24-lanosten-3beta-ol|Cycloartenol|cycloartenol http://purl.obolibrary.org/obo/CHEBI_17030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17031 biolink:ChemicalEntity chelirubine A benzophenanthridine alkaloid that is sanguinarine bearing a methoxy substituent at position 10. cas:18203-11-7|kegg.compound:C06327|knapsack:C00001821|knapsack:C00024636|pubmed:11842172|pubmed:12357384|pubmed:12602874|pubmed:16910039|pubmed:17367981|pubmed:17549765|pubmed:1822177|pubmed:19183968|pubmed:20117181|pubmed:21512447|pubmed:4092262|reaxys:4161959 Graph 5-methoxy-13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium|Chelirubine|chelirubine 5-methoxy-13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium 5-methoxy-13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium|Chelirubine|chelirubine http://purl.obolibrary.org/obo/CHEBI_17031 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17032 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-gluconic acid The 2-dehydro-3-deoxy derivative of D-gluconic acid. cas:17510-99-5|kegg.compound:C00204|pdb-ccd:KDG|reaxys:1724592 Graph 2-Dehydro-3-deoxy-D-gluconate|2-Keto-3-deoxy-D-gluconate|2-dehydro-3-deoxy-D-gluconate|3-Deoxy-2-oxo-D-gluconate|3-deoxy-D-erythro-2-hexulosonic acid|3-deoxy-D-erythro-hex-2-ulosonic acid 3-deoxy-D-erythro-hex-2-ulosonic acid 2-Dehydro-3-deoxy-D-gluconate|2-Keto-3-deoxy-D-gluconate|2-dehydro-3-deoxy-D-gluconate|3-Deoxy-2-oxo-D-gluconate|3-deoxy-D-erythro-2-hexulosonic acid|3-deoxy-D-erythro-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_17032 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17033 biolink:ChemicalEntity biliverdin A linear tetrapyrrole produced in the reticuloendothelial system by the first step of heme degradation, catalysed by heme oxygenase. cas:114-25-0|drugbank:DB02073|hmdb:HMDB0001008|kegg.compound:C00500|pdb-ccd:BLA|pubmed:14977878|pubmed:19617398|reaxys:74351|wikipedia.en:Biliverdin Graph 8,12-bis(2-carboxyethyl)-2,7,13,17-tetramethyl-3,18-divinylbilin-1(19)(21H,24H)-dione|BILIVERDINE IX ALPHA|Biliverdin|Biliverdin IX alpha|Biliverdin IXalpha|Biliverdine|biliverdin Biliverdin|biliverdin 8,12-bis(2-carboxyethyl)-2,7,13,17-tetramethyl-3,18-divinylbilin-1(19)(21H,24H)-dione|BILIVERDINE IX ALPHA|Biliverdin|Biliverdin IX alpha|Biliverdin IXalpha|Biliverdine|biliverdin http://purl.obolibrary.org/obo/CHEBI_17033 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17036 biolink:ChemicalEntity dibenzo[1,4]dioxine-2,3-dione beilstein:1376588|cas:6859-47-8|kegg.compound:C03861 Graph Dibenzo[1,4]dioxin-2,3-dione|Diphenylene dioxide 2,3-quinone|Diphenylenedioxide-2,3-quinone|dibenzo[1,4]dioxin-2,3-dione|dibenzo[b,e][1,4]dioxine-2,3-dione|oxanthrene-2,3-dione oxanthrene-2,3-dione Dibenzo[1,4]dioxin-2,3-dione|Diphenylene dioxide 2,3-quinone|Diphenylenedioxide-2,3-quinone|dibenzo[1,4]dioxin-2,3-dione|dibenzo[b,e][1,4]dioxine-2,3-dione|oxanthrene-2,3-dione http://purl.obolibrary.org/obo/CHEBI_17036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17037 biolink:ChemicalEntity (19E)-geissoschizine An indole alkaloid with formula C21H24N2O3. It is a biosynthetic precursor for a variety of monoterpenoid indole alkaloids. cas:439-66-7|kegg.compound:C02151|knapsack:C00051968|metacyc.compound:GEISSOSCHIZINE|pubmed:10822538|pubmed:12683825|pubmed:28467090|pubmed:28754932|pubmed:29147812|pubmed:29511102|pubmed:29575642|pubmed:29942076 Graph (+)-geissoschizine|(16Z,19E)-17-hydroxy-16-methoxycarbonyl-16,19-didehydro-corynane|(19E)-geissoschizine|19E-geissoschizine|Corynan-16-carboxylic acid, 16,17,19,20-tetradehydro-17-hydroxy-, methyl ester, (16Z,19E)-|geissoschizine|methyl (16Z,19E)-17-hydroxycoryna-16,19-dien-16-carboxylate methyl (16Z,19E)-17-hydroxycoryna-16,19-dien-16-carboxylate (+)-geissoschizine|(16Z,19E)-17-hydroxy-16-methoxycarbonyl-16,19-didehydro-corynane|(19E)-geissoschizine|19E-geissoschizine|Corynan-16-carboxylic acid, 16,17,19,20-tetradehydro-17-hydroxy-, methyl ester, (16Z,19E)-|geissoschizine|methyl (16Z,19E)-17-hydroxycoryna-16,19-dien-16-carboxylate http://purl.obolibrary.org/obo/CHEBI_17037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17038 biolink:ChemicalEntity fecosterol A 3β-sterol having a 5α-ergostane skeleton with a methylidene group at C-24 and double bonds at the C-8 and C-24(28) positions. beilstein:3220148|cas:516-86-9|kegg.compound:C04525|knapsack:C00023751|lipidmaps:LMST01030095|metacyc.compound:FECOSTEROL|pubmed:20946868|pubmed:378990 Graph 24-Methylene-5alpha-cholest-8-en-3beta-ol|24-methylene-5alpha-cholest-8-en-3beta-ol|24-methylene-cholest-8-en-3beta-ol|24-methylidene-5alpha-cholest-8-en-3beta-ol|5alpha-ergosta-8,24(28)-dien-3beta-ol|delta-8(24),28-Ergostadienol|fecosterol 24-methylidene-5alpha-cholest-8-en-3beta-ol|5alpha-ergosta-8,24(28)-dien-3beta-ol 24-Methylene-5alpha-cholest-8-en-3beta-ol|24-methylene-5alpha-cholest-8-en-3beta-ol|24-methylene-cholest-8-en-3beta-ol|24-methylidene-5alpha-cholest-8-en-3beta-ol|5alpha-ergosta-8,24(28)-dien-3beta-ol|delta-8(24),28-Ergostadienol|fecosterol http://purl.obolibrary.org/obo/CHEBI_17038 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17039 biolink:ChemicalEntity D-glucurono-6,2-lactone kegg.compound:C03387 Graph D-Glucurono-6,2-lactone|D-glucurono-6,2-lactone D-Glucurono-6,2-lactone|D-glucurono-6,2-lactone D-Glucurono-6,2-lactone|D-glucurono-6,2-lactone http://purl.obolibrary.org/obo/CHEBI_17039 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17040 biolink:ChemicalEntity (carboxymethoxy)succinic acid The carboxymethoxy derivative of succinic acid. cas:38945-27-6|kegg.compound:C03600 Graph (Carboxymethoxy) succinic acid|2-(carboxymethoxy)butanedioic acid|Carboxymethyloxysuccinate 2-(carboxymethoxy)butanedioic acid (Carboxymethoxy) succinic acid|2-(carboxymethoxy)butanedioic acid|Carboxymethyloxysuccinate http://purl.obolibrary.org/obo/CHEBI_17040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17041 biolink:ChemicalEntity (S)-N-methylcoclaurine The (S)-enantiomer of N-methylcoclaurine. cas:3423-07-2|kegg.compound:C05176|knapsack:C00025268 Graph (1S)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(S)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(S)-N-Methylcoclaurine|(S)-N-methylcoclaurine (1S)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (1S)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(S)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(S)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(S)-N-Methylcoclaurine|(S)-N-methylcoclaurine http://purl.obolibrary.org/obo/CHEBI_17041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17043 biolink:ChemicalEntity biphenyl-2-ol A member of the class of hydroxybiphenyls that is biphenyl substituted by a hydroxy group at position 2. It is generally used as a post-harvest fungicide for citrus fruits. cas:90-43-7|drugcentral:4768|hmdb:HMDB0032582|kegg.compound:C02499|kegg.drug:D08367|ppdb:1340|pubmed:14753781|pubmed:23156781|pubmed:23665931|pubmed:24525378|reaxys:606907|umbbd.compound:c0269|wikipedia.en:Biphenyl-2-ol Graph 2-Biphenylol|2-Hydroxybiphenyl|2-Phenylphenol|Orthophenyl phenol|[1,1'-biphenyl]-2-ol|biphenyl-2-ol|o-diphenylol|o-hydroxybiphenyl|o-hydroxydiphenyl|o-phenylphenol [1,1'-biphenyl]-2-ol 2-Biphenylol|2-Hydroxybiphenyl|2-Phenylphenol|Orthophenyl phenol|[1,1'-biphenyl]-2-ol|biphenyl-2-ol|o-diphenylol|o-hydroxybiphenyl|o-hydroxydiphenyl|o-phenylphenol http://purl.obolibrary.org/obo/CHEBI_17043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17044 biolink:ChemicalEntity D-glucitol 6-phosphate The 6-O-phospho derivative of D-glucitol. beilstein:1728363|cas:20479-58-7|drugbank:DB02548|kegg.compound:C01096 Graph 6-O-phosphono-D-glucitol|D-Glucitol 6-phosphate|D-Glucitol, 6-(dihydrogen phosphate)|D-Sorbitol 6-phosphate|D-glucitol 6-(dihydrogen phosphate)|Sorbitol 6-phosphate|Sorbitol-6-phosphate 6-O-phosphono-D-glucitol|D-glucitol 6-(dihydrogen phosphate) 6-O-phosphono-D-glucitol|D-Glucitol 6-phosphate|D-Glucitol, 6-(dihydrogen phosphate)|D-Sorbitol 6-phosphate|D-glucitol 6-(dihydrogen phosphate)|Sorbitol 6-phosphate|Sorbitol-6-phosphate http://purl.obolibrary.org/obo/CHEBI_17044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17045 biolink:ChemicalEntity dinitrogen oxide A nitrogen oxide consisting of linear unsymmetrical molecules with formula N2O. While it is the most used gaseous anaesthetic in the world, its major commercial use, due to its solubility under pressure in vegetable fats combined with its non-toxicity in low concentrations, is as an aerosol spray propellant and aerating agent for canisters of 'whipped' cream. cas:10024-97-2|drugcentral:4238|gmelin:2153410|kegg.compound:C00887|kegg.drug:D00102|pdb-ccd:N2O|pubmed:11159233|pubmed:11811748|pubmed:15316643|pubmed:15644008|pubmed:16179535|pubmed:17093360|pubmed:18992971|pubmed:19910265|pubmed:21622873|pubmed:23643142|pubmed:7880215|reaxys:8137358|umbbd.compound:c0650|wikipedia.en:Nitrous_oxide Graph Dinitrogen monoxide|Dinitrogen oxide|Distickstoffmonoxid|E942|Lachgas|N2O|NNO|Nitrous oxide|R-744A|Stickstoff(I)-oxid|diazyne 1-oxide|dinitrogen oxide|factitious air|gaz hilarant|laughing gas|nitrogen protoxide|nitrogenium oxydulatum|nitrous oxide|oxidodinitrogen(N--N)|oxyde nitreux|protoxyde d'azote Dinitrogen oxide|dinitrogen oxide|oxidodinitrogen(N--N) Dinitrogen monoxide|Dinitrogen oxide|Distickstoffmonoxid|E942|Lachgas|N2O|NNO|Nitrous oxide|R-744A|Stickstoff(I)-oxid|diazyne 1-oxide|dinitrogen oxide|factitious air|gaz hilarant|laughing gas|nitrogen protoxide|nitrogenium oxydulatum|nitrous oxide|oxidodinitrogen(N--N)|oxyde nitreux|protoxyde d'azote http://purl.obolibrary.org/obo/CHEBI_17045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17048 biolink:ChemicalEntity nororientaline An isoquinoline alkaloid consisting of a tetrahydroisoquinoline core with 4-hydroxy-3-methoxybenzyl, methoxy and hydroxy substituents at positions 1, 6 and 7 respectively; major species at pH 7.3. beilstein:314888|kegg.compound:C05317 Graph 1-(4-hydroxy-3-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|Nororientaline 1-(4-hydroxy-3-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol 1-(4-hydroxy-3-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|Nororientaline http://purl.obolibrary.org/obo/CHEBI_17048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17049 biolink:ChemicalEntity 6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol A glucosaminylphosphatidylinositol compound consisting of D-glucosamine joined to 1-phosphatidyl-1D-myo-inositol via a (1→6)-α-linkage. kegg.compound:C04248|kegg.glycan:G00144 Graph 6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol|D-Glucosaminylphosphatidylinositol 6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol|D-Glucosaminylphosphatidylinositol http://purl.obolibrary.org/obo/CHEBI_17049 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17050 biolink:ChemicalEntity 3-phosphoglyceric acid A monophosphoglyceric acid having the phospho group at the 3-position. It is an intermediate in metabolic pathways like glycolysis and calvin cycle. cas:820-11-1|chemspider:704|drugbank:DB04510|hmdb:HMDB0000807|kegg.compound:C00597|knapsack:C00007286|pubmed:17439666|pubmed:22735334|reaxys:1726829|wikipedia.en:3-Phosphoglyceric_acid Graph 2-hydroxy-3-(phosphonooxy)propanoic acid|3-(dihydrogen phosphate)Glycerate|3-(dihydrogen phosphate)Glyceric acid|3-Phosphoglycerate|DL-Glycerate 3-phosphate|Glycerate 3-phosphate|Glyceric acid 3-phosphate|glycerate 3-phosphates 2-hydroxy-3-(phosphonooxy)propanoic acid 2-hydroxy-3-(phosphonooxy)propanoic acid|3-(dihydrogen phosphate)Glycerate|3-(dihydrogen phosphate)Glyceric acid|3-Phosphoglycerate|DL-Glycerate 3-phosphate|Glycerate 3-phosphate|Glyceric acid 3-phosphate|glycerate 3-phosphates http://purl.obolibrary.org/obo/CHEBI_17050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17051 biolink:ChemicalEntity fluoride cas:16984-48-8|gmelin:14905|kegg.compound:C00742|pdb-ccd:F Graph F(-)|F-|FLUORIDE ION|Fluoride|Fluoride ion|Fluorine anion|fluoride|fluoride(1-) Fluoride|fluoride|fluoride(1-) F(-)|F-|FLUORIDE ION|Fluoride|Fluoride ion|Fluorine anion|fluoride|fluoride(1-) http://purl.obolibrary.org/obo/CHEBI_17051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17052 biolink:ChemicalEntity 3-phosphoshikimic acid drugbank:DB04328|kegg.compound:C03175|knapsack:C00000002|pdb-ccd:S3P Graph Shikimate 3-phosphate|Shikimate 5-phosphate|rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid Shikimate 3-phosphate|Shikimate 5-phosphate|rel-(3R,4S,5R)-4,5-dihydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_17052 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17053 biolink:ChemicalEntity L-aspartic acid The L-enantiomer of aspartic acid. cas:56-84-8|drugbank:DB00128|drugcentral:1550|ecmdb:ECMDB00191|gmelin:3333|hmdb:HMDB0000191|kegg.compound:C00049|kegg.drug:D00013|knapsack:C00001342|metacyc.compound:L-ASPARTATE|pdb-ccd:ASP|pubmed:11568288|pubmed:21359215|pubmed:22770225|reaxys:1723530|ymdb:YMDB00896 Graph (2S)-2-aminobutanedioic acid|(S)-2-aminobutanedioic acid|(S)-2-aminosuccinic acid|2-Aminosuccinic acid|ASPARTIC ACID|Asp|D|L-Asparaginsaeure|L-Aspartic acid|L-aspartic acid (2S)-2-aminobutanedioic acid|ASPARTIC ACID|L-Aspartic acid|L-aspartic acid (2S)-2-aminobutanedioic acid|(S)-2-aminobutanedioic acid|(S)-2-aminosuccinic acid|2-Aminosuccinic acid|ASPARTIC ACID|Asp|D|L-Asparaginsaeure|L-Aspartic acid|L-aspartic acid http://purl.obolibrary.org/obo/CHEBI_17053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17056 biolink:ChemicalEntity 1-carboxyvinyl carboxyphosphonate An organic phosphonate having O-1-carboxyvinyl and C-carboxy substituents. kegg.compound:C06367|knapsack:C00000783 Graph 1-Carboxyvinyl carboxyphosphonate|1-carboxyethenyl hydrogen carboxyphosphonate|Carboxyphosphonoenolpyruvate 1-carboxyethenyl hydrogen carboxyphosphonate 1-Carboxyvinyl carboxyphosphonate|1-carboxyethenyl hydrogen carboxyphosphonate|Carboxyphosphonoenolpyruvate http://purl.obolibrary.org/obo/CHEBI_17056 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17057 biolink:ChemicalEntity cellobiose A glycosylglucose consisting of two glucose units linked via a β(1→4) bond. beilstein:1292744|cas:528-50-7|drugbank:DB02061|kegg.compound:C00185|knapsack:C00001134|pubmed:19669625|pubmed:19968554|wikipedia.en:Cellobiose Graph 1-beta-D-Glucopyranosyl-4-D-glucopyranose|4-(beta-D-glucosido)-D-glucose|4-O-beta-D-glucopyranosyl-D-glucopyranose|4-beta-D-glucopyranosyl-D-glucopyranose|Cellobiose|D-(+)-cellobiose|D-celiobiose|D-cellobiose|D-glucosyl-beta-(1-4)-D-glucose|beta-D-glucopyranosyl-(1->4)-D-glucopyranose|cellose beta-D-glucopyranosyl-(1->4)-D-glucopyranose 1-beta-D-Glucopyranosyl-4-D-glucopyranose|4-(beta-D-glucosido)-D-glucose|4-O-beta-D-glucopyranosyl-D-glucopyranose|4-beta-D-glucopyranosyl-D-glucopyranose|Cellobiose|D-(+)-cellobiose|D-celiobiose|D-cellobiose|D-glucosyl-beta-(1-4)-D-glucose|beta-D-glucopyranosyl-(1->4)-D-glucopyranose|cellose http://purl.obolibrary.org/obo/CHEBI_17057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17058 biolink:ChemicalEntity 3-dehydroecdysone cas:39750-00-0|kegg.compound:C02513 Graph (22R)-2beta,14,22,25-tetrahydroxy-5beta-cholest-7-ene-3,6-dione|(2beta,5beta,22R)-2,14,22,25-tetrahydroxy-cholest-7-ene-3,6-dione|3-Dehydroecdysone|3-dehydroecdysone (22R)-2beta,14,22,25-tetrahydroxy-5beta-cholest-7-ene-3,6-dione (22R)-2beta,14,22,25-tetrahydroxy-5beta-cholest-7-ene-3,6-dione|(2beta,5beta,22R)-2,14,22,25-tetrahydroxy-cholest-7-ene-3,6-dione|3-Dehydroecdysone|3-dehydroecdysone http://purl.obolibrary.org/obo/CHEBI_17058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17059 biolink:ChemicalEntity 2-methylcholine beilstein:1738004|cas:7562-87-0|gmelin:362803|kegg.compound:C02224 Graph 2-Methylcholine|2-hydroxy-N,N,N-trimethylpropanaminium|2-methylcholine|beta-Methylcholine|beta-methylcholine 2-hydroxy-N,N,N-trimethylpropanaminium 2-Methylcholine|2-hydroxy-N,N,N-trimethylpropanaminium|2-methylcholine|beta-Methylcholine|beta-methylcholine http://purl.obolibrary.org/obo/CHEBI_17059 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17061 biolink:ChemicalEntity D-glutamine The D-enantiomer of glutamine. cas:5959-95-5|drugbank:DB02174|ecmdb:ECMDB03423|gmelin:1318700|hmdb:HMDB0003423|kegg.compound:C00819|metacyc.compound:GLUTAMIDE|patent:WO2011109119|pdb-ccd:DGN|pubmed:21048866|pubmed:21182880|pubmed:22291598|pubmed:3697715|pubmed:7197365|reaxys:1723796|ymdb:YMDB00990 Graph (2R)-2,5-diamino-5-oxopentanoic acid|(2R)-2-amino-4-carbamoylbutanoic acid|(R)-2,5-diamino-5-oxopentanoic acid|D-2-Aminoglutaramic acid|D-Glutamin|D-Glutamine|D-Glutaminsaeure-5-amid|D-glutamine|DGN D-Glutamine|D-glutamine (2R)-2,5-diamino-5-oxopentanoic acid|(2R)-2-amino-4-carbamoylbutanoic acid|(R)-2,5-diamino-5-oxopentanoic acid|D-2-Aminoglutaramic acid|D-Glutamin|D-Glutamine|D-Glutaminsaeure-5-amid|D-glutamine|DGN http://purl.obolibrary.org/obo/CHEBI_17061 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17062 biolink:ChemicalEntity primary aliphatic amine kegg.compound:C00375 Graph RCH2NH2|primary aliphatic amines RCH2NH2|primary aliphatic amines http://purl.obolibrary.org/obo/CHEBI_17062 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17063 biolink:ChemicalEntity L-erythrulose 1-phosphate The L-enantiomer of erythrulose 1-phosphate. beilstein:1711143|cas:16409-92-0|kegg.compound:C03394 Graph (3S)-3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|(S)-3,4-dihydroxy-1-(phosphonooxy)-2-butanone|Erythrulose 1-phosphate|L-erythrulose 1-(dihydrogen phosphate) (3S)-3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|L-erythrulose 1-(dihydrogen phosphate) (3S)-3,4-dihydroxy-2-oxobutyl dihydrogen phosphate|(S)-3,4-dihydroxy-1-(phosphonooxy)-2-butanone|Erythrulose 1-phosphate|L-erythrulose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17064 biolink:ChemicalEntity 4-nitroaniline A nitroaniline carrying a nitro group at position 4. cas:100-01-6|gmelin:27331|kegg.compound:C02126|metacyc.compound:4-NITROANILINE|pdb-ccd:NIT|pubmed:23090935|pubmed:24116023|reaxys:508690|wikipedia.en:4-Nitroaniline Graph 1-amino-4-nitrobenzene|4-NITROANILINE|4-Nitroaniline|4-Nitrobenzeneamine|4-nitraniline|4-nitroaniline|p-Nitroaniline|p-aminonitrobenzene|p-nitraniline|p-nitrophenylamine 4-NITROANILINE|4-Nitroaniline|4-nitroaniline 1-amino-4-nitrobenzene|4-NITROANILINE|4-Nitroaniline|4-Nitrobenzeneamine|4-nitraniline|4-nitroaniline|p-Nitroaniline|p-aminonitrobenzene|p-nitraniline|p-nitrophenylamine http://purl.obolibrary.org/obo/CHEBI_17064 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17065 biolink:ChemicalEntity 3',5'-cyclic CMP A 3',5'-cyclic pyrimidine nucleotide having cytosine as the nucleobase. cas:3616-08-8|kegg.compound:C00941|pdb-ccd:CC7|pubmed:25017019|pubmed:25062586|reaxys:625833|ymdb:YMDB00455 Graph 3',5'-Cyclic CMP|Cyclic cmp|Cytidine 3',5'-cyclic monophosphate|Cytidine, cyclic 3',5'-(hydrogen phosphate)|cCMP|cytidine 3',5'-(hydrogen phosphate) cytidine 3',5'-(hydrogen phosphate) 3',5'-Cyclic CMP|Cyclic cmp|Cytidine 3',5'-cyclic monophosphate|Cytidine, cyclic 3',5'-(hydrogen phosphate)|cCMP|cytidine 3',5'-(hydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17065 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17066 biolink:ChemicalEntity (R)-3-hydroxybutyric acid The R-enantiomer of 3-hydroxybutyric acid. Involved in the synthesis and degradation of ketone bodies, it can be used as an energy source by the brain during hypoglycaemia, and for the synthesis of biodegradable plastics. It is a sex pheremone in the European spider Linyphia triangularis. cas:625-72-9|hmdb:HMDB0000011|kegg.compound:C01089|lipidmaps:LMFA01050243|metacyc.compound:CPD-335|patent:WO9312254|pubmed:17810206|pubmed:19304817|pubmed:20699574|pubmed:3679704|reaxys:1720568 Graph (3R)-3-hydroxybutanoic acid|(R)-(-)-beta-hydroxybutyric acid|(R)-3-Hydroxybutanoic acid|(R)-3-Hydroxybutyric acid|3-D-hydroxybutyric acid|D-3-hydroxybutyric acid (3R)-3-hydroxybutanoic acid (3R)-3-hydroxybutanoic acid|(R)-(-)-beta-hydroxybutyric acid|(R)-3-Hydroxybutanoic acid|(R)-3-Hydroxybutyric acid|3-D-hydroxybutyric acid|D-3-hydroxybutyric acid http://purl.obolibrary.org/obo/CHEBI_17066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17069 biolink:ChemicalEntity 3-hydroxybenzyl alcohol A hydroxybenzyl alcohol that is phenol substituted at position C-3 by a hydroxymethyl group. cas:620-24-6|kegg.compound:C03351|knapsack:C00000776|pubmed:22770225|reaxys:2041500|umbbd.compound:c0054 Graph 3-(hydroxymethyl)phenol|3-Hydroxybenzenemethanol|3-Hydroxybenzyl alcohol|3-hydroxybenzyl alcohol 3-(hydroxymethyl)phenol 3-(hydroxymethyl)phenol|3-Hydroxybenzenemethanol|3-Hydroxybenzyl alcohol|3-hydroxybenzyl alcohol http://purl.obolibrary.org/obo/CHEBI_17069 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17071 biolink:ChemicalEntity glycolaldehyde The glycolaldehyde derived from ethylene glycol. The parent of the class of glycolaldehydes. cas:141-46-8|ecmdb:ECMDB02165|foodb.food:FDB030893|hmdb:HMDB0003344|kegg.compound:C00266|knapsack:C00007457|metacyc.compound:GLYCOLALDEHYDE|pdb-ccd:DW3|pubmed:20960220|pubmed:21378371|pubmed:21472960|pubmed:21820089|pubmed:23543734|pubmed:29400466|pubmed:35348319|pubmed:35624799|reaxys:506029|wikipedia.en:Glycolaldehyde|ymdb:YMDB00343 Graph GLYCOALDEHYDE|Glycolaldehyde|Glycolic aldehyde|Hydroxyacetaldehyde|Methylol formaldehyde|Monomethylolformaldehyde|glycolaldehyde|glycollaldehyde|hydroxyacetaldehyde Hydroxyacetaldehyde|hydroxyacetaldehyde GLYCOALDEHYDE|Glycolaldehyde|Glycolic aldehyde|Hydroxyacetaldehyde|Methylol formaldehyde|Monomethylolformaldehyde|glycolaldehyde|glycollaldehyde|hydroxyacetaldehyde http://purl.obolibrary.org/obo/CHEBI_17071 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17072 biolink:ChemicalEntity N-amidino-L-aspartic acid An aspartic acid derivative comprising L-aspartic acid carrying an N-amidino substituent. cas:6133-30-8|kegg.compound:C03139|reaxys:1726856 Graph (2S)-2-carbamimidamidobutanedioic acid|Guanidinosuccinic acid|L-N-amidinoaspartic acid|N-(aminoiminomethyl)-L-aspartic acid|N-Amidino-L-aspartic acid|N-carbamimidoyl-L-aspartic acid N-carbamimidoyl-L-aspartic acid (2S)-2-carbamimidamidobutanedioic acid|Guanidinosuccinic acid|L-N-amidinoaspartic acid|N-(aminoiminomethyl)-L-aspartic acid|N-Amidino-L-aspartic acid|N-carbamimidoyl-L-aspartic acid http://purl.obolibrary.org/obo/CHEBI_17072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17073 biolink:ChemicalEntity Cypridina luciferin cas:7273-34-9|kegg.compound:C02825 Graph 1-(3-{2-[(2S)-butan-2-yl]-6-(1H-indol-3-yl)-3-oxo-3,7-dihydroimidazo[1,2-a]pyrazin-8-yl}propyl)guanidine|Cypridina luciferin|[3-[3,7-dihydro-6-(1H-indol-3-yl)-2-[(S)-1-methyl-6-propyl]-3-oxoimidazo[1,2-a]pyrazin-8-yl]propyl]guanidine|cypridinluciferin 1-(3-{2-[(2S)-butan-2-yl]-6-(1H-indol-3-yl)-3-oxo-3,7-dihydroimidazo[1,2-a]pyrazin-8-yl}propyl)guanidine 1-(3-{2-[(2S)-butan-2-yl]-6-(1H-indol-3-yl)-3-oxo-3,7-dihydroimidazo[1,2-a]pyrazin-8-yl}propyl)guanidine|Cypridina luciferin|[3-[3,7-dihydro-6-(1H-indol-3-yl)-2-[(S)-1-methyl-6-propyl]-3-oxoimidazo[1,2-a]pyrazin-8-yl]propyl]guanidine|cypridinluciferin http://purl.obolibrary.org/obo/CHEBI_17073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17074 biolink:ChemicalEntity cycasin cas:14901-08-7|kegg.compound:C01418|knapsack:C00001535 Graph (methyl-ONN-azoxy)methyl beta-D-glucopyranoside|Cycasin|Methylazoxymethanol glucoside|Methylazoxymethyl-b-D-glucopyranoside|beta-D-Glucosyloxyazoxymethane|cycasin (methyl-ONN-azoxy)methyl beta-D-glucopyranoside (methyl-ONN-azoxy)methyl beta-D-glucopyranoside|Cycasin|Methylazoxymethanol glucoside|Methylazoxymethyl-b-D-glucopyranoside|beta-D-Glucosyloxyazoxymethane|cycasin http://purl.obolibrary.org/obo/CHEBI_17074 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17076 biolink:ChemicalEntity streptomycin A amino cyclitol glycoside that consists of streptidine having a disaccharyl moiety attached at the 4-position. The parent of the streptomycin class cas:57-92-1|drugbank:DB01082|drugcentral:2481|hmdb:HMDB0015214|kegg.compound:C00413|kegg.drug:D08531|metacyc.compound:STREPTOMYCIN|pdb-ccd:SRY|pesticides:streptomycin|pubmed:11228320|pubmed:11905029|pubmed:12118520|pubmed:13030054|pubmed:13116094|pubmed:13136149|pubmed:13596285|pubmed:13691614|pubmed:13985260|pubmed:13990247|pubmed:14623118|pubmed:14828344|pubmed:14852338|pubmed:14939639|pubmed:15081082|pubmed:15137533|pubmed:15207172|pubmed:15686853|pubmed:15736038|pubmed:16904706|pubmed:17105735|pubmed:17238915|pubmed:17429930|pubmed:18173084|pubmed:18916143|pubmed:19052412|pubmed:19335957|pubmed:21350946|pubmed:21362244|pubmed:21593257|pubmed:21937264|pubmed:22101040|reaxys:74498|wikipedia.en:Streptomycin Graph 2,4-Diguanidino-3,5,6-trihydroxycyclohexyl 5-deoxy-2-O-(2-deoxy-2-methylamino-alpha-L-glucopyranosyl)-3-C-formyl-beta-L-lyxopentanofuranoside|Kantrex|N,N'''-[(1R,2R,3S,4R,5R,6S)-4-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-formyl-alpha-L-lyxofuranosyloxy}-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine|SM|STREPTOMYCIN|[2-deoxy-2-(dimethylamino)-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine}|streomycin|streptomycin N,N'''-[(1R,2R,3S,4R,5R,6S)-4-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-formyl-alpha-L-lyxofuranosyloxy}-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine 2,4-Diguanidino-3,5,6-trihydroxycyclohexyl 5-deoxy-2-O-(2-deoxy-2-methylamino-alpha-L-glucopyranosyl)-3-C-formyl-beta-L-lyxopentanofuranoside|Kantrex|N,N'''-[(1R,2R,3S,4R,5R,6S)-4-{5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-formyl-alpha-L-lyxofuranosyloxy}-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine|SM|STREPTOMYCIN|[2-deoxy-2-(dimethylamino)-alpha-L-glucopyranosyl]-(1->2)-[5-deoxy-3-C-formyl-alpha-L-lyxofuranosyl]-(1->4)-{N',N'''-[(1,3,5/2,4,6)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine}|streomycin|streptomycin http://purl.obolibrary.org/obo/CHEBI_17076 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17077 biolink:ChemicalEntity 2-carboxy-D-arabinitol The 2-carboxy derivative of D-arabinitol. beilstein:1726018|kegg.compound:C03215 Graph 2-C-(hydroxymethyl)-D-ribonic acid|2-Carboxy-D-arabinitol|2-carboxy-D-arabitol 2-C-(hydroxymethyl)-D-ribonic acid 2-C-(hydroxymethyl)-D-ribonic acid|2-Carboxy-D-arabinitol|2-carboxy-D-arabitol http://purl.obolibrary.org/obo/CHEBI_17077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17078 biolink:ChemicalEntity L-gamma-glutamyl-L-cysteinyl-beta-alanine kegg.compound:C04544 Graph L-gamma-glutamyl-L-cysteinyl-beta-alanine|gamma-L-Glutamyl-L-cysteinyl-beta-alanine L-gamma-glutamyl-L-cysteinyl-beta-alanine L-gamma-glutamyl-L-cysteinyl-beta-alanine|gamma-L-Glutamyl-L-cysteinyl-beta-alanine http://purl.obolibrary.org/obo/CHEBI_17078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17079 biolink:ChemicalEntity (S)-3'-hydroxy-N-methylcoclaurine An isoquinoline alkaloid having a tetrahydroisoquinoline core with 3,4-dihydroxybenzyl, methoxy and hydroxy groups at the 1-, 6- and 7-positions respectively; major species at pH 7.3. kegg.compound:C05202 Graph (S)-3'-Hydroxy-N-methylcoclaurine|3'-Hydroxy-N-methyl-(S)-coclaurine|3'-hydroxy-(S)-N-methylcoclaurine|3'-hydroxy-N-methyl-(S)-coclaurine|4-{[(1S)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}benzene-1,2-diol 4-{[(1S)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}benzene-1,2-diol (S)-3'-Hydroxy-N-methylcoclaurine|3'-Hydroxy-N-methyl-(S)-coclaurine|3'-hydroxy-(S)-N-methylcoclaurine|3'-hydroxy-N-methyl-(S)-coclaurine|4-{[(1S)-7-hydroxy-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}benzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_17079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17081 biolink:ChemicalEntity dimethylmaleate(2-) A dicarboxylic acid dianion that is obtained from dimethylmaleic acid by removal of a proton from each of the carboxylic acid groups. beilstein:3664409|kegg.compound:C00922|metacyc.compound:DIMETHYLMAL-CPD|pubmed:11814804|pubmed:16899047|pubmed:4332128|pubmed:5817984|pubmed:6489933|pubmed:8124663|pubmed:8392528 Graph (2Z)-2,3-dimethylbut-2-enedioate|2,3-dimethylmaleate|Dimethylmaleate|dimethylmaleate|dimethylmaleic acid dianion (2Z)-2,3-dimethylbut-2-enedioate (2Z)-2,3-dimethylbut-2-enedioate|2,3-dimethylmaleate|Dimethylmaleate|dimethylmaleate|dimethylmaleic acid dianion http://purl.obolibrary.org/obo/CHEBI_17081 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17082 biolink:ChemicalEntity L-2-aminoadipate(2-) Graph (2S)-2-aminohexanedioate (2S)-2-aminohexanedioate (2S)-2-aminohexanedioate http://purl.obolibrary.org/obo/CHEBI_17082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17083 biolink:ChemicalEntity 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol A dihydropterin that is 7,8-dihydropteridin-4-ol substituted at positions 2 and 6 by amino and hydroxymethyl groups respectively. kegg.compound:C01300|knapsack:C00007501|pdb-ccd:PH2 Graph 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine|2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine|2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine|2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine|2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol http://purl.obolibrary.org/obo/CHEBI_17083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17084 biolink:ChemicalEntity 2-hydroxyglutaric acid A 2-hydroxydicarboxylic acid that is glutaric acid in which one hydrogen α- to a carboxylic acid group is substituted by a hydroxy group. cas:2889-31-8|hmdb:HMDB0059655|kegg.compound:C02630|metacyc.compound:2-HYDROXYGLUTARIC_ACID|pubmed:17439666|reaxys:1723805|wikipedia.en:Alpha-Hydroxyglutaric_acid Graph 2-hydroxyglutaric acid|2-hydroxypentanedioic acid|alpha-hydroxyglutaric acid 2-hydroxypentanedioic acid 2-hydroxyglutaric acid|2-hydroxypentanedioic acid|alpha-hydroxyglutaric acid http://purl.obolibrary.org/obo/CHEBI_17084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17087 biolink:ChemicalEntity ketone A compound in which a carbonyl group is bonded to two carbon atoms: R2C=O (neither R may be H). kegg.compound:C01450|wikipedia.en:Ketone Graph Keton|Ketone|R-CO-R'|a ketone|cetone|ketones ketones Keton|Ketone|R-CO-R'|a ketone|cetone|ketones http://purl.obolibrary.org/obo/CHEBI_17087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17088 biolink:ChemicalEntity monoacyl-sn-glycerol 3-phosphate An sn-glycero-3-phosphate compound having a single unspecified acyl group at either position 1 or position 2. kegg.compound:C03849 Graph Acyl-sn-glycerol 3-phosphate|acyl-sn-glycerol 3-phosphates Acyl-sn-glycerol 3-phosphate|acyl-sn-glycerol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_17088 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17089 biolink:ChemicalEntity glycoprotein A compound in which a carbohydrate component is covalently bound to a protein component. kegg.compound:C00326 Graph Glycoprotein|Glykoprotein|Glykoproteine|a glycoprotein|glicoproteina|glicoproteinas|glycoproteine|glycoproteines|glycoproteins glycoproteins Glycoprotein|Glykoprotein|Glykoproteine|a glycoprotein|glicoproteina|glicoproteinas|glycoproteine|glycoproteines|glycoproteins http://purl.obolibrary.org/obo/CHEBI_17089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17092 biolink:ChemicalEntity 3-chloro-D-alanine A 3-chloroalanine that has S configutation at the chiral centre. kegg.compound:C02634 Graph 3-Chloro-D-alanine|3-chloro-D-alanine 3-Chloro-D-alanine|3-chloro-D-alanine 3-Chloro-D-alanine|3-chloro-D-alanine http://purl.obolibrary.org/obo/CHEBI_17092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17094 biolink:ChemicalEntity 2-dehydropantoic acid An oxo monocarboxylic acid that is 2-oxobutanoic acid in which both of the hydrogens at position 3 are substituted by methyl groups and one of the hydrogens at position 4 is substituted by a hydroxy group. kegg.compound:C00966|knapsack:C00007477|pdb-ccd:KPL|pubmed:234966|reaxys:2242422 Graph 2-Dehydropantoate|4-hydroxy-3,3-dimethyl-2-oxobutanoic acid|ketopantoic acid 4-hydroxy-3,3-dimethyl-2-oxobutanoic acid 2-Dehydropantoate|4-hydroxy-3,3-dimethyl-2-oxobutanoic acid|ketopantoic acid http://purl.obolibrary.org/obo/CHEBI_17094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17096 biolink:ChemicalEntity strictosidine aglycone cas:85925-13-9|kegg.compound:C03309|pubmed:29424954 Graph Strictosidine aglycone|methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-{[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl}-3,4-dihydro-2H-pyran-5-carboxylate methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-{[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl}-3,4-dihydro-2H-pyran-5-carboxylate Strictosidine aglycone|methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-{[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl}-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_17096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17097 biolink:ChemicalEntity biphenyl A benzenoid aromatic compound that consists of two benzene rings connected by a single covalent bond. Biphenyl occurs naturally in coal tar, crude oil, and natural gas. Formerly used as a fungicide for citrus crops. cas:92-52-4|gmelin:3808|hmdb:HMDB0034437|kegg.compound:C06588|metacyc.compound:BIPHENYL|pdb-ccd:BNL|pesticides:biphenyl|ppdb:82|pubmed:21337247|pubmed:21575716|reaxys:1634058|umbbd.compound:c0371|wikipedia.en:Biphenyl Graph 1,1'-Biphenyl|1,1'-Diphenyl|1,1'-biphenyl|Biphenyl|E230|Phenylbenzene|biphenyl 1,1'-Biphenyl|1,1'-biphenyl 1,1'-Biphenyl|1,1'-Diphenyl|1,1'-biphenyl|Biphenyl|E230|Phenylbenzene|biphenyl http://purl.obolibrary.org/obo/CHEBI_17097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17099 biolink:ChemicalEntity aspulvinone H cas:57744-69-1|kegg.compound:C02008 Graph 4-hydroxy-5-[4-hydroxy-3-(3-methylbut-2-en-1-yl)benzylidene]-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]furan-2(5H)-one|Aspulvinone H 4-hydroxy-5-[4-hydroxy-3-(3-methylbut-2-en-1-yl)benzylidene]-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]furan-2(5H)-one 4-hydroxy-5-[4-hydroxy-3-(3-methylbut-2-en-1-yl)benzylidene]-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]furan-2(5H)-one|Aspulvinone H http://purl.obolibrary.org/obo/CHEBI_17099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17100 biolink:ChemicalEntity L-arabinono-1,4-lactone beilstein:82060|cas:51532-86-6|kegg.compound:C01114 Graph (3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one|L-Arabino-1,4-lactone|L-Arabinonic acid, gamma-lactone|L-Arabinono-1,4-lactone|L-Arabonolactone|L-arabino-1,4-Lactone|L-arabinonic acid gamma-lactone|L-arabinono-1,4-lactone (3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one (3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one|L-Arabino-1,4-lactone|L-Arabinonic acid, gamma-lactone|L-Arabinono-1,4-lactone|L-Arabonolactone|L-arabino-1,4-Lactone|L-arabinonic acid gamma-lactone|L-arabinono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_17100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17102 biolink:ChemicalEntity phosphoramide A compound in which one or more of the OH groups of phosphoric acid have been replaced with an amino or substituted amino group. The term is commonly confined to the phosphoric triamides, P(=O)(NR2)3, since replacement of one or two OH groups produces phosphoramidic acids: P(=O)(OH)(NR2)2 , P(=O)(OH)2(NR2). Graph phosphamide|phosphamides|phosphoramides phosphamide|phosphamides|phosphoramides http://purl.obolibrary.org/obo/CHEBI_17102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17103 biolink:ChemicalEntity N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide(d18:1(4E)) A glycotriaosylceramide having N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucose as the glycotriaosyl component. kegg.compound:C04845|kegg.glycan:G00036|pubmed:1528196|pubmed:60462|pubmed:6209560 Graph (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactocyl-1,4-beta-glucosyl-1,1'-beta-ceramide|N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactosyl-1,4-beta-D-glucosylceramide|a beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer(d18:1(4E))|beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactocyl-1,4-beta-glucosyl-1,1'-beta-ceramide|N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactosyl-1,4-beta-D-glucosylceramide|a beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer(d18:1(4E))|beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer http://purl.obolibrary.org/obo/CHEBI_17103 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17104 biolink:ChemicalEntity 6-hydroxyprotopine A dibenzazecine alkaloid that is protopine bearing a hydroxy substituent at the 6-position. kegg.compound:C05190 Graph 10-hydroxyprotopine|6-Hydroxyprotopine|6-hydroxy-7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one|6-hydroxyprotopine|8-hydroxy-7-methyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one 6-hydroxy-7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one 10-hydroxyprotopine|6-Hydroxyprotopine|6-hydroxy-7-methyl-2,3:9,10-bis[methylenebis(oxy)]-7,13a-secoberbin-13a-one|6-hydroxyprotopine|8-hydroxy-7-methyl-6,8,9,16-tetrahydrobis[1,3]benzodioxolo[4,5-c:5',6'-g]azecin-15(7H)-one http://purl.obolibrary.org/obo/CHEBI_17104 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17105 biolink:ChemicalEntity 4-maleylacetoacetate kegg.compound:C01036|umbbd.compound:c0109 Graph (2Z)-4,6-dioxooct-2-enedioate|4-maleylacetoacetate (2Z)-4,6-dioxooct-2-enedioate (2Z)-4,6-dioxooct-2-enedioate|4-maleylacetoacetate http://purl.obolibrary.org/obo/CHEBI_17105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17106 biolink:ChemicalEntity 1-alkyl-sn-glycerol 3-phosphate An alkyl-sn-glycerol 3-phosphate in which the alkyl group is at position 1 of the sn-glycerol. kegg.compound:C03968 Graph 1-Alkyl-sn-glycero-3-phosphate|1-Alkyl-sn-glycerol 3-phosphate|1-O-Alkyl-sn-glycerol 3-phosphate|1-alkyl-sn-glycerol 3-phosphates 1-Alkyl-sn-glycero-3-phosphate|1-Alkyl-sn-glycerol 3-phosphate|1-O-Alkyl-sn-glycerol 3-phosphate|1-alkyl-sn-glycerol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_17106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17108 biolink:ChemicalEntity D-arabinose cas:10323-20-3|kegg.compound:C00216 Graph D-Ara|D-Arabinose|D-arabino-pentose|D-arabinose D-Arabinose|D-arabino-pentose|D-arabinose D-Ara|D-Arabinose|D-arabino-pentose|D-arabinose http://purl.obolibrary.org/obo/CHEBI_17108 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17109 biolink:ChemicalEntity 7,8-dihydro-7,8-dihydroxykynurenic acid The 7,8-dihydro-7,8-dihydroxy derivative of kynurenic acid. kegg.compound:C01249 Graph 4,7,8-trihydroxy-7,8-dihydroquinoline-2-carboxylic acid|7,8-Dihydro-7,8-dihydroxykynurenate 4,7,8-trihydroxy-7,8-dihydroquinoline-2-carboxylic acid 4,7,8-trihydroxy-7,8-dihydroquinoline-2-carboxylic acid|7,8-Dihydro-7,8-dihydroxykynurenate http://purl.obolibrary.org/obo/CHEBI_17109 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17110 biolink:ChemicalEntity 1-guanidino-1-deoxy-scyllo-inositol A derivative of scyllo-inositol having a guanidino group in place of the 1-hydroxy group. kegg.compound:C04280 Graph 1-Guanidino-1-deoxy-scyllo-inositol|1-[(1s,2R,3S,4r,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]guanidine|1-carbamimidamido-1-deoxy-scyllo-inositol|1-carbamimidoylamino-1-deoxy-scyllo-inositol|1-guanidino-1-deoxy-scyllo-inositol|Amidino-scyllo-inosamine 1-[(1s,2R,3S,4r,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]guanidine 1-Guanidino-1-deoxy-scyllo-inositol|1-[(1s,2R,3S,4r,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]guanidine|1-carbamimidamido-1-deoxy-scyllo-inositol|1-carbamimidoylamino-1-deoxy-scyllo-inositol|1-guanidino-1-deoxy-scyllo-inositol|Amidino-scyllo-inosamine http://purl.obolibrary.org/obo/CHEBI_17110 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17111 biolink:ChemicalEntity 5-O-phosphono-alpha-D-ribofuranosyl diphosphate A derivative of α-D-ribose having a phosphate group at the 5-position and a diphosphate at the 1-position. cas:7540-64-9|drugbank:DB01632|hmdb:HMDB0000280|kegg.compound:C00119|knapsack:C00007296|metacyc.compound:PRPP|pdb-ccd:PRP|pubmed:22264286|pubmed:23509005|pubmed:23734909|reaxys:60403 Graph 5-O-phosphono-alpha-D-ribofuranose 1-(trihydrogen diphosphate)|5-Phospho-alpha-D-ribose 1-diphosphate|5-Phosphoribosyl 1-pyrophosphate|5-Phosphoribosyl diphosphate|ALPHA-PHOSPHORIBOSYLPYROPHOSPHORIC ACID|PRPP|PRib-PP|alpha-D-ribofuranose 5-(dihydrogen phosphate) 1-(trihydrogen diphosphate)|phosphoribosyl pyrophosphate|phosphoribosylpyrophosphate 5-O-phosphono-alpha-D-ribofuranose 1-(trihydrogen diphosphate) 5-O-phosphono-alpha-D-ribofuranose 1-(trihydrogen diphosphate)|5-Phospho-alpha-D-ribose 1-diphosphate|5-Phosphoribosyl 1-pyrophosphate|5-Phosphoribosyl diphosphate|ALPHA-PHOSPHORIBOSYLPYROPHOSPHORIC ACID|PRPP|PRib-PP|alpha-D-ribofuranose 5-(dihydrogen phosphate) 1-(trihydrogen diphosphate)|phosphoribosyl pyrophosphate|phosphoribosylpyrophosphate http://purl.obolibrary.org/obo/CHEBI_17111 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17113 biolink:ChemicalEntity erythritol The meso-diastereomer of butane-1,2,3,4-tetrol. beilstein:1719753|cas:149-32-6|drugbank:DB04481|gmelin:82499|hmdb:HMDB0002994|kegg.compound:C00503|knapsack:C00001161|metacyc.compound:ERYTHRITOL|pdb-ccd:MRY|pmc:PMC9193570|pubmed:12639570|pubmed:163226|pubmed:16901854|pubmed:17336832|pubmed:17979222|pubmed:18369603|pubmed:19632091|pubmed:19804861|pubmed:22770225|pubmed:23421980|pubmed:23574577|pubmed:23890177|pubmed:24643482|pubmed:25108762|pubmed:35289142|pubmed:35364613|pubmed:35575772|pubmed:36276829|pubmed:36354105|pubmed:36478868|pubmed:36547619|pubmed:36615861|pubmed:36849732|pubmed:9862657|reaxys:1735878|wikipedia.en:Erythritol Graph (2R,3S)-butane-1,2,3,4-tetrol|Erythrit|Erythrite|Erythritol|Erythrol|L-erythritol|MESO-ERYTHRITOL|Phycite|Phycitol|erythritol|erythro-tetritol|meso-erythritol|mesoerythritol MESO-ERYTHRITOL|meso-erythritol (2R,3S)-butane-1,2,3,4-tetrol|Erythrit|Erythrite|Erythritol|Erythrol|L-erythritol|MESO-ERYTHRITOL|Phycite|Phycitol|erythritol|erythro-tetritol|meso-erythritol|mesoerythritol http://purl.obolibrary.org/obo/CHEBI_17113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17114 biolink:ChemicalEntity N(5)-formyl-5,6,7,8-tetrahydromethanopterin cas:99451-79-3|kegg.compound:C01274|pdb-ccd:H4Z Graph 1-(4-{(1R)-1-[(6S,7S)-2-amino-5-formyl-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5-(4-{[1-(2-AMINO-5-FORMYL-7-METHYL-4-OXO-3,4,5,6,7,8-HEXAHYDROPTERIDIN-6-YL)ETHYL]AMINO}PHENYL)-5-DEOXY-1-O-{5-O-[(1,3-DICARBOXYPROPOXY)(HYDROXY)PHOSPHORYL]PENTOFURANOSYL}PENTITOL|5-Formyl-5,6,7,8-tetrahydromethanopterin|5-Formyl-H4MPT|5-formyl-5,6,7,8-tetrahydromethanopterin|N(5)-Formyltetrahydromethanopterin|N5-formyl-5,6,7,8-tetrahydromethanopterin 1-(4-{(1R)-1-[(6S,7S)-2-amino-5-formyl-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol 1-(4-{(1R)-1-[(6S,7S)-2-amino-5-formyl-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5-(4-{[1-(2-AMINO-5-FORMYL-7-METHYL-4-OXO-3,4,5,6,7,8-HEXAHYDROPTERIDIN-6-YL)ETHYL]AMINO}PHENYL)-5-DEOXY-1-O-{5-O-[(1,3-DICARBOXYPROPOXY)(HYDROXY)PHOSPHORYL]PENTOFURANOSYL}PENTITOL|5-Formyl-5,6,7,8-tetrahydromethanopterin|5-Formyl-H4MPT|5-formyl-5,6,7,8-tetrahydromethanopterin|N(5)-Formyltetrahydromethanopterin|N5-formyl-5,6,7,8-tetrahydromethanopterin http://purl.obolibrary.org/obo/CHEBI_17114 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17115 biolink:ChemicalEntity L-serine The L-enantiomer of serine. cas:56-45-1|drugbank:DB00133|drugcentral:4127|ecmdb:ECMDB00187|gmelin:2570|hmdb:HMDB0000187|kegg.compound:C00065|kegg.drug:D00016|knapsack:C00001393|metacyc.compound:SER|pdb-ccd:SER|pubmed:1650428|pubmed:17439666|pubmed:19062365|pubmed:21956576|pubmed:22265470|pubmed:22393170|pubmed:22547037|pubmed:22566084|pubmed:22566694|reaxys:1721404|wikipedia.en:L-serine|ymdb:YMDB00112 Graph (2S)-2-amino-3-hydroxypropanoic acid|(S)-(-)-serine|(S)-2-amino-3-hydroxypropanoic acid|(S)-alpha-Amino-beta-hydroxypropionic acid|(S)-serine|L-(-)-serine|L-2-Amino-3-hydroxypropionic acid|L-3-Hydroxy-2-aminopropionic acid|L-3-Hydroxy-alanine|L-Ser|L-Serin|L-Serine|L-serine|S|SERINE|Ser|Serine|beta-Hydroxy-L-alanine|beta-Hydroxyalanine L-Serine|L-serine (2S)-2-amino-3-hydroxypropanoic acid|(S)-(-)-serine|(S)-2-amino-3-hydroxypropanoic acid|(S)-alpha-Amino-beta-hydroxypropionic acid|(S)-serine|L-(-)-serine|L-2-Amino-3-hydroxypropionic acid|L-3-Hydroxy-2-aminopropionic acid|L-3-Hydroxy-alanine|L-Ser|L-Serin|L-Serine|L-serine|S|SERINE|Ser|Serine|beta-Hydroxy-L-alanine|beta-Hydroxyalanine http://purl.obolibrary.org/obo/CHEBI_17115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17117 biolink:ChemicalEntity 5-dehydro-4-deoxy-D-glucuronate The anion resulting from the removal of a proton from the carboxylic acid group of 5-dehydro-4-deoxy-D-glucuronic acid. kegg.compound:C04053|pubmed:10441389|pubmed:15148314|pubmed:16630576|pubmed:16893885|pubmed:19416976|pubmed:21147778 Graph (4S,5R)-4,5-dihydroxy-2,6-dioxohexanoate|4-Deoxy-L-threo-5-hexosulose uronate|4-deoxy-L-threo-hex-5-ulosuronate|5-Dehydro-4-deoxy-D-glucuronate|5-dehydro-4-deoxy-D-glucuronate 4-deoxy-L-threo-hex-5-ulosuronate (4S,5R)-4,5-dihydroxy-2,6-dioxohexanoate|4-Deoxy-L-threo-5-hexosulose uronate|4-deoxy-L-threo-hex-5-ulosuronate|5-Dehydro-4-deoxy-D-glucuronate|5-dehydro-4-deoxy-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_17117 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17118 biolink:ChemicalEntity aldehydo-D-galactose beilstein:1724619|glytoucan:G93924TT Graph (2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal|aldehydo-D-galacto-hexose|aldehydo-D-galactose aldehydo-D-galacto-hexose|aldehydo-D-galactose (2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal|aldehydo-D-galacto-hexose|aldehydo-D-galactose http://purl.obolibrary.org/obo/CHEBI_17118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17119 biolink:ChemicalEntity fMet-tRNA(fMet) kegg.compound:C03294 Graph N-Formylmethionyl-tRNA|N-formyl-L-methionyl-tRNA(fMet)|fMet-tRNA(fMet) N-Formylmethionyl-tRNA|N-formyl-L-methionyl-tRNA(fMet)|fMet-tRNA(fMet) http://purl.obolibrary.org/obo/CHEBI_17119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17120 biolink:ChemicalEntity hexanoate A short-chain fatty acid anion that is the conjugate base of hexanoic acid (also known as caproic acid). beilstein:3601453|cas:151-33-7|ecmdb:ECMDB21229|gmelin:326340|kegg.compound:C01585|metacyc.compound:HEXANOATE Graph 1-hexanoate|1-pentacarboxylate|1-pentanecarboxylate|CH3-[CH2]4-COO(-)|butylacetate|caproate|capronate|hexanoate|hexoate|hexylate|n-caproate|n-hexanoate|n-hexoate|n-hexylate|nPnCO2 anion|pentanecarboxylate|pentylformate hexanoate 1-hexanoate|1-pentacarboxylate|1-pentanecarboxylate|CH3-[CH2]4-COO(-)|butylacetate|caproate|capronate|hexanoate|hexoate|hexylate|n-caproate|n-hexanoate|n-hexoate|n-hexylate|nPnCO2 anion|pentanecarboxylate|pentylformate http://purl.obolibrary.org/obo/CHEBI_17120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17121 biolink:ChemicalEntity oxomalonate(2-) beilstein:5807275|gmelin:1783066|kegg.compound:C00830 Graph oxomalonate|oxopropanedioate oxopropanedioate oxomalonate|oxopropanedioate http://purl.obolibrary.org/obo/CHEBI_17121 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17122 biolink:ChemicalEntity aldehydo-N-acetyl-D-mannosamine An N-acetylmannosamine in open-chain aldehyde form with D-configuration. cas:3615-17-6|kegg.compound:C00645 Graph 2-Acetamido-2-deoxy-D-mannose|D-ManNAc|N-Acetyl-D-mannosamine|N-acetyl-D-mannosamine|aldehydo-N-acetyl-D-mannosamine N-Acetyl-D-mannosamine|N-acetyl-D-mannosamine 2-Acetamido-2-deoxy-D-mannose|D-ManNAc|N-Acetyl-D-mannosamine|N-acetyl-D-mannosamine|aldehydo-N-acetyl-D-mannosamine http://purl.obolibrary.org/obo/CHEBI_17122 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17123 biolink:ChemicalEntity 2-aminoacrylic acid A 2,3-dehydroamino acid that is alanine which has been dehydrogenated to introduce a double bond between positions 2 and 3. cas:1948-56-7|drugbank:DB02688|kegg.compound:C02218|pdb-ccd:DHA|pubmed:16734454|pubmed:18585427|pubmed:23749972|pubmed:23815688|reaxys:6122568 Graph 2,3-didehydroalanine|2-Aminoacrylate|2-aminoprop-2-enoic acid|Dehydroalanine|alpha,beta-dehydroalanine|anhydroserine2-aminopropenoic acid 2-aminoprop-2-enoic acid 2,3-didehydroalanine|2-Aminoacrylate|2-aminoprop-2-enoic acid|Dehydroalanine|alpha,beta-dehydroalanine|anhydroserine2-aminopropenoic acid http://purl.obolibrary.org/obo/CHEBI_17123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17125 biolink:ChemicalEntity 6-acetamido-3-aminohexanoate kegg.compound:C03846 Graph 6-acetamido-3-aminohexanoate 6-acetamido-3-aminohexanoate 6-acetamido-3-aminohexanoate http://purl.obolibrary.org/obo/CHEBI_17125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17126 biolink:ChemicalEntity carnitine An amino-acid betaine that is butanoate substituted with a hydroxy group at position C-3 and a trimethylammonium group at C-4. cas:461-06-3|drugbank:DB02648|kegg.compound:C00487|metacyc.compound:DL-CARNITINE|patent:US4255449|patent:US4315944|pubmed:22770225|pubmed:23868375|reaxys:1866665|wikipedia.en:Carnitine Graph 3-hydroxy-4-(trimethylammonio)butanoate|D,L-carnitine|carnitine 3-hydroxy-4-(trimethylammonio)butanoate 3-hydroxy-4-(trimethylammonio)butanoate|D,L-carnitine|carnitine http://purl.obolibrary.org/obo/CHEBI_17126 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17128 biolink:ChemicalEntity adipate(2-) A dicarboxylic acid dianion obtained by the deprotonation of both the carboxy groups of adipic acid. cas:764-65-8|gmelin:326743|metacyc.compound:ADIPATE|reaxys:3904826|umbbd.compound:c0123 Graph O2C(CH2)4CO2 dianion|adipate dianion|hexan-1,6-dicarboxylate|hexanedioate|hexanedioic acid, ion(2-) hexanedioate O2C(CH2)4CO2 dianion|adipate dianion|hexan-1,6-dicarboxylate|hexanedioate|hexanedioic acid, ion(2-) http://purl.obolibrary.org/obo/CHEBI_17128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17129 biolink:ChemicalEntity (S)-scoulerine A berberine alkaloid isolated from Corydalis saxicola. cas:6451-73-6|kegg.compound:C02106|knapsack:C00026092|lincs.smallmolecule:LSM-3391|pdb-ccd:SLX|pubmed:18649321|pubmed:22029392|wikipedia.en:Scoulerine Graph (-)-scoulerine|(13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol|(13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol|(S)-Scoulerine|(S)-scoulerine (13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol (-)-scoulerine|(13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol|(13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol|(S)-Scoulerine|(S)-scoulerine http://purl.obolibrary.org/obo/CHEBI_17129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17130 biolink:ChemicalEntity 10-oxocapric acid A capric acid derivative carrying an oxo group at position 10. beilstein:1766800|cas:5578-80-3|kegg.compound:C02217|lipidmaps:LMFA01060078 Graph 10-oxodecanoic acid|9-aldehydononanoic acid|9-formylnonanoic acid|9-formylpelargonic acid|omega-oxocapric acid|omega-oxodecanoic acid|sebacaldehydic acid|sebacic semialdehyde 10-oxodecanoic acid 10-oxodecanoic acid|9-aldehydononanoic acid|9-formylnonanoic acid|9-formylpelargonic acid|omega-oxocapric acid|omega-oxodecanoic acid|sebacaldehydic acid|sebacic semialdehyde http://purl.obolibrary.org/obo/CHEBI_17130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17131 biolink:ChemicalEntity (3,5-diiodo-4-hydroxyphenyl)pyruvic acid A derivative of pyruvic acid carrying a 3,5-diiodo-4-hydroxyphenyl group at the 3-position. kegg.compound:C01244 Graph 3,5-Diiodo-4-hydroxyphenylpyruvate|3-(3,5-Diiodo-4-hydroxyphenyl)pyruvate|3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid|beta-(3,5-diiodo-4-hydroxyphenyl)pyruvate 3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid 3,5-Diiodo-4-hydroxyphenylpyruvate|3-(3,5-Diiodo-4-hydroxyphenyl)pyruvate|3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid|beta-(3,5-diiodo-4-hydroxyphenyl)pyruvate http://purl.obolibrary.org/obo/CHEBI_17131 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17132 biolink:ChemicalEntity diethyl (2R,3R)-2-hydroxy-3-methylsuccinate beilstein:5736901|kegg.compound:C04586 Graph Diethyl (2R,3R)-2-methyl-3-hydroxysuccinate|diethyl (2R,3R)-2-hydroxy-3-methylbutanedioate|diethyl (2R,3R)-2-methyl-3-hydroxysuccinate diethyl (2R,3R)-2-hydroxy-3-methylbutanedioate Diethyl (2R,3R)-2-methyl-3-hydroxysuccinate|diethyl (2R,3R)-2-hydroxy-3-methylbutanedioate|diethyl (2R,3R)-2-methyl-3-hydroxysuccinate http://purl.obolibrary.org/obo/CHEBI_17132 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17133 biolink:ChemicalEntity deoxylimonoic acid cas:35606-75-8|kegg.compound:C02027 Graph Deoxylimonate|Deoxylimonic acid|{(3R,3aR,7aS)-3a-[(1R,6S,8aR)-1-furan-3-yl-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-isochromen-6-yl]-2,2-dimethyl-6-oxohexahydro-4H-furo[3,2-c]pyran-3-yl}acetic acid {(3R,3aR,7aS)-3a-[(1R,6S,8aR)-1-furan-3-yl-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-isochromen-6-yl]-2,2-dimethyl-6-oxohexahydro-4H-furo[3,2-c]pyran-3-yl}acetic acid Deoxylimonate|Deoxylimonic acid|{(3R,3aR,7aS)-3a-[(1R,6S,8aR)-1-furan-3-yl-5,8a-dimethyl-3-oxo-3,4,6,7,8,8a-hexahydro-1H-isochromen-6-yl]-2,2-dimethyl-6-oxohexahydro-4H-furo[3,2-c]pyran-3-yl}acetic acid http://purl.obolibrary.org/obo/CHEBI_17133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17134 biolink:ChemicalEntity octopamine A member of the class of phenylethanolamines that is phenol which is substituted at the para- position by a 2-amino-1-hydroxyethyl group. A biogenic phenylethanolamine which has been found to act as a neurotransmitter, neurohormone or neuromodulator in invertebrates. beilstein:1211019|cas:104-14-3|drugcentral:3396|kegg.compound:C04227|lincs.smallmolecule:LSM-4975 Graph 1-(4-Hydroxyphenyl)-2-aminoethanol|1-(p-hydroxyphenyl)-2-aminoethanol|4-(2-amino-1-hydroxyethyl)phenol|Octopamin|Octopamine|alpha-(aminomethyl)-4-hydroxybenzenemethanol|alpha-(aminomethyl)-p-hydroxybenzyl alcohol|beta-hydroxytyramine|norsynephrine|octopaminum|p-Hydroxyphenylethanolamine 4-(2-amino-1-hydroxyethyl)phenol 1-(4-Hydroxyphenyl)-2-aminoethanol|1-(p-hydroxyphenyl)-2-aminoethanol|4-(2-amino-1-hydroxyethyl)phenol|Octopamin|Octopamine|alpha-(aminomethyl)-4-hydroxybenzenemethanol|alpha-(aminomethyl)-p-hydroxybenzyl alcohol|beta-hydroxytyramine|norsynephrine|octopaminum|p-Hydroxyphenylethanolamine http://purl.obolibrary.org/obo/CHEBI_17134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17135 biolink:ChemicalEntity long-chain fatty alcohol A fatty alcohol with a chain length ranging from C13 to C22. kegg.compound:C00339|metacyc.compound:Long-chain-alcohols|pubmed:19155068|pubmed:22436224|pubmed:22444994 Graph Long-chain alcohol|a long chain fatty alcohol|long chain fatty alcohol|long chain fatty alcohols|long-chain alcohols|long-chain fatty alcohols Long-chain alcohol|a long chain fatty alcohol|long chain fatty alcohol|long chain fatty alcohols|long-chain alcohols|long-chain fatty alcohols http://purl.obolibrary.org/obo/CHEBI_17135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17136 biolink:ChemicalEntity 2,8-dihydroxy-1,4-naphthoquinone A hydroxyquinone that is the 2,8-dihydroxy derivative of 1,4-naphthoquinone. kegg.compound:C04110 Graph 2,8-dihydroxynaphthalene-1,4-dione|3,5-Dihydroxy-1,4-naphthoquinone 2,8-dihydroxynaphthalene-1,4-dione 2,8-dihydroxynaphthalene-1,4-dione|3,5-Dihydroxy-1,4-naphthoquinone http://purl.obolibrary.org/obo/CHEBI_17136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17137 biolink:ChemicalEntity hydrogensulfite cas:15181-46-1|gmelin:1455|kegg.compound:C11481|pdb-ccd:SO3 Graph Bisulfite|HSO3(-)|HSO3-|Hydrogen sulfite|[SO2(OH)](-)|bisulfite|bisulphite|hydrogen sulfite(1-)|hydrogen(trioxidosulfate)(1-)|hydrogensulfite(1-)|hydrogentrioxosulfate(1-)|hydrogentrioxosulfate(IV)|hydrosulfite anion|hydroxidodioxidosulfate(1-)|monohydrogentrioxosulfate hydrogen(trioxidosulfate)(1-)|hydrogensulfite(1-)|hydrogentrioxosulfate(1-)|hydrogentrioxosulfate(IV)|hydroxidodioxidosulfate(1-)|monohydrogentrioxosulfate Bisulfite|HSO3(-)|HSO3-|Hydrogen sulfite|[SO2(OH)](-)|bisulfite|bisulphite|hydrogen sulfite(1-)|hydrogen(trioxidosulfate)(1-)|hydrogensulfite(1-)|hydrogentrioxosulfate(1-)|hydrogentrioxosulfate(IV)|hydrosulfite anion|hydroxidodioxidosulfate(1-)|monohydrogentrioxosulfate http://purl.obolibrary.org/obo/CHEBI_17137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17138 biolink:ChemicalEntity glyceraldehyde 3-phosphate An aldotriose phosphate that is the 3-phospho derivative of glyceraldehyde. It is an important metabolic intermediate in several central metabolic pathways in all organisms. cas:142-10-9|cas:591-59-3|drugbank:DB02263|hmdb:HMDB0001112|kegg.compound:C00661|knapsack:C00007285|metacyc.compound:CPD0-2032|reaxys:1725008|wikipedia.en:3-phosphoglyceraldehyde Graph 2-hydroxy-3-(phosphonooxy)propanal|2-hydroxy-3-oxopropyl dihydrogen phosphate|3-phosphoglyceraldehyde|DL-Glyceraldehyde 3-phosphate|GAP|Glyceraldehyde 3-phosphate|Glycerinaldehyd-3-phosphat|Glyzerinaldehyd-3-phosphat|gliceraldehido-3-fosfato|glyceraldehyde 3-(dihydrogen phosphate)|glyceraldehyde-3-phosphate 2-hydroxy-3-oxopropyl dihydrogen phosphate 2-hydroxy-3-(phosphonooxy)propanal|2-hydroxy-3-oxopropyl dihydrogen phosphate|3-phosphoglyceraldehyde|DL-Glyceraldehyde 3-phosphate|GAP|Glyceraldehyde 3-phosphate|Glycerinaldehyd-3-phosphat|Glyzerinaldehyd-3-phosphat|gliceraldehido-3-fosfato|glyceraldehyde 3-(dihydrogen phosphate)|glyceraldehyde-3-phosphate http://purl.obolibrary.org/obo/CHEBI_17138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17139 biolink:ChemicalEntity 6-O-sulfo-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->3)-1-O-alkyl-2-O-acylglycerol kegg.compound:C04920 Graph 6-Sulfo-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,3-1-O-alkyl-2-O-acylglycerol 6-Sulfo-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,3-1-O-alkyl-2-O-acylglycerol http://purl.obolibrary.org/obo/CHEBI_17139 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17140 biolink:ChemicalEntity D-xylulose The D-enantiomer of xylulose. cas:551-84-8|drugbank:DB03947|hmdb:HMDB0001644|kegg.compound:C00310|knapsack:C00019684|metacyc.compound:D-XYLULOSE|pdb-ccd:XUL|pubmed:15234337|reaxys:1723052 Graph D-Lyxulose|D-Xul|D-Xylulose|D-threo-Pentulose|D-threo-pent-2-ulose|D-xylulose D-threo-pent-2-ulose D-Lyxulose|D-Xul|D-Xylulose|D-threo-Pentulose|D-threo-pent-2-ulose|D-xylulose http://purl.obolibrary.org/obo/CHEBI_17140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17141 biolink:ChemicalEntity cysteamine An amine that consists of an ethane skeleton substituted with a thiol group at C-1 and an amino group at C-2. cas:60-23-1|chemspider:5834|drugbank:DB00847|drugcentral:768|foodb.food:FDB023091|gmelin:25385|hmdb:HMDB0002991|kegg.compound:C01678|kegg.drug:D03634|metacyc.compound:CPD-239|pdb-ccd:DHL|pubmed:11341102|pubmed:1603809|pubmed:17581819|pubmed:22039970|pubmed:22642810|pubmed:22735334|pubmed:23429057|pubmed:26043233|pubmed:26322858|reaxys:635649|wikipedia.en:Cysteamine Graph 1-amino-2-mercaptoethane|2-AMINO-ETHANETHIOL|2-Aminoethanethiol|2-amino-1-ethanethiol|2-aminoethanethiol|2-aminoethyl mercaptan|2-aminoethylthiol|2-mercaptoethanamine|2-mercaptoethylamine|Cysteamine|MEA|Thioethanolamine|beta-Aminoethanethiol|beta-MEA|beta-Mercaptoethylamine|beta-aminoethanethiol|beta-aminoethylthiol|beta-mercaptoethylamine|cysteinamine|mercaptamina|mercaptamine|mercaptaminum|mercaptoethylamine 2-Aminoethanethiol|2-aminoethanethiol 1-amino-2-mercaptoethane|2-AMINO-ETHANETHIOL|2-Aminoethanethiol|2-amino-1-ethanethiol|2-aminoethanethiol|2-aminoethyl mercaptan|2-aminoethylthiol|2-mercaptoethanamine|2-mercaptoethylamine|Cysteamine|MEA|Thioethanolamine|beta-Aminoethanethiol|beta-MEA|beta-Mercaptoethylamine|beta-aminoethanethiol|beta-aminoethylthiol|beta-mercaptoethylamine|cysteinamine|mercaptamina|mercaptamine|mercaptaminum|mercaptoethylamine http://purl.obolibrary.org/obo/CHEBI_17141 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17142 biolink:ChemicalEntity 5-formyl-2-hydroxyhepta-2,4-dienedioic acid cas:2461-62-3|kegg.compound:C04642|umbbd.compound:c0305 Graph 2-Hydroxy-5-carboxymethylmuconate semialdehyde|5-Carboxymethyl-2-hydroxymuconate semialdehyde|5-Carboxymethyl-2-hydroxymuconic semialdehyde|5-formyl-2-hydroxyhepta-2,4-dienedioic acid 5-formyl-2-hydroxyhepta-2,4-dienedioic acid 2-Hydroxy-5-carboxymethylmuconate semialdehyde|5-Carboxymethyl-2-hydroxymuconate semialdehyde|5-Carboxymethyl-2-hydroxymuconic semialdehyde|5-formyl-2-hydroxyhepta-2,4-dienedioic acid http://purl.obolibrary.org/obo/CHEBI_17142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17143 biolink:ChemicalEntity 5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1H)-one kegg.compound:C06726 Graph 5,6-Dihydroxy-3-methyl-2-oxo-1,2,5,6-tetrahydroquinoline|5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1H)-one 5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1H)-one 5,6-Dihydroxy-3-methyl-2-oxo-1,2,5,6-tetrahydroquinoline|5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1H)-one http://purl.obolibrary.org/obo/CHEBI_17143 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17144 biolink:ChemicalEntity 2-(3-amino-3-carboxypropyl)-L-histidine hmdb:HMDB0011655 Graph 2-(3-Carboxy-3-aminopropyl)-L-histidine|2-(3-amino-3-carboxypropyl)-L-histidine|2-(3-carboxy-3-aminopropyl)-L-histidine 2-(3-amino-3-carboxypropyl)-L-histidine 2-(3-Carboxy-3-aminopropyl)-L-histidine|2-(3-amino-3-carboxypropyl)-L-histidine|2-(3-carboxy-3-aminopropyl)-L-histidine http://purl.obolibrary.org/obo/CHEBI_17144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17146 biolink:ChemicalEntity anhydrotetracycline kegg.compound:C02811|pdb-ccd:TDC Graph (4S,4aS,12aS)-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide|Anhydrotetracycline (4S,4aS,12aS)-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide (4S,4aS,12aS)-4-(dimethylamino)-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide|Anhydrotetracycline http://purl.obolibrary.org/obo/CHEBI_17146 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17147 biolink:ChemicalEntity 5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one kegg.compound:C04798 Graph 5-Amino-4-chloro-2-(2',3'-dihydroxyphenyl)-3(2H)-pyridazinone|5-Amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one|Chloridazon catechol 5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one 5-Amino-4-chloro-2-(2',3'-dihydroxyphenyl)-3(2H)-pyridazinone|5-Amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one|Chloridazon catechol http://purl.obolibrary.org/obo/CHEBI_17147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17148 biolink:ChemicalEntity putrescine A four-carbon alkane-α,ω-diamine. It is obtained by the breakdown of amino acids and is responsible for the foul odour of putrefying flesh. bpdb:1393|cas:110-60-1|drugbank:DB01917|ecmdb:ECMDB01414|gmelin:1715|hmdb:HMDB0001414|kegg.compound:C00134|knapsack:C00001428|metacyc.compound:PUTRESCINE|pdb-ccd:PUT|pubmed:12053479|pubmed:15453685|pubmed:16346523|pubmed:18721677|pubmed:22735334|pubmed:24331418|pubmed:24820075|pubmed:24864091|reaxys:605282|wikipedia.en:Putrescine|ymdb:YMDB00132 Graph 1,4-Butanediamine|1,4-DIAMINOBUTANE|1,4-butylenediamine|1,4-tetramethylenediamine|Butane-1,4-diamine|H2N(CH2)4NH2|Putrescin|Putrescine|Putreszin|Tetramethylendiamin|Tetramethylenediamine|butane-1,4-diamine|butylenediamine|putrescina butane-1,4-diamine 1,4-Butanediamine|1,4-DIAMINOBUTANE|1,4-butylenediamine|1,4-tetramethylenediamine|Butane-1,4-diamine|H2N(CH2)4NH2|Putrescin|Putrescine|Putreszin|Tetramethylendiamin|Tetramethylenediamine|butane-1,4-diamine|butylenediamine|putrescina http://purl.obolibrary.org/obo/CHEBI_17148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17149 biolink:ChemicalEntity N-acetyl-beta-D-glycosaminyl glycopeptide A glycopeptide having an N-acetyl-β-D-glycosaminyl residue at the non-reducing end. kegg.compound:C04502 Graph N-acetyl-beta-D-glycosaminyl glycopeptides N-acetyl-beta-D-glycosaminyl glycopeptides http://purl.obolibrary.org/obo/CHEBI_17149 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17150 biolink:ChemicalEntity 2-phosphoglycolic acid The O-phospho derivative of glycolic acid. drugbank:DB02726|kegg.compound:C00988|knapsack:C00007561 Graph (phosphonooxy)acetic acid|2-Phosphoglycolate|2-phosphoglycolic acid|Phosphoglycolic acid (phosphonooxy)acetic acid (phosphonooxy)acetic acid|2-Phosphoglycolate|2-phosphoglycolic acid|Phosphoglycolic acid http://purl.obolibrary.org/obo/CHEBI_17150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17151 biolink:ChemicalEntity xylitol A pentitol (five-carbon sugar alcohol) having meso-configuration, being derived from xylose by reduction of the carbonyl group. cas:87-99-0|drugbank:DB01904|drugcentral:4604|gmelin:82893|hmdb:HMDB0002917|kegg.compound:C00379|kegg.drug:D00061|metacyc.compound:XYLITOL|pdb-ccd:XYL|pubmed:11154411|pubmed:11163479|pubmed:12061879|pubmed:15377394|pubmed:16708791|pubmed:16901854|pubmed:17216457|pubmed:17216458|pubmed:17336832|pubmed:17979222|pubmed:18316079|pubmed:20030329|pubmed:22735334|pubmed:22791282|pubmed:23247825|pubmed:23287496|pubmed:23338824|pubmed:23589387|pubmed:23597921|pubmed:23615861|pubmed:23796483|pubmed:23916161|pubmed:23957303|pubmed:24012734|pubmed:24643482|pubmed:25108762|reaxys:1720523|wikipedia.en:Xylitol Graph (2R,3R,4S)-Pentane-1,2,3,4,5-pentaol|(2R,3r,4S)-pentane-1,2,3,4,5-pentol|D-XYLITOL|L-xylitol|Xylit|Xylitol|meso-xylitol|xylite|xylitol (2R,3r,4S)-pentane-1,2,3,4,5-pentol|meso-xylitol (2R,3R,4S)-Pentane-1,2,3,4,5-pentaol|(2R,3r,4S)-pentane-1,2,3,4,5-pentol|D-XYLITOL|L-xylitol|Xylit|Xylitol|meso-xylitol|xylite|xylitol http://purl.obolibrary.org/obo/CHEBI_17151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17153 biolink:ChemicalEntity propanal An aldehyde that consists of ethane bearing a formyl substituent. The parent of the class of propanals. cas:123-38-6|hmdb:HMDB0003366|kegg.compound:C00479|metacyc.compound:CPD-665|pdb-ccd:CBG|pubmed:20097366|pubmed:21568340|reaxys:506010|umbbd.compound:c0207|wikipedia.en:Propanal Graph 1-Propanal|Aldehyde propionique|C2H5CHO|Methylacetaldehyde|Propaldehyde|Propanal|Propanaldehyde|Propional|Propionaldehyde|Propionic aldehyde|Propyl aldehyde|Propylaldehyde|Propylic aldehyde|n-Propanal|n-Propionaldehyde|propanal|propionaldehyde Propionaldehyde|propionaldehyde 1-Propanal|Aldehyde propionique|C2H5CHO|Methylacetaldehyde|Propaldehyde|Propanal|Propanaldehyde|Propional|Propionaldehyde|Propionic aldehyde|Propyl aldehyde|Propylaldehyde|Propylic aldehyde|n-Propanal|n-Propionaldehyde|propanal|propionaldehyde http://purl.obolibrary.org/obo/CHEBI_17153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17154 biolink:ChemicalEntity nicotinamide A pyridinecarboxamide that is pyridine in which the hydrogen at position 3 is replaced by a carboxamide group. cas:98-92-0|drugbank:DB02701|drugcentral:1906|foodb.food:FDB012485|gmelin:3336|hmdb:HMDB0001406|kegg.compound:C00153|kegg.drug:D00036|knapsack:C00000209|lincs.smallmolecule:LSM-5428|metacyc.compound:NIACINAMIDE|patent:US2904552|patent:US2993051|pdb-ccd:NCA|pubmed:10884473|pubmed:11355130|pubmed:11814060|pubmed:12014919|pubmed:12487919|pubmed:12519385|pubmed:12709297|pubmed:12782109|pubmed:12890690|pubmed:14729974|pubmed:14757966|pubmed:14871431|pubmed:15497767|pubmed:15563975|pubmed:15780941|pubmed:15807725|pubmed:15834926|pubmed:15995937|pubmed:16029679|pubmed:16209160|pubmed:16596767|pubmed:16766489|pubmed:16871361|pubmed:17021258|pubmed:17129213|pubmed:18234191|pubmed:18316796|pubmed:18368629|pubmed:18373238|pubmed:18389009|pubmed:18514428|pubmed:18930755|pubmed:18987186|pubmed:19212411|pubmed:19539713|pubmed:19544437|pubmed:2026685|pubmed:21503886|pubmed:21891976|pubmed:21918528|pubmed:21926578|pubmed:22067079|pubmed:22160932|pubmed:22207684|pubmed:22232263|pubmed:22281243|pubmed:22359146|pubmed:22361740|pubmed:22407380|pubmed:22456321|pubmed:22536229|pubmed:22543086|pubmed:22626821|pubmed:22699421|pubmed:22709272|pubmed:22763693|pubmed:22770225|pubmed:23016598|pubmed:23028781|pubmed:23043891|pubmed:23047329|pubmed:24027187|pubmed:24077178|pubmed:24559077|pubmed:24635573|pubmed:25504347|pubmed:25561219|pubmed:31710686|pubmed:32249824|pubmed:33196157|pubmed:33471934|pubmed:8620561|pubmed:8767167|pubmed:9518388|reaxys:383619|wikipedia.en:Nicotinamide Graph 3-carbamoylpyridine|3-pyridinecarboxamide|Niacinamide|Nicotinamid|Nicotinsaeureamid|Nikotinamid|Nikotinsaeureamid|Vitamin PP|beta-pyridinecarboxamide|m-(aminocarbonyl)pyridine|niacin|niamide|nicotinamida|nicotinamide|nicotinamidum|nicotine acid amide|nicotine amide|nicotinic acid amide|nicotinic amide|nicotylamide|pyridine-3-carboxamide|pyridine-3-carboxylic acid amide|vitamin B3 pyridine-3-carboxamide 3-carbamoylpyridine|3-pyridinecarboxamide|Niacinamide|Nicotinamid|Nicotinsaeureamid|Nikotinamid|Nikotinsaeureamid|Vitamin PP|beta-pyridinecarboxamide|m-(aminocarbonyl)pyridine|niacin|niamide|nicotinamida|nicotinamide|nicotinamidum|nicotine acid amide|nicotine amide|nicotinic acid amide|nicotinic amide|nicotylamide|pyridine-3-carboxamide|pyridine-3-carboxylic acid amide|vitamin B3 http://purl.obolibrary.org/obo/CHEBI_17154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17155 biolink:ChemicalEntity flavonol 3-O-(6-O-malonyl-beta-D-glucoside) Any glycosyloxyflavone that consists of a flavonol attached to a 6-O-malonyl-β-D-glucosyl residue at position 3 via a glycosidic linkage. kegg.compound:C04385 Graph 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside|Flavonol 3-O-(6-O-malonyl-beta-D-glucoside)|flavonol 3-O-(6-O-malonyl-beta-D-glucoside)s 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside|Flavonol 3-O-(6-O-malonyl-beta-D-glucoside)|flavonol 3-O-(6-O-malonyl-beta-D-glucoside)s http://purl.obolibrary.org/obo/CHEBI_17155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17156 biolink:ChemicalEntity 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol A derivative of scyllo-inositol where the 1- and 3-hydroxy groups are replaced by guanidino and amino groups respectively. kegg.compound:C01298 Graph 1-[(1R,2S,3S,4R,5S,6S)-3-amino-2,4,5,6-tetrahydroxycyclohexyl]guanidine|1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol|Amidinostreptamine 1-[(1R,2S,3S,4R,5S,6S)-3-amino-2,4,5,6-tetrahydroxycyclohexyl]guanidine 1-[(1R,2S,3S,4R,5S,6S)-3-amino-2,4,5,6-tetrahydroxycyclohexyl]guanidine|1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol|Amidinostreptamine http://purl.obolibrary.org/obo/CHEBI_17156 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17158 biolink:ChemicalEntity methylglyoxal A 2-oxo aldehyde derived from propanal. cas:78-98-8|kegg.compound:C00546|knapsack:C00007562|pubmed:10373458|pubmed:10723098|pubmed:11504881|pubmed:15520007|pubmed:17103372|pubmed:19202315|pubmed:20096340|pubmed:22983866|pubmed:23543734|pubmed:23845007|pubmed:24040205|pubmed:24168114|pubmed:26861824|pubmed:9506998|reaxys:906750|wikipedia.en:Methylglyoxal Graph 1,2-propanedione|2-Ketopropionaldehyde|2-Oxopropanal|2-oxopropanal|2-oxopropionaldehyde|CH3COCHO|Methylglyoxal|Pyruvaldehyde|Pyruvic aldehyde|acetylformaldehyde|acetylformyl|alpha-ketopropionaldehyde|methylglyoxal 2-Oxopropanal|2-oxopropanal 1,2-propanedione|2-Ketopropionaldehyde|2-Oxopropanal|2-oxopropanal|2-oxopropionaldehyde|CH3COCHO|Methylglyoxal|Pyruvaldehyde|Pyruvic aldehyde|acetylformaldehyde|acetylformyl|alpha-ketopropionaldehyde|methylglyoxal http://purl.obolibrary.org/obo/CHEBI_17158 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17159 biolink:ChemicalEntity (R)-carnitinamide beilstein:5731415|kegg.compound:C02290 Graph (2R)-4-amino-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium|(R)-carnitinamide|L-Carnitinamide (2R)-4-amino-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium (2R)-4-amino-2-hydroxy-N,N,N-trimethyl-4-oxobutan-1-aminium|(R)-carnitinamide|L-Carnitinamide http://purl.obolibrary.org/obo/CHEBI_17159 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17160 biolink:ChemicalEntity 17alpha-estradiol An estradiol that is estra-1,3,5(10)-triene substituted by hydroxy groups at positions 3 and 17 (the 17α stereoisomer). beilstein:2698044|cas:57-91-0|chemspider:61840|foodb.food:FDB011524|gmelin:2190991|hmdb:HMDB0000429|kegg.compound:C02537|kegg.drug:D07121|lincs.smallmolecule:LSM-36371|lipidmaps:LMST02010029|metacyc.compound:CPD-351|pubmed:10533159|pubmed:10977945|pubmed:11379378|pubmed:11410806|pubmed:12115026|pubmed:12234624|pubmed:15698550|pubmed:15947006|pubmed:16042770|pubmed:1810267|pubmed:18644750|pubmed:19093730|pubmed:1920120|pubmed:20451236|pubmed:22581453|pubmed:24245565|pubmed:24564600|pubmed:28877759|pubmed:7925599|pubmed:9457484|wikipedia.en:17%CE%B1-Estradiol Graph (17alpha)-estra-1,3,5(10)-triene-3,17-diol|1,3,5-estratriene-3,17alpha-diol|13beta-methyl-1,3,5(10)-gonatriene-3,17alpha-diol|17-alpha-estradiol|17-epiestradiol|17alpha-Estradiol|17alpha-oestradiol|3,17alpha-dihydroxyestra-1,3,5(10)-triene|3,17alpha-dihydroxyoestra-1,3,5(10)-triene|Estradiol-17alpha|alfatradiol|alfatradiolum|alpha-estradiol|epiestradiol|epiestrol|estra-1,3,5(10)-triene-3,17alpha-diol|estra-1,3,5(10)trien-3,17alpha-diol|oestra-1,3,5(10)-triene-3,17alpha-diol estra-1,3,5(10)-triene-3,17alpha-diol (17alpha)-estra-1,3,5(10)-triene-3,17-diol|1,3,5-estratriene-3,17alpha-diol|13beta-methyl-1,3,5(10)-gonatriene-3,17alpha-diol|17-alpha-estradiol|17-epiestradiol|17alpha-Estradiol|17alpha-oestradiol|3,17alpha-dihydroxyestra-1,3,5(10)-triene|3,17alpha-dihydroxyoestra-1,3,5(10)-triene|Estradiol-17alpha|alfatradiol|alfatradiolum|alpha-estradiol|epiestradiol|epiestrol|estra-1,3,5(10)-triene-3,17alpha-diol|estra-1,3,5(10)trien-3,17alpha-diol|oestra-1,3,5(10)-triene-3,17alpha-diol http://purl.obolibrary.org/obo/CHEBI_17160 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17161 biolink:ChemicalEntity O-demethylpuromycin A derivative of puromycin lacking the O-methyl group on the tyrosyl residue. cas:21708-87-2|kegg.compound:C02864 Graph 3'-deoxy-N,N-dimethyl-3'-(L-tyrosinamido)adenosine|O-Demethylpuromycin 3'-deoxy-N,N-dimethyl-3'-(L-tyrosinamido)adenosine 3'-deoxy-N,N-dimethyl-3'-(L-tyrosinamido)adenosine|O-Demethylpuromycin http://purl.obolibrary.org/obo/CHEBI_17161 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17162 biolink:ChemicalEntity 2-oxooctadecanoate A 2-oxo monocarboxylic acid anion resulting from the removal of the proton from the carboxy group of 2-oxooctadecanoic acid (stearic acid). The major species at pH 7.3. kegg.compound:C00869 Graph 2-oxooctadecanoate|2-oxostearate 2-oxooctadecanoate 2-oxooctadecanoate|2-oxostearate http://purl.obolibrary.org/obo/CHEBI_17162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17163 biolink:ChemicalEntity S-methyl D-thioglycerate beilstein:1701892|kegg.compound:C03804 Graph (2R)-S-methyl-1-thioglycerate|S-Methyl-1-thio-D-glycerate|S-methyl (2R)-2,3-dihydroxypropanethioate S-methyl (2R)-2,3-dihydroxypropanethioate (2R)-S-methyl-1-thioglycerate|S-Methyl-1-thio-D-glycerate|S-methyl (2R)-2,3-dihydroxypropanethioate http://purl.obolibrary.org/obo/CHEBI_17163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17164 biolink:ChemicalEntity stachyose A tetrasaccharide consisting of sucrose having an α-D-galactosyl-(1→6)-α-D-galactosyl moiety attached at the 6-position of the glucose. cas:10094-58-3|cas:470-55-3|hmdb:HMDB0003553|kegg.compound:C01613|kegg.glycan:G00278|knapsack:C00001150|pubmed:10334866|pubmed:10652123|pubmed:11789231|pubmed:1255266|pubmed:12801075|pubmed:16656948|pubmed:16658766|pubmed:16666190|pubmed:16668659|pubmed:18970754|pubmed:21421343|pubmed:7524207|pubmed:8479952|pubmed:8528153|pubmed:9629861|reaxys:1445746|reaxys:1696669|reaxys:74246|wikipedia.en:Stachyose Graph O-alpha-D-galactopyranosyl-(1->6)o-alpha-D-galactopyranosyl-(1->6)O-alpha-D-galactopyranosyl-beta-D-fructofuranoside|Stachyose|alpha-D-Galp-(1->6)-alpha-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside|stachyose beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside O-alpha-D-galactopyranosyl-(1->6)o-alpha-D-galactopyranosyl-(1->6)O-alpha-D-galactopyranosyl-beta-D-fructofuranoside|Stachyose|alpha-D-Galp-(1->6)-alpha-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside|stachyose http://purl.obolibrary.org/obo/CHEBI_17164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17165 biolink:ChemicalEntity Photinus luciferin cas:2591-17-5|gmelin:30484|kegg.compound:C02740 Graph (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid|(S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid|(S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid|(S)-4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid|(S)-4,5-dihydro-2-(6-hydroxybenzothiazol-2-yl)thiazole-4-carboxylic acid|Firefly luciferin|Photinus luciferin|firefly luciferin (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid|(S)-4,5-Dihydro-2-(6-hydroxy-1,3-benzothiazol-2-yl)thiazole-4-carboxylic acid|(S)-4,5-Dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid|(S)-4,5-dihydro-2-(6-hydroxy-2-benzothiazolyl)-4-thiazolecarboxylic acid|(S)-4,5-dihydro-2-(6-hydroxybenzothiazol-2-yl)thiazole-4-carboxylic acid|Firefly luciferin|Photinus luciferin|firefly luciferin http://purl.obolibrary.org/obo/CHEBI_17165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17166 biolink:ChemicalEntity N-methylputrescine An N-monosubstituted putrescine where the N-substituent is methyl. kegg.compound:C02723 Graph N-Methylputrescine|N-methylbutane-1,4-diamine N-methylbutane-1,4-diamine N-Methylputrescine|N-methylbutane-1,4-diamine http://purl.obolibrary.org/obo/CHEBI_17166 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:171664 biolink:ChemicalEntity antiamoebic agent An antiparasitic agent which is effective against amoeba, a genus of single-celled amoeboids in the family Amoebidae. Graph amebicide|amebicides|amoebicide|amoebicides|anti-amoebic agent|anti-amoebic agents|anti-amoebic drug|anti-amoebic drugs|antiamoebic|antiamoebic agents|antiamoebic drug|antiamoebic drugs|antiamoebics amebicide|amebicides|amoebicide|amoebicides|anti-amoebic agent|anti-amoebic agents|anti-amoebic drug|anti-amoebic drugs|antiamoebic|antiamoebic agents|antiamoebic drug|antiamoebic drugs|antiamoebics http://purl.obolibrary.org/obo/CHEBI_171664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17167 biolink:ChemicalEntity (R)-lactaldehyde The (R)-stereoisomer of lactaldehyde. kegg.compound:C00937|pubmed:14323585|pubmed:5016652|reaxys:1719826 Graph (2R)-2-hydroxypropanal|(R)-Lactaldehyde|(R)-lactaldehyde|D-2-Hydroxypropionaldehyde|D-2-hydroxypropionaldehyde|D-Lactaldehyde|D-lactaldehyde (2R)-2-hydroxypropanal (2R)-2-hydroxypropanal|(R)-Lactaldehyde|(R)-lactaldehyde|D-2-Hydroxypropionaldehyde|D-2-hydroxypropionaldehyde|D-Lactaldehyde|D-lactaldehyde http://purl.obolibrary.org/obo/CHEBI_17167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17168 biolink:ChemicalEntity 5alpha-cholest-7-en-3beta-ol A cholestanoid that is (5α)-cholest-7-ene substituted by a β-hydroxy group at position 3. cas:80-99-9|hmdb:HMDB0001170|kegg.compound:C01189|knapsack:C00023744|lipidmaps:LMST01010089|pubmed:12812989|pubmed:14511438|reaxys:3215566|wikipedia.en:Lathosterol Graph 5alpha-Cholest-7-en-3beta-ol|5alpha-cholest-7-en-3beta-ol|Lathosterol|gamma-Cholesterol|lathosterol 5alpha-Cholest-7-en-3beta-ol|5alpha-cholest-7-en-3beta-ol|Lathosterol|gamma-Cholesterol|lathosterol http://purl.obolibrary.org/obo/CHEBI_17168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:171681 biolink:ChemicalEntity Bis(2-furanylmethyl) disulfide cas:4437-20-1|chemspider:19306|hmdb:HMDB0029988 Graph 2-[(uran-2-ylmethyldisulanyl)methyl]uran 2-[(uran-2-ylmethyldisulanyl)methyl]uran 2-[(uran-2-ylmethyldisulanyl)methyl]uran http://purl.obolibrary.org/obo/CHEBI_171681 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17169 biolink:ChemicalEntity benzaldehyde An arenecarbaldehyde that consists of benzene bearing a single formyl substituent; the simplest aromatic aldehyde and parent of the class of benzaldehydes. cas:100-52-7|hmdb:HMDB0006115|kegg.compound:C00193|kegg.compound:C00261|kegg.drug:D02314|metacyc.compound:BENZALDEHYDE|pdb-ccd:HBX|pubmed:11943806|pubmed:12692643|pubmed:12738275|pubmed:12746108|pubmed:1388821|pubmed:15087594|pubmed:15658857|pubmed:16248550|pubmed:16508147|pubmed:16557466|pubmed:18348134|pubmed:20733068|pubmed:20878540|pubmed:21035797|pubmed:21538605|pubmed:21773601|pubmed:21828928|pubmed:23263855|reaxys:471223|umbbd.compound:c0279|wikipedia.en:Benzaldehyde Graph Artificial almond oil|Benzaldehyde|Benzanoaldehyde|Benzene carbaldehyde|Benzene carboxaldehyde|Benzenecarbonal|Benzenecarboxaldehyde|Benzenemethylal|Benzoic acid aldehyde|Benzoic aldehyde|Benzylaldehyde|Ethereal oil of bitter almonds|Phenylformaldehyde|Phenylmethanal|Synthetic oil of bitter almond|benzaldehyde Benzaldehyde|benzaldehyde Artificial almond oil|Benzaldehyde|Benzanoaldehyde|Benzene carbaldehyde|Benzene carboxaldehyde|Benzenecarbonal|Benzenecarboxaldehyde|Benzenemethylal|Benzoic acid aldehyde|Benzoic aldehyde|Benzylaldehyde|Ethereal oil of bitter almonds|Phenylformaldehyde|Phenylmethanal|Synthetic oil of bitter almond|benzaldehyde http://purl.obolibrary.org/obo/CHEBI_17169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17170 biolink:ChemicalEntity dimethylamine A secondary aliphatic amine where both N-substituents are methyl. cas:124-40-3|gmelin:849|hmdb:HMDB0000087|kegg.compound:C00543|metacyc.compound:DIMETHYLAMINE|pdb-ccd:DMN|pubmed:17190852|pubmed:18282650|pubmed:22074457|reaxys:605257|wikipedia.en:Dimethylamine Graph DIMETHYLAMINE|DMA|Dimethylamine|HNMe2|Me2NH|N,N-Dimethylamine|N,N-dimethylamine|N-methylmethanamine N-methylmethanamine DIMETHYLAMINE|DMA|Dimethylamine|HNMe2|Me2NH|N,N-Dimethylamine|N,N-dimethylamine|N-methylmethanamine http://purl.obolibrary.org/obo/CHEBI_17170 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17172 biolink:ChemicalEntity 2'-deoxyguanosine A purine 2'-deoxyribonucleoside having guanine as the nucleobase. cas:961-07-9|hmdb:HMDB0000085|kegg.compound:C00330|metacyc.compound:DEOXYGUANOSINE|pdb-ccd:GNG|reaxys:39814|wikipedia.en:Deoxyguanosine Graph 2'-Deoxyguanosine|2'-deoxyguanosine|2-amino-9-(2-deoxy-9-beta-D-ribofuranosyl)-9H-purin-6-ol|9-(2-deoxy-beta-D-erythro-pentofuranosyl)-guanine|Deoxyguanosine|dG|guanine deoxy nucleoside 2'-Deoxyguanosine|2'-deoxyguanosine 2'-Deoxyguanosine|2'-deoxyguanosine|2-amino-9-(2-deoxy-9-beta-D-ribofuranosyl)-9H-purin-6-ol|9-(2-deoxy-beta-D-erythro-pentofuranosyl)-guanine|Deoxyguanosine|dG|guanine deoxy nucleoside http://purl.obolibrary.org/obo/CHEBI_17172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17173 biolink:ChemicalEntity D-ribulose The D-stereoisomer of ribulose. cas:488-84-6|hmdb:HMDB0000621|kegg.compound:C00309|kegg.compound:C05052|knapsack:C00001131|metacyc.compound:D-RIBULOSE|pdb-ccd:RBL|pubmed:22344653|pubmed:24391356|pubmed:4928018|reaxys:1723050 Graph D-Arabinoketose|D-Arabinulose|D-Riboketose|D-Ribulose|D-Rul|D-erythro-2-Pentulose|D-erythro-Pent-2-ulose|D-erythro-pent-2-ulose|D-ribulose D-Ribulose|D-erythro-pent-2-ulose|D-ribulose D-Arabinoketose|D-Arabinulose|D-Riboketose|D-Ribulose|D-Rul|D-erythro-2-Pentulose|D-erythro-Pent-2-ulose|D-erythro-pent-2-ulose|D-ribulose http://purl.obolibrary.org/obo/CHEBI_17173 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17174 biolink:ChemicalEntity heparosan N-sulfate L-iduronic acid A heparan sulfate composed of a backbone of repeating α-L-iduronosyl-(1→4)-N-sulfonyl-α-D-glucosamine units joined by (1→4)-linkages. kegg.compound:C04073|pubmed:16860191 Graph Heparosan-N-sulfate L-iduronate|[4)-alpha-L-IdoA-(1->4)-alpha-D-GlcNS-(1->]n|[4)-alpha-L-IdopA-(1->4)-alpha-D-GlcpNS-(1->]n|poly[(1->4)-(alpha-L-idopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl]|poly[(1->4)-alpha-L-iduronosyl-(1->4)-N-sulfo-alpha-D-glucosaminyl] poly[(1->4)-(alpha-L-idopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl] Heparosan-N-sulfate L-iduronate|[4)-alpha-L-IdoA-(1->4)-alpha-D-GlcNS-(1->]n|[4)-alpha-L-IdopA-(1->4)-alpha-D-GlcpNS-(1->]n|poly[(1->4)-(alpha-L-idopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl]|poly[(1->4)-alpha-L-iduronosyl-(1->4)-N-sulfo-alpha-D-glucosaminyl] http://purl.obolibrary.org/obo/CHEBI_17174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:171741 biolink:ChemicalEntity cerulenin An epoxydodecadienamide isolated from several species, including Acremonium, Acrocylindrum and Helicoceras. It inhibits the biosynthesis of several lipids by interfering with enzyme function. beilstein:4807182|cas:17397-89-6|drugbank:DB01034|drugcentral:578|kegg.compound:C12058|knapsack:C00018711 Graph (2R,3S)-3-((4E,7E)-Nona-4,7-dienoyl)-oxirane-2-carboxylic acid amide|(2R,3S)-3-((4E,7E)-nona-4,7-dienoyl)oxirane-2-carboxamide|(2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide|Cerulenin (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide (2R,3S)-3-((4E,7E)-Nona-4,7-dienoyl)-oxirane-2-carboxylic acid amide|(2R,3S)-3-((4E,7E)-nona-4,7-dienoyl)oxirane-2-carboxamide|(2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide|Cerulenin http://purl.obolibrary.org/obo/CHEBI_171741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17175 biolink:ChemicalEntity guanidinoethyl methyl phosphate An organic phosphate that consists of phosphoethanolamine bearing N-amidino and O-methyl substituents. kegg.compound:C04071|reaxys:2692661 Graph 2-(carbamimidamido)ethyl methyl hydrogen phosphate|Guanidinoethyl methyl phosphate 2-(carbamimidamido)ethyl methyl hydrogen phosphate 2-(carbamimidamido)ethyl methyl hydrogen phosphate|Guanidinoethyl methyl phosphate http://purl.obolibrary.org/obo/CHEBI_17175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17176 biolink:ChemicalEntity long-chain fatty aldehyde A fatty aldehyde that has a chain length ranging from C13 to C22. kegg.compound:C00609 Graph a long-chain fatty aldehyde|long-chain fatty aldehydes a long-chain fatty aldehyde|long-chain fatty aldehydes http://purl.obolibrary.org/obo/CHEBI_17176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17177 biolink:ChemicalEntity cinnamyl alcohol A primary alcohol comprising an allyl core with a hydroxy substituent at the 1-position and a phenyl substituent at the 3-position (geometry of the C=C bond unspecified). cas:104-54-1|gmelin:27238|hmdb:HMDB0029697|kegg.compound:C02394|knapsack:C00042390|metacyc.compound:CINNAMYL-ALC|pubmed:23421457|pubmed:24190481|reaxys:1903999|wikipedia.en:Cinnamyl_alcohol Graph 3-Phenyl-2-propen-1-ol|3-phenyl-2-propen-1-ol|3-phenylprop-2-en-1-ol|Cinnamyl alcohol|Styrylcarbinol|Zimtalcohol|cinnamyl alcohol 3-phenylprop-2-en-1-ol 3-Phenyl-2-propen-1-ol|3-phenyl-2-propen-1-ol|3-phenylprop-2-en-1-ol|Cinnamyl alcohol|Styrylcarbinol|Zimtalcohol|cinnamyl alcohol http://purl.obolibrary.org/obo/CHEBI_17177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17179 biolink:ChemicalEntity taurolithocholate kegg.compound:C02592 Graph 2-[(3alpha-hydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate|taurolithocholate 2-[(3alpha-hydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate 2-[(3alpha-hydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonate|taurolithocholate http://purl.obolibrary.org/obo/CHEBI_17179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17180 biolink:ChemicalEntity 3-hydroxypyruvate A hydroxy monocarboxylic acid anion that results from the deprotonation of the carboxylic acid group of 3-hydroxypyruvic acid. kegg.compound:C00168|metacyc.compound:OH-PYR|reaxys:3904014 Graph 3-hydroxy-2-oxopropanoate|3-hydroxypyruvate 3-hydroxy-2-oxopropanoate 3-hydroxy-2-oxopropanoate|3-hydroxypyruvate http://purl.obolibrary.org/obo/CHEBI_17180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17181 biolink:ChemicalEntity 5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene beilstein:1288732|cas:1219-28-9|kegg.compound:C04485 Graph 4-(2,2'-bithien-5-yl)but-3-yn-1-yl acetate|4-(5-(2-thienyl)-2-thienyl)-3-butyn-1-ol acetate|5-(4-Acetoxybut-1-ynyl)-2,2'-bithiophene|5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene 4-(2,2'-bithien-5-yl)but-3-yn-1-yl acetate 4-(2,2'-bithien-5-yl)but-3-yn-1-yl acetate|4-(5-(2-thienyl)-2-thienyl)-3-butyn-1-ol acetate|5-(4-Acetoxybut-1-ynyl)-2,2'-bithiophene|5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene http://purl.obolibrary.org/obo/CHEBI_17181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17183 biolink:ChemicalEntity sanguinarine bpdb:2914|cas:2447-54-3|kegg.compound:C06162|knapsack:C00001917|knapsack:C00024663|lincs.smallmolecule:LSM-6639|pubmed:19346183 Graph 13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium|13-methyl[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridinium|Sanguinarine|sanguinarine 13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium 13-methyl-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridinium|13-methyl[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridinium|Sanguinarine|sanguinarine http://purl.obolibrary.org/obo/CHEBI_17183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17184 biolink:ChemicalEntity chlordecone alcohol beilstein:2160427|cas:1034-41-9|kegg.compound:C02817 Graph 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-1H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-ol|1,2,3,4,6,7,8,9,10,10-decachloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-ol|Chlordecone alcohol|chlordecone alcohol|reduced kepone 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-1H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-ol 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-1H-1,3,4-(methanetriyl)cyclobuta[cd]pentalen-2-ol|1,2,3,4,6,7,8,9,10,10-decachloropentacyclo[5.3.0.0(2,6).0(3,9).0(4,8)]decan-5-ol|Chlordecone alcohol|chlordecone alcohol|reduced kepone http://purl.obolibrary.org/obo/CHEBI_17184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17185 biolink:ChemicalEntity 2,3,5-trihydroxytoluene cas:767-81-7|kegg.compound:C03338|umbbd.compound:c0156 Graph 2,3,5-Trihydroxytoluene|2,3,5-trihydroxytoluene|6-Methylbenzene-1,2,4-triol|6-methylbenzene-1,2,4-triol 6-methylbenzene-1,2,4-triol 2,3,5-Trihydroxytoluene|2,3,5-trihydroxytoluene|6-Methylbenzene-1,2,4-triol|6-methylbenzene-1,2,4-triol http://purl.obolibrary.org/obo/CHEBI_17185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:171868 biolink:ChemicalEntity 11,12-Epoxyeicosatrienoic acid cas:81276-02-0|chemspider:4510033|hmdb:HMDB0004673|kegg.compound:C14770|lipidmaps:LMFA03090011 Graph (5E,8E)-10-[3-[(E)-oct-2-enyl]oxiran-2-yl]deca-5,8-dienoic acid (5E,8E)-10-[3-[(E)-oct-2-enyl]oxiran-2-yl]deca-5,8-dienoic acid (5E,8E)-10-[3-[(E)-oct-2-enyl]oxiran-2-yl]deca-5,8-dienoic acid http://purl.obolibrary.org/obo/CHEBI_171868 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17187 biolink:ChemicalEntity pinene kegg.compound:C06077 Graph Pinene|pinene Pinene|pinene http://purl.obolibrary.org/obo/CHEBI_17187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17188 biolink:ChemicalEntity nucleoside 5'-monophosphate kegg.compound:C01329|kegg.compound:C02520 Graph NMP|Nucleoside monophosphate|Nucleoside phosphate|nucleoside monophosphate|nucleoside monophosphates NMP|Nucleoside monophosphate|Nucleoside phosphate|nucleoside monophosphate|nucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_17188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17189 biolink:ChemicalEntity 2,5-dihydroxybenzoic acid A dihydroxybenzoic acid having the two hydroxy groups at the 2- and 5-positions. cas:490-79-9|drugcentral:3260|hmdb:HMDB0000152|kegg.compound:C00628|knapsack:C00002648|lincs.smallmolecule:LSM-19031|metacyc.compound:CPD-633|pdb-ccd:GTQ|pubmed:15862799|pubmed:18314336|pubmed:22770225|pubmed:24547933|reaxys:2209119|wikipedia.en:Gentisic_acid Graph 2,5-Dihydroxybenzoate|2,5-Dihydroxybenzoic acid|2,5-dihydroxybenzoic acid|5-hydroxysalicylic acid|Gentisate|Gentisic acid|Hydroquinonecarboxylic acid 2,5-Dihydroxybenzoate|2,5-dihydroxybenzoic acid 2,5-Dihydroxybenzoate|2,5-Dihydroxybenzoic acid|2,5-dihydroxybenzoic acid|5-hydroxysalicylic acid|Gentisate|Gentisic acid|Hydroquinonecarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17189 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:171895 biolink:ChemicalEntity Homodihydrojasmone chemspider:9312845|hmdb:HMDB0031181 Graph 2-hexyl-3-methylcyclopent-2-en-1-one 2-hexyl-3-methylcyclopent-2-en-1-one 2-hexyl-3-methylcyclopent-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_171895 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17191 biolink:ChemicalEntity L-isoleucine The L-enantiomer of isoleucine. cas:73-32-5|drugbank:DB00167|drugcentral:4129|ecmdb:ECMDB00172|gmelin:486381|hmdb:HMDB0000172|kegg.compound:C00407|kegg.drug:D00065|knapsack:C00001374|metacyc.compound:ILE|pdb-ccd:ILE|pubmed:14651987|pubmed:16140883|pubmed:17299083|pubmed:17409434|pubmed:22298573|pubmed:24284437|pubmed:24406630|pubmed:24738868|pubmed:24831709|reaxys:1721792|wikipedia.en:Isoleucine|ymdb:YMDB00038 Graph (2S,3S)-2-amino-3-methylpentanoic acid|2-Amino-3-methylvaleric acid|I|ISOLEUCINE|Ile|L-Isoleucine|L-isoleucine|alpha-amino-beta-methylvaleric acid L-Isoleucine|L-isoleucine (2S,3S)-2-amino-3-methylpentanoic acid|2-Amino-3-methylvaleric acid|I|ISOLEUCINE|Ile|L-Isoleucine|L-isoleucine|alpha-amino-beta-methylvaleric acid http://purl.obolibrary.org/obo/CHEBI_17191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17192 biolink:ChemicalEntity 3,5-dibromo-4-hydroxybenzonitrile A dibromobenzene that is 2,6-dibromophenol substituted by a cyano group at position 4. beilstein:2364039|cas:1689-84-5|gmelin:1473439|kegg.compound:C04178|pesticides:bromoxynil|ppdb:96|pubmed:11910467|pubmed:24458090|umbbd.compound:c0480|wikipedia.en:Bromoxynil Graph 2,6-dibromo-4-cyanophenol|3,5-Dibromo-4-hydroxybenzonitrile|3,5-dibromo-4-hydroxybenzonitrile|bromoxynil 3,5-Dibromo-4-hydroxybenzonitrile|3,5-dibromo-4-hydroxybenzonitrile 2,6-dibromo-4-cyanophenol|3,5-Dibromo-4-hydroxybenzonitrile|3,5-dibromo-4-hydroxybenzonitrile|bromoxynil http://purl.obolibrary.org/obo/CHEBI_17192 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17193 biolink:ChemicalEntity ADP-aldose kegg.compound:C01547 Graph ADP-aldose|ADP-aldoses ADP-aldose|ADP-aldoses http://purl.obolibrary.org/obo/CHEBI_17193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17194 biolink:ChemicalEntity bromochloromethane A halomethane that is chloromethane in which one of the hydrogens has been replaced by a bromine atom. cas:74-97-5|gmelin:25577|kegg.compound:C02661|metacyc.compound:CPD-614|pubmed:19243639|pubmed:22719758|pubmed:23638678|reaxys:1730801|wikipedia.en:Bromochloromethane Graph Bromochloromethane|Methylene chlorobromide|bromo(chloro)methane|bromochloromethane|chlorobromomethane|chloromethyl bromide|monochloromonobromomethane bromo(chloro)methane Bromochloromethane|Methylene chlorobromide|bromo(chloro)methane|bromochloromethane|chlorobromomethane|chloromethyl bromide|monochloromonobromomethane http://purl.obolibrary.org/obo/CHEBI_17194 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17196 biolink:ChemicalEntity L-asparagine An optically active form of asparagine having L-configuration. cas:70-47-3|drugbank:DB00174|drugcentral:4126|ecmdb:ECMDB00168|foodb.food:FDB000787|gmelin:3334|hmdb:HMDB0000168|kegg.compound:C00152|knapsack:C00001341|metacyc.compound:ASN|pdb-ccd:ASN|pubmed:12142634|pubmed:15907185|pubmed:16190636|pubmed:16368161|pubmed:16668324|pubmed:17497286|pubmed:21800258|pubmed:21854356|pubmed:22513289|reaxys:1723527|wikipedia.en:Asparagine|ymdb:YMDB00226 Graph (2S)-2,4-diamino-4-oxobutanoic acid|(2S)-2-amino-3-carbamoylpropanoic acid|(S)-2-amino-3-carbamoylpropanoic acid|(S)-Asparagine|2-Aminosuccinamic acid|ASPARAGINE|Asn|Aspartamic acid|L-2-aminosuccinamic acid|L-Asparagin|L-Asparagine|L-asparagine|L-aspartic acid beta-amide|N|alpha-aminosuccinamic acid ASPARAGINE|L-Asparagine|L-asparagine (2S)-2,4-diamino-4-oxobutanoic acid|(2S)-2-amino-3-carbamoylpropanoic acid|(S)-2-amino-3-carbamoylpropanoic acid|(S)-Asparagine|2-Aminosuccinamic acid|ASPARAGINE|Asn|Aspartamic acid|L-2-aminosuccinamic acid|L-Asparagin|L-Asparagine|L-asparagine|L-aspartic acid beta-amide|N|alpha-aminosuccinamic acid http://purl.obolibrary.org/obo/CHEBI_17196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17197 biolink:ChemicalEntity 1-alkylglycerone 3-phosphate A glycerone 3-phosphate having an unspecified O-alkyl substituent at the 1-position. kegg.compound:C03715 Graph 1-alkylglycerone 3-phosphates|Alkyl-glycerone 3-phosphate|Dihydroxyacetone phosphate alkyl ether|O-Alkylglycerone phosphate|O-alkylglycerone phosphates 1-alkylglycerone 3-phosphates|Alkyl-glycerone 3-phosphate|Dihydroxyacetone phosphate alkyl ether|O-Alkylglycerone phosphate|O-alkylglycerone phosphates http://purl.obolibrary.org/obo/CHEBI_17197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17198 biolink:ChemicalEntity dolichyl N-acetyl-alpha-D-glucosaminyl phosphate kegg.compound:C04678 Graph Dolichyl N-acetyl-alpha-D-glucosaminyl phosphate|alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(2-acetamido-2-deoxy-alpha-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(2-acetamido-2-deoxy-alpha-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] Dolichyl N-acetyl-alpha-D-glucosaminyl phosphate|alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(2-acetamido-2-deoxy-alpha-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] http://purl.obolibrary.org/obo/CHEBI_17198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17199 biolink:ChemicalEntity 4,5-dihydroxyphthalic acid cas:63958-66-7|kegg.compound:C03233|umbbd.compound:c0183 Graph 4,5-Dihydroxyphthalate|4,5-Dihydroxyphthalic acid|4,5-dihydroxyphthalic acid 4,5-Dihydroxyphthalate|4,5-dihydroxyphthalic acid 4,5-Dihydroxyphthalate|4,5-Dihydroxyphthalic acid|4,5-dihydroxyphthalic acid http://purl.obolibrary.org/obo/CHEBI_17199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17200 biolink:ChemicalEntity UDP-alpha-D-glucuronic acid A UDP-sugar having α-D-glucuronic acid as the sugar component. cas:2616-64-0|hmdb:HMDB0000935|kegg.compound:C00167|kegg.glycan:G10612|knapsack:C00007238|pdb-ccd:UGA|pubmed:11420884|pubmed:13984680|pubmed:14351193|pubmed:16300963|pubmed:19375693|pubmed:19564155|reaxys:78881|wikipedia.en:Uridine_diphosphate_glucuronic_acid Graph UDP-D-glucuronate|UDP-alpha-D-glucuronate|UDPglucuronate|URIDINE-5'-DIPHOSPHATE-GLUCURONIC ACID|uridine 5'-[3-(alpha-D-glucopyranuronosyl) dihydrogen diphosphate]|uridine diphosphate glucuronic acid uridine 5'-[3-(alpha-D-glucopyranuronosyl) dihydrogen diphosphate] UDP-D-glucuronate|UDP-alpha-D-glucuronate|UDPglucuronate|URIDINE-5'-DIPHOSPHATE-GLUCURONIC ACID|uridine 5'-[3-(alpha-D-glucopyranuronosyl) dihydrogen diphosphate]|uridine diphosphate glucuronic acid http://purl.obolibrary.org/obo/CHEBI_17200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17201 biolink:ChemicalEntity glycylglycine A dipeptide formed from glycine residues. cas:556-50-3|gmelin:82735|hmdb:HMDB0011733|kegg.compound:C02037|metacyc.compound:GLYCYLGLYCINE|pubmed:15283580|pubmed:872518|reaxys:1765223|wikipedia.en:Glycylglycine Graph 2-(aminoacetamido)acetic acid|Gly-Gly|Gly2|Glycylglycine|N-glycylglycine|[(aminoacetyl)amino]acetic acid|glycine dipeptide|glycylglycine Glycylglycine|glycylglycine 2-(aminoacetamido)acetic acid|Gly-Gly|Gly2|Glycylglycine|N-glycylglycine|[(aminoacetyl)amino]acetic acid|glycine dipeptide|glycylglycine http://purl.obolibrary.org/obo/CHEBI_17201 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17202 biolink:ChemicalEntity IMP A purine ribonucleoside 5'-monophosphate having hypoxanthine as the nucleobase. cas:131-99-7|drugbank:DB04566|gmelin:528845|hmdb:HMDB0000175|kegg.compound:C00130|knapsack:C00007224|metacyc.compound:IMP|pdb-ccd:IMP|pubmed:7877593|reaxys:630517|wikipedia.en:Inosinic_acid Graph 2'-inosine-5'-monophosphate|5'-IMP|5'-Inosinate|5'-Inosine monophosphate|5'-Inosinic acid|5'-inosinic acid|IMP|Inosine 5'-monophosphate|Inosine 5'-phosphate|Inosine monophosphate|Inosinic acid|hypoxanthosine 5'-monophosphate|inosinic acid|ribosylhypoxanthine monophosphate 5'-Inosinic acid|5'-inosinic acid 2'-inosine-5'-monophosphate|5'-IMP|5'-Inosinate|5'-Inosine monophosphate|5'-Inosinic acid|5'-inosinic acid|IMP|Inosine 5'-monophosphate|Inosine 5'-phosphate|Inosine monophosphate|Inosinic acid|hypoxanthosine 5'-monophosphate|inosinic acid|ribosylhypoxanthine monophosphate http://purl.obolibrary.org/obo/CHEBI_17202 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17203 biolink:ChemicalEntity L-proline Pyrrolidine in which the pro-S hydrogen at position 2 is substituted by a carboxylic acid group. L-Proline is the only one of the twenty DNA-encoded amino acids which has a secondary amino group α to the carboxyl group. It is an essential component of collagen and is important for proper functioning of joints and tendons. It also helps maintain and strengthen heart muscles. cas:147-85-3|drugbank:DB00172|drugcentral:4125|gmelin:50152|hmdb:HMDB0000162|kegg.compound:C00148|kegg.drug:D00035|knapsack:C00001388|metacyc.compound:PRO|pdb-ccd:PRO|pubmed:11076505|pubmed:12770004|pubmed:14975886|pubmed:15576824|pubmed:15838615|pubmed:15894682|pubmed:15973048|pubmed:16033917|pubmed:16190672|pubmed:16501220|pubmed:16656443|pubmed:16657874|pubmed:16668324|pubmed:17127472|pubmed:17608428|pubmed:18551589|pubmed:18802692|pubmed:18973300|pubmed:19215998|pubmed:19580280|pubmed:19656302|pubmed:19688381|pubmed:19811425|pubmed:22139509|pubmed:22201772|pubmed:22451406|pubmed:22475019|pubmed:22482728|pubmed:22491679|pubmed:22770225|reaxys:80810|wikipedia.en:L-proline Graph (-)-(S)-proline|(-)-2-pyrrolidinecarboxylic acid|(-)-proline|(2S)-pyrrolidine-2-carboxylic acid|(S)-2-carboxypyrrolidine|(S)-2-pyrrolidinecarboxylic acid|(S)-pyrrolidine-2-carboxylic acid|2-Pyrrolidinecarboxylic acid|L-(-)-proline|L-Prolin|L-Proline|L-alpha-pyrrolidinecarboxylic acid|L-proline|L-pyrrolidine-2-carboxylic acid|P|PROLINE|prolina|proline|prolinum L-Proline|L-proline|PROLINE (-)-(S)-proline|(-)-2-pyrrolidinecarboxylic acid|(-)-proline|(2S)-pyrrolidine-2-carboxylic acid|(S)-2-carboxypyrrolidine|(S)-2-pyrrolidinecarboxylic acid|(S)-pyrrolidine-2-carboxylic acid|2-Pyrrolidinecarboxylic acid|L-(-)-proline|L-Prolin|L-Proline|L-alpha-pyrrolidinecarboxylic acid|L-proline|L-pyrrolidine-2-carboxylic acid|P|PROLINE|prolina|proline|prolinum http://purl.obolibrary.org/obo/CHEBI_17203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17204 biolink:ChemicalEntity 4,5-dioxopentanoic acid A dioxo monocarboxylic acid consisting of a valeric acid core with the two oxo groups at the 4- and 5-positions. kegg.compound:C02800|pdb-ccd:HKV Graph 4,5-Dioxopentanoate|4,5-dioxopentanoic acid|4-Oxoglutarate semialdehyde|4-oxoglutarate semialdehyde 4,5-Dioxopentanoate|4,5-dioxopentanoic acid 4,5-Dioxopentanoate|4,5-dioxopentanoic acid|4-Oxoglutarate semialdehyde|4-oxoglutarate semialdehyde http://purl.obolibrary.org/obo/CHEBI_17204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17206 biolink:ChemicalEntity 9,11alpha-epoxypregn-4-ene-3,20-dione An epoxy steroid that is pregn-4-ene-3,20-dione which has an epoxy group whose oxygen is attached to the 9α and 11α-positions. beilstein:5763507|kegg.compound:C04379 Graph 9,11-alpha-epoxypregn-4-ene-3,20-dione|9,11alpha-Epoxypregn-4-ene-3,20-dione|9,11alpha-dihydrooxireno[2',3':9,11]pregn-4-ene-3,20-dione 9,11alpha-dihydrooxireno[2',3':9,11]pregn-4-ene-3,20-dione 9,11-alpha-epoxypregn-4-ene-3,20-dione|9,11alpha-Epoxypregn-4-ene-3,20-dione|9,11alpha-dihydrooxireno[2',3':9,11]pregn-4-ene-3,20-dione http://purl.obolibrary.org/obo/CHEBI_17206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17207 biolink:ChemicalEntity 2-methylideneglutaric acid A dicarboxylic acid comprising a glutaric acid core with a methylene group at the 2-position. kegg.compound:C02930 Graph 2-Methyleneglutarate|2-methylidenepentanedioic acid 2-methylidenepentanedioic acid 2-Methyleneglutarate|2-methylidenepentanedioic acid http://purl.obolibrary.org/obo/CHEBI_17207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17209 biolink:ChemicalEntity dihydrosanguinarine A benzophenanthridine alkaloid obtained by selective hydrogenation of the 13,14-position of sanguinarine. cas:3606-45-9|kegg.compound:C05191|knapsack:C00001847|knapsack:C00024647|pubmed:11488455|pubmed:11488467|pubmed:12898646|pubmed:17260290|pubmed:18309269|pubmed:18420297|pubmed:18495316|pubmed:19346183|pubmed:19578993|pubmed:19629460|pubmed:19647059|pubmed:19873781|pubmed:20226485|pubmed:20385218|pubmed:20600683|pubmed:20683512|pubmed:20686258|pubmed:21500094|reaxys:48770 Graph 13,14-Dihydro-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13,14-dihydro-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydrosanguinarine|dihydroavicine|dihydrosanguinarine 13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine 13,14-Dihydro-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13,14-dihydro-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydrosanguinarine|dihydroavicine|dihydrosanguinarine http://purl.obolibrary.org/obo/CHEBI_17209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17210 biolink:ChemicalEntity (S)-4-hydroxymandelate kegg.compound:C03198 Graph (2S)-hydroxy(4-hydroxyphenyl)acetate|(S)-4-hydroxymandelate (2S)-hydroxy(4-hydroxyphenyl)acetate (2S)-hydroxy(4-hydroxyphenyl)acetate|(S)-4-hydroxymandelate http://purl.obolibrary.org/obo/CHEBI_17210 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17211 biolink:ChemicalEntity geranyl diphosphate The diphosphate of the polyprenol compound geraniol. cas:763-10-0|drugbank:DB02552|kegg.compound:C00341|knapsack:C00000846|lipidmaps:LMPR0102010001|pdb-ccd:GPP|pubmed:19049370|pubmed:19856009|pubmed:23607888|pubmed:7753173|reaxys:1915690 Graph (2E)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate|GERANYL DIPHOSPHATE|Geranyl diphosphate|geranyl pyrophosphate (2E)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate (2E)-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate|GERANYL DIPHOSPHATE|Geranyl diphosphate|geranyl pyrophosphate http://purl.obolibrary.org/obo/CHEBI_17211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17212 biolink:ChemicalEntity 1,2-dihydroxydibenzothiophene Dibenzothiophene substituted at positions 1 and 2 by hydroxy groups. kegg.compound:C06722|metacyc.compound:12-DIHYDROXYDIBENZOTHIOPHENE|umbbd.compound:c0196 Graph 1,2-Dihydroxydibenzothiophene|1,2-dihydroxydibenzothiophene|dibenzo[b,d]thiophene-1,2-diol|dibenzothiophene-1,2-diol dibenzo[b,d]thiophene-1,2-diol 1,2-Dihydroxydibenzothiophene|1,2-dihydroxydibenzothiophene|dibenzo[b,d]thiophene-1,2-diol|dibenzothiophene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_17212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17213 biolink:ChemicalEntity D-lysopine The N2-(R)-1-carboxyethyl derivative of L-lysine. cas:34522-31-1|kegg.compound:C04020|knapsack:C00001544 Graph (R)-N(2)-(1-Carboxyethyl)-L-lysine|D-Lysopine|D-lysopine|Lysopine|N(2)-(D-1-carboxyethyl)-L-lysine|N(2)-[(1R)-1-carboxyethyl]-L-lysine|N2-(D-1-Carboxyethyl)-L-lysine N(2)-[(1R)-1-carboxyethyl]-L-lysine (R)-N(2)-(1-Carboxyethyl)-L-lysine|D-Lysopine|D-lysopine|Lysopine|N(2)-(D-1-carboxyethyl)-L-lysine|N(2)-[(1R)-1-carboxyethyl]-L-lysine|N2-(D-1-Carboxyethyl)-L-lysine http://purl.obolibrary.org/obo/CHEBI_17213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17215 biolink:ChemicalEntity methyl L-tyrosinate An L-tyrosyl ester that is the methyl ester of L-tyrosine. cas:1080-06-4|hmdb:HMDB0029217|kegg.compound:C03404|pubmed:12459019|pubmed:24434201|pubmed:3656360|pubmed:8385625|reaxys:2372626 Graph 2-Amino-3-(4-hydroxy-phenyl)-propionic acid methyl ester|L-Tyrosine methyl ester|L-tyrosine methyl ester|Tyr-OMe|Tyrosine methyl ester|methyl L-tyrosinate methyl L-tyrosinate 2-Amino-3-(4-hydroxy-phenyl)-propionic acid methyl ester|L-Tyrosine methyl ester|L-tyrosine methyl ester|Tyr-OMe|Tyrosine methyl ester|methyl L-tyrosinate http://purl.obolibrary.org/obo/CHEBI_17215 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17216 biolink:ChemicalEntity oxidized Cypridina luciferin kegg.compound:C03887 Graph 1-(3-{6-(1H-indol-3-yl)-3-[(2S)-2-methylbutanamido]pyrazin-2-yl}propyl)guanidine|Oxidized Cypridina luciferin 1-(3-{6-(1H-indol-3-yl)-3-[(2S)-2-methylbutanamido]pyrazin-2-yl}propyl)guanidine 1-(3-{6-(1H-indol-3-yl)-3-[(2S)-2-methylbutanamido]pyrazin-2-yl}propyl)guanidine|Oxidized Cypridina luciferin http://purl.obolibrary.org/obo/CHEBI_17216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17217 biolink:ChemicalEntity 2-butenoic acid A butenoic acid having the double bond at position C-2. cas:3724-65-0|gmelin:324286|kegg.compound:C01771|reaxys:1098434 Graph 2-Butenoate|2-Butenoic acid|2-butenic acid|3-methylacrylic acid|CTA|Crotonic acid|Crotonsaeure|acide crotonique|alpha-butenoic acid|alpha-crotonic acid|beta-methacrylic acid|beta-methylacrylic acid|but-2-enoic acid but-2-enoic acid 2-Butenoate|2-Butenoic acid|2-butenic acid|3-methylacrylic acid|CTA|Crotonic acid|Crotonsaeure|acide crotonique|alpha-butenoic acid|alpha-crotonic acid|beta-methacrylic acid|beta-methylacrylic acid|but-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_17217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17219 biolink:ChemicalEntity limonene-1,2-diol beilstein:2553629|cas:1946-00-5|kegg.compound:C07276|kegg.compound:C18020 Graph 1,2-Cyclohexanediol, 1-methyl-4-(1-methylethenyl)-|1-Methyl-4-(1-methylethenyl)-1,2-cyclohexanediol|1-Methyl-4-(1-methylvinyl)cyclohexane-1,2-diol|1-methyl-4-(prop-1-en-2-yl)cyclohexane-1,2-diol|Limonene-1,2-diol|Menth-8-ene-1,2-diol|limonene-1,2-diol|p-Menth-8(9)-ene-1,2-diol 1-methyl-4-(prop-1-en-2-yl)cyclohexane-1,2-diol 1,2-Cyclohexanediol, 1-methyl-4-(1-methylethenyl)-|1-Methyl-4-(1-methylethenyl)-1,2-cyclohexanediol|1-Methyl-4-(1-methylvinyl)cyclohexane-1,2-diol|1-methyl-4-(prop-1-en-2-yl)cyclohexane-1,2-diol|Limonene-1,2-diol|Menth-8-ene-1,2-diol|limonene-1,2-diol|p-Menth-8(9)-ene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_17219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1722 biolink:ChemicalEntity 3beta-hydroxy-Delta(5)-steroid Any 3β-hydroxy-steroid that contains a double bond between positions 5 and 6. kegg.compound:C03836|metacyc.compound:3b-hydroxy-D5-steroids Graph 3beta-hydroxy Delta(5)-steroids|3beta-hydroxy-Delta(5)-steroids|a 3-beta-hydroxy-Delta(5)-steroid 3beta-hydroxy Delta(5)-steroids|3beta-hydroxy-Delta(5)-steroids|a 3-beta-hydroxy-Delta(5)-steroid http://purl.obolibrary.org/obo/CHEBI_1722 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17221 biolink:ChemicalEntity beta-myrcene A monoterpene that is octa-1,6-diene bearing methylene and methyl substituents at positions 3 and 7 respectively. cas:123-35-3|gmelin:279258|hmdb:HMDB0038169|kegg.compound:C06074|knapsack:C00000853|lipidmaps:LMPR0102010005|metacyc.compound:CPD-4888|pubmed:15299125|pubmed:25280163|pubmed:25503374|pubmed:25622554|pubmed:25909988|pubmed:27439360|pubmed:9268308|reaxys:1719990|wikipedia.en:Myrcene Graph 7-methyl-3-methylene-1,6-octadiene|7-methyl-3-methyleneocta-1,6-diene|7-methyl-3-methylideneocta-1,6-diene|Beta-myrcene|Myrcene|beta-Myrcene 7-methyl-3-methylideneocta-1,6-diene 7-methyl-3-methylene-1,6-octadiene|7-methyl-3-methyleneocta-1,6-diene|7-methyl-3-methylideneocta-1,6-diene|Beta-myrcene|Myrcene|beta-Myrcene http://purl.obolibrary.org/obo/CHEBI_17221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17223 biolink:ChemicalEntity polyprenyl glucosyl phosphate Graph polyprenyl glucosyl phosphates polyprenyl glucosyl phosphates http://purl.obolibrary.org/obo/CHEBI_17223 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17224 biolink:ChemicalEntity 4-methylumbelliferone A hydroxycoumarin that is umbelliferone substituted by a methyl group at position 4. cas:90-33-5|drugcentral:1401|gmelin:165817|hmdb:HMDB0059622|kegg.compound:C03081|kegg.drug:D00170|lincs.smallmolecule:LSM-3025|metacyc.compound:CPD-182|pdb-ccd:4MU|pubmed:12419303|pubmed:1650428|pubmed:17470403|pubmed:20332231|pubmed:23124556|pubmed:23228386|pubmed:24080584|pubmed:26548718|reaxys:142217|wikipedia.en:Hymecromone Graph 4-MU|4-Methyl-7-hydroxycoumarin|4-Methylumbelliferone|4-methylumbelliferone|7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran|7-Hydroxy-4-methyl-2-oxo-3-chromene|7-Hydroxy-4-methyl-2H-1-benzopyran-2-one|7-Hydroxy-4-methylcoumarin|7-hydroxy-4-methyl-2H-chromen-2-one|Hymecromone|Imecromone|beta-Methylumbelliferone|himecromona|hymecromone|hymecromonum 7-hydroxy-4-methyl-2H-chromen-2-one 4-MU|4-Methyl-7-hydroxycoumarin|4-Methylumbelliferone|4-methylumbelliferone|7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran|7-Hydroxy-4-methyl-2-oxo-3-chromene|7-Hydroxy-4-methyl-2H-1-benzopyran-2-one|7-Hydroxy-4-methylcoumarin|7-hydroxy-4-methyl-2H-chromen-2-one|Hymecromone|Imecromone|beta-Methylumbelliferone|himecromona|hymecromone|hymecromonum http://purl.obolibrary.org/obo/CHEBI_17224 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17225 biolink:ChemicalEntity salutaridine A morphinane alkaloid from the opium poppy, in which the 5,6,8,14-tetradehydromorphinan-7-one skeleton is substituted at position 4 by a hydroxyl group, positions 3 and 6 by methoxy groups and position N17 by a methyl group. An intermediate in the biosynthesis of narcotic analgesics such as morphine and codeine. beilstein:4788633|cas:1936-18-1|kegg.compound:C05179|knapsack:C00001916|pubmed:17226487|pubmed:17611928|reaxys:1630083|wikipedia.en:Salutaridine Graph 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7-one|5,6,8,14-Tetradehydro-4-hydroxy-3,6-dimethoxy-17-methyl-morphinan-7-one|Salutaridine|Sinoacutine 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7-one 4-hydroxy-3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-7-one|5,6,8,14-Tetradehydro-4-hydroxy-3,6-dimethoxy-17-methyl-morphinan-7-one|Salutaridine|Sinoacutine http://purl.obolibrary.org/obo/CHEBI_17225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17226 biolink:ChemicalEntity rosmarinic acid The 1-carboxy-2-(2,4-dihydroxyphenyl)ethyl ester of trans-caffeic acid. cas:537-15-5|pubmed:12482446|pubmed:20071057|pubmed:21364781|pubmed:21838541|pubmed:22236574|pubmed:22439433|pubmed:23016274|pubmed:23116643|pubmed:23122135|pubmed:23381830|pubmed:23414442|pubmed:23548128|pubmed:24085626|pubmed:24097334|pubmed:24262570 Graph 3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid|R-(+)-2-(3,4-Dihydroxycinnamoyloxy)-3-(3,4-dihydroxyphenyl)propionic acid|alpha-(((3,4-Dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-3,4-dihydroxy- benzenepropanoic acid 3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid 3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid|R-(+)-2-(3,4-Dihydroxycinnamoyloxy)-3-(3,4-dihydroxyphenyl)propionic acid|alpha-(((3,4-Dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-3,4-dihydroxy- benzenepropanoic acid http://purl.obolibrary.org/obo/CHEBI_17226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17228 biolink:ChemicalEntity taurocyamine The N-amidino derivative of taurine. beilstein:1775583|cas:543-18-0|kegg.compound:C01959|pdb-ccd:3S5 Graph 2-(carbamimidamido)ethanesulfonic acid|2-{[amino(imino)methyl]amino}ethanesulfonic acid|N-(aminoiminomethyl) taurine|Taurocyamine|guanidinoethane sulfonic acid 2-(carbamimidamido)ethanesulfonic acid 2-(carbamimidamido)ethanesulfonic acid|2-{[amino(imino)methyl]amino}ethanesulfonic acid|N-(aminoiminomethyl) taurine|Taurocyamine|guanidinoethane sulfonic acid http://purl.obolibrary.org/obo/CHEBI_17228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17229 biolink:ChemicalEntity 5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene beilstein:1320331|kegg.compound:C04711 Graph 1-acetoxy-4-[2,2']bithiophenyl-5-ylbut-3-yn-2-ol|4-(2,2'-bithien-5-yl)-2-hydroxybut-3-yn-1-yl acetate|5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene|5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene 4-(2,2'-bithien-5-yl)-2-hydroxybut-3-yn-1-yl acetate 1-acetoxy-4-[2,2']bithiophenyl-5-ylbut-3-yn-2-ol|4-(2,2'-bithien-5-yl)-2-hydroxybut-3-yn-1-yl acetate|5-(3-Hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene|5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene http://purl.obolibrary.org/obo/CHEBI_17229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17230 biolink:ChemicalEntity homocysteine A sulfur-containing amino acid consisting of a glycine core with a 2-mercaptoethyl side-chain. hmdb:HMDB0000742|kegg.compound:C05330|pubmed:11133260|pubmed:16596805|pubmed:18370634|wikipedia.en:Homocysteine Graph 2-Amino-4-mercaptobutyric acid|2-amino-4-sulfanylbutanoic acid|Hcy|Homocysteine|homocysteine 2-amino-4-sulfanylbutanoic acid|Homocysteine|homocysteine 2-Amino-4-mercaptobutyric acid|2-amino-4-sulfanylbutanoic acid|Hcy|Homocysteine|homocysteine http://purl.obolibrary.org/obo/CHEBI_17230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17231 biolink:ChemicalEntity m-cresol A cresol with the methyl substituent at position 3. It is a minor urinary metabolite of toluene. cas:108-39-4|drugbank:DB01776|gmelin:101411|hmdb:HMDB0002048|kegg.compound:C01467|kegg.drug:D04951|metacyc.compound:CPD-112|pdb-ccd:CRS|pubmed:15687000|pubmed:23190556|reaxys:506719|umbbd.compound:c0282|wikipedia.en:M-cresol Graph 1-hydroxy-3-methylbenzene|3-Cresol|3-Hydroxytoluene|3-methylphenol|M-CRESOL|m-Cresol|m-Kresol|m-methylphenol|meta-cresol|metacresol 3-methylphenol 1-hydroxy-3-methylbenzene|3-Cresol|3-Hydroxytoluene|3-methylphenol|M-CRESOL|m-Cresol|m-Kresol|m-methylphenol|meta-cresol|metacresol http://purl.obolibrary.org/obo/CHEBI_17231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17232 biolink:ChemicalEntity L-glutamic 5-semialdehyde A glutamic semialdehyde arising from formal reduction of the side-chain carboxy group of L-glutamic acid. beilstein:1704370|cas:496-92-4|kegg.compound:C01165|knapsack:C00007475 Graph (2S)-2-amino-5-oxopentanoic acid|5-oxo-L-norvaline|L-Glutamate 5-semialdehyde|L-Glutamate gamma-semialdehyde (2S)-2-amino-5-oxopentanoic acid (2S)-2-amino-5-oxopentanoic acid|5-oxo-L-norvaline|L-Glutamate 5-semialdehyde|L-Glutamate gamma-semialdehyde http://purl.obolibrary.org/obo/CHEBI_17232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17233 biolink:ChemicalEntity (3Z,5S)-3-(1-hydroxyethylidene)-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione beilstein:5356455 Graph (3Z,5S)-3-(1-hydroxyethylidene)-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione (3Z,5S)-3-(1-hydroxyethylidene)-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione (3Z,5S)-3-(1-hydroxyethylidene)-5-{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione http://purl.obolibrary.org/obo/CHEBI_17233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172333 biolink:ChemicalEntity HET0016 chemspider:2009610|pdb-ccd:V16 Graph N'-(4-butyl-2-methylphenyl)-N-hydroxymethanimidamide N'-(4-butyl-2-methylphenyl)-N-hydroxymethanimidamide N'-(4-butyl-2-methylphenyl)-N-hydroxymethanimidamide http://purl.obolibrary.org/obo/CHEBI_172333 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17234 biolink:ChemicalEntity glucose An aldohexose used as a source of energy and metabolic intermediate. cas:50-99-7|kegg.compound:C00293|wikipedia.en:Glucose Graph DL-glucose|Glc|Glucose|Glukose|gluco-hexose|glucose Glucose|gluco-hexose|glucose DL-glucose|Glc|Glucose|Glukose|gluco-hexose|glucose http://purl.obolibrary.org/obo/CHEBI_17234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17236 biolink:ChemicalEntity 2-hydroxy-6-oxohexa-2,4-dienoic acid A muconic semialdehyde having a hydroxy substituent at the 2-position. cas:3270-98-2|kegg.compound:C00682|umbbd.compound:c0107 Graph 2-Hydroxymuconate semialdehyde|2-Hydroxymuconic semialdehyde|2-hydroxy-6-oxohexa-2,4-dienoic acid|2-hydroxymuconic semialdehyde 2-hydroxy-6-oxohexa-2,4-dienoic acid 2-Hydroxymuconate semialdehyde|2-Hydroxymuconic semialdehyde|2-hydroxy-6-oxohexa-2,4-dienoic acid|2-hydroxymuconic semialdehyde http://purl.obolibrary.org/obo/CHEBI_17236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17237 biolink:ChemicalEntity (E)-4-(trimethylammonio)but-2-enoate beilstein:4377338|cas:927-89-9|kegg.compound:C04114 Graph (2E)-4-(trimethylammonio)but-2-enoate|(3-carboxyallyl)trimethylammonium hydroxide, inner salt|Crotonsaeurebetain|croton betaine|crotonic acid betaine|crotonobetaine (2E)-4-(trimethylammonio)but-2-enoate (2E)-4-(trimethylammonio)but-2-enoate|(3-carboxyallyl)trimethylammonium hydroxide, inner salt|Crotonsaeurebetain|croton betaine|crotonic acid betaine|crotonobetaine http://purl.obolibrary.org/obo/CHEBI_17237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17239 biolink:ChemicalEntity CDP A pyrimidine ribonucleoside 5'-diphosphate having cytosine as the nucleobase. cas:63-38-7|drugbank:DB04555|kegg.compound:C00112|pdb-ccd:CDF|pdb-ccd:CDP Graph 5'-CDP|CDP|CYTIDINE-5'-DIPHOSPHATE|Cytidine 5'-diphosphate|Cytidine 5'-diphosphoric acid|Cytidine 5'-pyrophosphate|Cytidine diphosphate|Cytidine, 5'-(trihydrogen pyrophosphate)|cytidine 5'-(trihydrogen diphosphate) cytidine 5'-(trihydrogen diphosphate) 5'-CDP|CDP|CYTIDINE-5'-DIPHOSPHATE|Cytidine 5'-diphosphate|Cytidine 5'-diphosphoric acid|Cytidine 5'-pyrophosphate|Cytidine diphosphate|Cytidine, 5'-(trihydrogen pyrophosphate)|cytidine 5'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172390 biolink:ChemicalEntity glycol ether A hydroxyether which contains both an ether and alcohol functional groups. It is one of the most versatile classes of organic solvents which are commonly used in paints, cleaners, adhesives, pharmaceuticals and cosmetics. pubmed:28650840|pubmed:29536623|pubmed:30471335|pubmed:31518935|pubmed:32172156|wikipedia.en:Glycol_ethers Graph glycol ethers glycol ethers http://purl.obolibrary.org/obo/CHEBI_172390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17240 biolink:ChemicalEntity itaconate(2-) A dicarboxylic acid dianion that results from the deprotonation of both of the carboxylic acid groups of itaconic acid. cas:2964-00-3|gmelin:327340|kegg.compound:C00490|metacyc.compound:ITACONATE|reaxys:3904702 Graph 2-methylidenebutanedioate|itaconate|methylenesuccinate(2-)|methylenesuccinic acid, ion(2-) 2-methylidenebutanedioate 2-methylidenebutanedioate|itaconate|methylenesuccinate(2-)|methylenesuccinic acid, ion(2-) http://purl.obolibrary.org/obo/CHEBI_17240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172403 biolink:ChemicalEntity 1,2-dilinoleoyl-sn-glycero-3-phosphoethanolamine zwitterion pubmed:22941046 Graph 1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine|1,2-di-(9Z,12Z-octadecadienoyl)-sn-phosphatidylethanolamine zwitterion|PE(18:2(9Z,12Z)/18:2(9Z,12Z)) zwitterion 1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine|1,2-di-(9Z,12Z-octadecadienoyl)-sn-phosphatidylethanolamine zwitterion|PE(18:2(9Z,12Z)/18:2(9Z,12Z)) zwitterion http://purl.obolibrary.org/obo/CHEBI_172403 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17241 biolink:ChemicalEntity 1H-pyrazole The 1H-tautomer of pyrazole. cas:288-13-1|drugbank:DB02757|gmelin:1360|kegg.compound:C00481|pdb-ccd:PZO|reaxys:103775 Graph 1,2-Diazole|1H-Pyrazol|1H-pyrazole|Hpz|PYRAZOLE|Pyrazole|pyrazole 1H-pyrazole|PYRAZOLE|Pyrazole 1,2-Diazole|1H-Pyrazol|1H-pyrazole|Hpz|PYRAZOLE|Pyrazole|pyrazole http://purl.obolibrary.org/obo/CHEBI_17241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17242 biolink:ChemicalEntity dehydroascorbic acid cas:7723-73-1 Graph 5-(1,2-dihydroxyethyl)furan-2,3,4(5H)-trione|Dehydroascorbate|Dehydroascorbic acid|dehydroascorbates 5-(1,2-dihydroxyethyl)furan-2,3,4(5H)-trione 5-(1,2-dihydroxyethyl)furan-2,3,4(5H)-trione|Dehydroascorbate|Dehydroascorbic acid|dehydroascorbates http://purl.obolibrary.org/obo/CHEBI_17242 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17243 biolink:ChemicalEntity mono(2-ethylhexyl) phthalate The mono(2-ethylhexyl) ester of benzene-1,2-dicarboxylic acid. beilstein:3206630|cas:4376-20-9|kegg.compound:C03343|lincs.smallmolecule:LSM-36855 Graph (2-ethylhexyl) hydrogen phthalate|1,2-benzenedicarboxylic acid, mono(2-ethylhexyl) ester|2-(2-ethylhexyloxycarbonyl)benzoic acid|2-([(2-ethylhexyl)oxy]carbonyl)benzoic acid|2-Ethylhexyl phthalate|2-ethylhexyl hydrogen phthalate|MEHP|mono(2-ethylhexyl)phthalate|mono-(2-ethylhexyl)phthalate|mono-2-ethylhexyl phthalate|monoethylhexyl phthalate|phthalic acid, 2-ethylhexyl ester 2-(2-ethylhexyloxycarbonyl)benzoic acid (2-ethylhexyl) hydrogen phthalate|1,2-benzenedicarboxylic acid, mono(2-ethylhexyl) ester|2-(2-ethylhexyloxycarbonyl)benzoic acid|2-([(2-ethylhexyl)oxy]carbonyl)benzoic acid|2-Ethylhexyl phthalate|2-ethylhexyl hydrogen phthalate|MEHP|mono(2-ethylhexyl)phthalate|mono-(2-ethylhexyl)phthalate|mono-2-ethylhexyl phthalate|monoethylhexyl phthalate|phthalic acid, 2-ethylhexyl ester http://purl.obolibrary.org/obo/CHEBI_17243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17244 biolink:ChemicalEntity 5,6-dihydroquinoline-2,5,6-triol kegg.compound:C06339 Graph 2,5,6-Trihydroxy-5,6-dihydroquinoline|5,6-dihydroquinoline-2,5,6-triol 5,6-dihydroquinoline-2,5,6-triol 2,5,6-Trihydroxy-5,6-dihydroquinoline|5,6-dihydroquinoline-2,5,6-triol http://purl.obolibrary.org/obo/CHEBI_17244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17245 biolink:ChemicalEntity carbon monoxide A one-carbon compound in which the carbon is joined only to a single oxygen. It is a colourless, odourless, tasteless, toxic gas. beilstein:1900508|beilstein:3535285|beilstein:3587264|cas:630-08-0|gmelin:421|hmdb:HMDB0001361|kegg.compound:C00237|kegg.drug:D09706|metacyc.compound:CARBON-MONOXIDE|molbase:753|pdb-ccd:CMO|pubmed:10085152|pubmed:10679539|pubmed:11572959|pubmed:14527438|pubmed:14563665|pubmed:15127883|pubmed:15598489|pubmed:16371440|pubmed:16520836|pubmed:17041734|pubmed:18094356|pubmed:19909254|pubmed:23762709|pubmed:7022476|pubmed:8240252|pubmed:8620577|umbbd.compound:c0369|wikipedia.en:Carbon_monoxide Graph C#O|CARBON MONOXIDE|CO|Carbon monoxide|[CO]|carbon monooxide|carbon monoxide|carbon(II) oxide CARBON MONOXIDE|Carbon monoxide|carbon monooxide|carbon monoxide|carbon(II) oxide C#O|CARBON MONOXIDE|CO|Carbon monoxide|[CO]|carbon monooxide|carbon monoxide|carbon(II) oxide http://purl.obolibrary.org/obo/CHEBI_17245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17246 biolink:ChemicalEntity poly(vinyl alcohol) macromolecule A homopolymer macromolecule obtained by polymerisation of vinyl alcohol. cas:9002-89-5|kegg.compound:C00980|kegg.drug:D02320|pubmed:21628086|pubmed:21680612|pubmed:22036988|pubmed:22040352|pubmed:22252656|pubmed:22275820|pubmed:22278052|pubmed:22370251|pubmed:22435602|pubmed:22514196|pubmed:22592478|pubmed:22748429|pubmed:22789109|pubmed:22793061|pubmed:22849091|pubmed:23012555|pubmed:23039272|wikipedia.en:Poly(vinyl_alcohol) Graph PVA|Polyvinyl alcohol|a polyvinyl alcohol|poly(1-hydroxyethylene)|poly(vinyl alcohol) poly(1-hydroxyethylene) PVA|Polyvinyl alcohol|a polyvinyl alcohol|poly(1-hydroxyethylene)|poly(vinyl alcohol) http://purl.obolibrary.org/obo/CHEBI_17246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17247 biolink:ChemicalEntity N-isopropylammelide A dihydroxy-1,3,5-triazine consisting of ammelide bearing an N-isopropyl substituent. cas:35200-63-6|kegg.compound:C06553|pubmed:17660279|pubmed:18237303|pubmed:19581468|pubmed:9422605|reaxys:515389|umbbd.compound:c0162 Graph 6-(isopropylamino)-1,3,5-triazine-2,4-diol|N-Isopropylammelide|N-isopropylammelide 6-(isopropylamino)-1,3,5-triazine-2,4-diol 6-(isopropylamino)-1,3,5-triazine-2,4-diol|N-Isopropylammelide|N-isopropylammelide http://purl.obolibrary.org/obo/CHEBI_17247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17248 biolink:ChemicalEntity 6-lactoyl-5,6,7,8-tetrahydropterin cas:33405-80-0|hmdb:HMDB0002065|kegg.compound:C04244 Graph 2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(3H)-one|2-amino-6-lactoyl-5,6,7,8-tetrahydropteridin-4(3H)-one|6-1'-Oxo-2'-hydroxypropyl tetrahydropterin|6-Lactoyl-5,6,7,8-tetrahydropterin|6-Lactoyltetrahydropterin 2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(3H)-one 2-amino-6-(2-hydroxypropanoyl)-5,6,7,8-tetrahydropteridin-4(3H)-one|2-amino-6-lactoyl-5,6,7,8-tetrahydropteridin-4(3H)-one|6-1'-Oxo-2'-hydroxypropyl tetrahydropterin|6-Lactoyl-5,6,7,8-tetrahydropterin|6-Lactoyltetrahydropterin http://purl.obolibrary.org/obo/CHEBI_17248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17249 biolink:ChemicalEntity D-nopaline An amino acid opine resulting from the formal reductive condensation of the amino group of L-arginine with the keto group of 2-oxopentanedioic acid. cas:22350-70-5|kegg.compound:C01682|knapsack:C00001548 Graph (2R)-2-{[(1S)-4-carbamimidamido-1-carboxybutyl]amino}pentanedioic acid|(S)-N-(4-((Aminoiminomethyl)amino)-1-carboxybutyl)-D-glutamic acid|D-Nopaline|N(2)-(D-1,3-dicarboxypropyl)-L-arginine|N-[(1S)-4-carbamimidamido-1-carboxybutyl]-D-glutamic acid|N-[4-[(Aminoiminomethyl)amino]-1-carboxybutyl]-D-glutamic acid(ECL)|N2-(D-1,3-Dicarboxypropyl)-L-arginine|Nopaline (2R)-2-{[(1S)-4-carbamimidamido-1-carboxybutyl]amino}pentanedioic acid|N-[(1S)-4-carbamimidamido-1-carboxybutyl]-D-glutamic acid (2R)-2-{[(1S)-4-carbamimidamido-1-carboxybutyl]amino}pentanedioic acid|(S)-N-(4-((Aminoiminomethyl)amino)-1-carboxybutyl)-D-glutamic acid|D-Nopaline|N(2)-(D-1,3-dicarboxypropyl)-L-arginine|N-[(1S)-4-carbamimidamido-1-carboxybutyl]-D-glutamic acid|N-[4-[(Aminoiminomethyl)amino]-1-carboxybutyl]-D-glutamic acid(ECL)|N2-(D-1,3-Dicarboxypropyl)-L-arginine|Nopaline http://purl.obolibrary.org/obo/CHEBI_17249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17250 biolink:ChemicalEntity 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid A tricarboxylic acid that is the 2-oxo derivative of homocitric acid. kegg.compound:C04115 Graph 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid|4-carboxy-4-hydroxy-2-oxoadipic acid|4-hydroxy-4-carboxymethyl-2-oxoglutaric acid 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid|4-carboxy-4-hydroxy-2-oxoadipic acid|4-hydroxy-4-carboxymethyl-2-oxoglutaric acid http://purl.obolibrary.org/obo/CHEBI_17250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17251 biolink:ChemicalEntity pentalenene cas:73306-73-7|kegg.compound:C01841|knapsack:C00021799|reaxys:3603613 Graph (+)-pentalenene|(1R,3aS,5aS,8aR)-1,2,3,3a,5a,6,7,8-octahydro-1,4,7,7-tetramethylcyclopenta[c]pentalene|(1R,3aS,5aS,8aR)-1,4,7,7-tetramethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene|(1alpha,3a alpha,5a beta,8aR*)-1,2,3,3a,5a,6,7,8-octahydro-1,4,7,7-tetramethylcyclopenta(c)pentalene|Pentalenene|pentalenene (1R,3aS,5aS,8aR)-1,4,7,7-tetramethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene (+)-pentalenene|(1R,3aS,5aS,8aR)-1,2,3,3a,5a,6,7,8-octahydro-1,4,7,7-tetramethylcyclopenta[c]pentalene|(1R,3aS,5aS,8aR)-1,4,7,7-tetramethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene|(1alpha,3a alpha,5a beta,8aR*)-1,2,3,3a,5a,6,7,8-octahydro-1,4,7,7-tetramethylcyclopenta(c)pentalene|Pentalenene|pentalenene http://purl.obolibrary.org/obo/CHEBI_17251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17252 biolink:ChemicalEntity 17alpha-hydroxyprogesterone A 17α-hydroxy steroid that is the 17α-hydroxy derivative of progesterone. cas:68-96-2|hmdb:HMDB0000374|kegg.compound:C01176|kegg.drug:D08052|lipidmaps:LMST02030161|metacyc.compound:17-ALPHA-HYDROXYPROGESTERONE|pdb-ccd:3QZ|pubmed:1167988|pubmed:12915667|pubmed:14999215|pubmed:15863951|pubmed:17066953|pubmed:17096820|pubmed:17128559|pubmed:18573861|pubmed:19390483|pubmed:25301938|pubmed:28539365|pubmed:28980354|pubmed:4339047|pubmed:4343782|pubmed:4628727|pubmed:4678211|pubmed:4678212|pubmed:5061166|pubmed:5065810|pubmed:5098538|pubmed:518278|pubmed:5571099|pubmed:6632812|pubmed:72488|pubmed:8496956|pubmed:9931518|reaxys:2062088|wikipedia.en:17-Hydroxyprogesterone|wikipedia.en:Hydroxyprogesterone Graph 17-Hydroxypregn-4-en-3,20-dione|17-alpha-hydroxyprogesterone|17-hydroxypregn-4-ene-3,20-dione|17-hydroxyprogesterone|17alpha-Hydroxy-4-pregnene-3,20-dione|17alpha-Hydroxy-progesterone|17alpha-Hydroxyprogesterone|Pregn-4-ene-3,20-dione-17-ol|delta(4)-Pregnene-17alpha-ol-3,20-dione|hidroxiprogesterona|hydroxyprogesterone|hydroxyprogesteronum 17-hydroxypregn-4-ene-3,20-dione 17-Hydroxypregn-4-en-3,20-dione|17-alpha-hydroxyprogesterone|17-hydroxypregn-4-ene-3,20-dione|17-hydroxyprogesterone|17alpha-Hydroxy-4-pregnene-3,20-dione|17alpha-Hydroxy-progesterone|17alpha-Hydroxyprogesterone|Pregn-4-ene-3,20-dione-17-ol|delta(4)-Pregnene-17alpha-ol-3,20-dione|hidroxiprogesterona|hydroxyprogesterone|hydroxyprogesteronum http://purl.obolibrary.org/obo/CHEBI_17252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17253 biolink:ChemicalEntity 1,2-benzoquinone A benzoquinone resulting from the formal oxidation of catechol. beilstein:2038185|cas:583-63-1|gmelin:26767|kegg.compound:C02351|wikipedia.en:1,2-Benzoquinone Graph 1,2-Benzoquinone|1,2-benzoquinone|2-benzoquinone|3,5-cyclohexadiene-1,2-dione|catechol quinone|cyclohexa-3,5-diene-1,2-dione|o-benzoquinone|o-quinone|ortho-benzoquinone cyclohexa-3,5-diene-1,2-dione 1,2-Benzoquinone|1,2-benzoquinone|2-benzoquinone|3,5-cyclohexadiene-1,2-dione|catechol quinone|cyclohexa-3,5-diene-1,2-dione|o-benzoquinone|o-quinone|ortho-benzoquinone http://purl.obolibrary.org/obo/CHEBI_17253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17254 biolink:ChemicalEntity 4-methylcatechol A methylcatechol having a single methyl substituent at the 4-position. It has been isolated from Picea abies. cas:452-86-8|drugbank:DB04120|hmdb:HMDB0000873|kegg.compound:C06730|knapsack:C00002660|pdb-ccd:MCT|pubmed:18499097|reaxys:636512|umbbd.compound:c0126|wikipedia.en:4-Methylcatechol Graph 1,2-Dihydroxy-4-methylbenzene|1,2-dihydroxy-4-methylbenzene|2-Hydroxy-4-methylphenol|3,4-Dihydroxytoluene|3,4-dihydroxytoluene|4-Methyl-1,2-benzenediol|4-Methyl-1,2-dihydroxybenzene|4-Methylcatechol|4-Methylpyrocatechol|4-methyl-1,2-benzenediol|4-methylbenzene-1,2-diol|4-methylcatechol|Homocatechol|Homopyrocatechol|Toluene-3,4-diol|p-Methylcatechol|p-Methylpyrocatechol 4-methylbenzene-1,2-diol 1,2-Dihydroxy-4-methylbenzene|1,2-dihydroxy-4-methylbenzene|2-Hydroxy-4-methylphenol|3,4-Dihydroxytoluene|3,4-dihydroxytoluene|4-Methyl-1,2-benzenediol|4-Methyl-1,2-dihydroxybenzene|4-Methylcatechol|4-Methylpyrocatechol|4-methyl-1,2-benzenediol|4-methylbenzene-1,2-diol|4-methylcatechol|Homocatechol|Homopyrocatechol|Toluene-3,4-diol|p-Methylcatechol|p-Methylpyrocatechol http://purl.obolibrary.org/obo/CHEBI_17254 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17255 biolink:ChemicalEntity N-carbamoyl-D-alpha-amino acid Any N-carbamoyl-amino acid having D-configuration. kegg.compound:C05226|metacyc.compound:N-Carbamoyl-D-Amino-Acids Graph http://purl.obolibrary.org/obo/CHEBI_17255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17256 biolink:ChemicalEntity 2'-deoxyadenosine A purine 2'-deoxyribonucleoside having adenine as the nucleobase. cas:958-09-8|gmelin:283189|hmdb:HMDB0000101|kegg.compound:C00559|knapsack:C00019281|metacyc.compound:DEOXYADENOSINE|pdb-ccd:3D1|pubmed:14253484|pubmed:18508186|pubmed:24144081|pubmed:8171392|pubmed:9869364|reaxys:91015|wikipedia.en:Deoxyadenosine Graph (2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol|2'-Deoxyadenosine|2'-deoxyadenosine|5-(6-AMINO-PURIN-9-YL)-2-HYDROXYMETHYL-TETRAHYDRO-FURAN-3-OL|9-(2-Deoxy-beta-D-erythro-pentofuranosyl)adenine|9-(2-deoxy-beta-D-ribofuranosyl)-9H-purin-6-amine|Deoxyadenosine|adenine deoxyribonucleoside|adenyldeoxyriboside|dA 2'-Deoxyadenosine|2'-deoxyadenosine (2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol|2'-Deoxyadenosine|2'-deoxyadenosine|5-(6-AMINO-PURIN-9-YL)-2-HYDROXYMETHYL-TETRAHYDRO-FURAN-3-OL|9-(2-Deoxy-beta-D-erythro-pentofuranosyl)adenine|9-(2-deoxy-beta-D-ribofuranosyl)-9H-purin-6-amine|Deoxyadenosine|adenine deoxyribonucleoside|adenyldeoxyriboside|dA http://purl.obolibrary.org/obo/CHEBI_17256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17257 biolink:ChemicalEntity bis-gamma-glutamylcystine The dimer obtained by formal oxidative coupling of γ-glutamylcystine. kegg.compound:C03646 Graph 5,5'-{disulfanediylbis[(1-carboxyethane-2,1-diyl)imino]}bis(2-amino-5-oxopentanoic acid)|Bis-gamma-L-glutamyl-L-cystine|Bis-gamma-glutamylcystine|Oxidized gamma-L-glutamyl-L-cysteine|Oxidized gamma-glutamylcysteine 5,5'-{disulfanediylbis[(1-carboxyethane-2,1-diyl)imino]}bis(2-amino-5-oxopentanoic acid) 5,5'-{disulfanediylbis[(1-carboxyethane-2,1-diyl)imino]}bis(2-amino-5-oxopentanoic acid)|Bis-gamma-L-glutamyl-L-cystine|Bis-gamma-glutamylcystine|Oxidized gamma-L-glutamyl-L-cysteine|Oxidized gamma-glutamylcysteine http://purl.obolibrary.org/obo/CHEBI_17257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17258 biolink:ChemicalEntity 7H-purine The 7H-tautomer of purine. gmelin:601779|hmdb:HMDB0001366|kegg.compound:C15587|reaxys:3200 Graph 7H-purine|Purine|Purine base 7H-purine|Purine 7H-purine|Purine|Purine base http://purl.obolibrary.org/obo/CHEBI_17258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17259 biolink:ChemicalEntity CDP-3,6-dideoxy-D-mannose A CDP-sugar in which the sugar component is 3,6-dideoxy-D-mannose. Graph CDP-tyvelose|cytidine 5'-[3-(3,6-dideoxy-D-arabino-hexopyranosyl) dihydrogen diphosphate] cytidine 5'-[3-(3,6-dideoxy-D-arabino-hexopyranosyl) dihydrogen diphosphate] CDP-tyvelose|cytidine 5'-[3-(3,6-dideoxy-D-arabino-hexopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17260 biolink:ChemicalEntity butanoyl dihydrogen phosphate An acyl monophosphate where the acyl groups is butanoyl. kegg.compound:C02527 Graph Butanoyl phosphate|Butanoylphosphate|butanoyl dihydrogen phosphate Butanoyl phosphate|butanoyl dihydrogen phosphate Butanoyl phosphate|Butanoylphosphate|butanoyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_17260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17261 biolink:ChemicalEntity N(4)-(beta-N-acetyl-D-glucosaminyl)-L-asparagine An N4-glycosyl-L-asparagine having (β-N-acetyl-D-glucosaminyl as the glycosyl component. cas:2776-93-4|kegg.compound:C04540 Graph 1-beta-Aspartyl-N-acetyl-D-glucosaminylamine|2-Acetamido-1-(beta-L-aspartamido)-1,2-dideoxy-beta-D-glucose|2-Acetamido-1-N-(4'-L-aspartyl)-2-deoxy-beta-D-glucopyranosylamine|2-acetamido-N(1)-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine|2-acetamido-N-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine|AADG|N(4)-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine|N-Acetylglucosaminylasparagine|N4-(Acetyl-beta-D-glucosaminyl)asparagine|N4-(beta-N-Acetyl-D-glucosaminyl)-L-asparagine|beta-N-acetylglucosaminyl-L-asparagine N(4)-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine 1-beta-Aspartyl-N-acetyl-D-glucosaminylamine|2-Acetamido-1-(beta-L-aspartamido)-1,2-dideoxy-beta-D-glucose|2-Acetamido-1-N-(4'-L-aspartyl)-2-deoxy-beta-D-glucopyranosylamine|2-acetamido-N(1)-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine|2-acetamido-N-L-beta-aspartyl-2-deoxy-beta-D-glucopyranosylamine|AADG|N(4)-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine|N-Acetylglucosaminylasparagine|N4-(Acetyl-beta-D-glucosaminyl)asparagine|N4-(beta-N-Acetyl-D-glucosaminyl)-L-asparagine|beta-N-acetylglucosaminyl-L-asparagine http://purl.obolibrary.org/obo/CHEBI_17261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17262 biolink:ChemicalEntity dTDP-D-galacturonic acid A dTDP-sugar where the sugar component is D-galacturonic acid. kegg.compound:C03034 Graph dTDP-D-galacturonate|thymidine 5'-[3-(D-galactopyranosyluronic acid) dihydrogen diphosphate] thymidine 5'-[3-(D-galactopyranosyluronic acid) dihydrogen diphosphate] dTDP-D-galacturonate|thymidine 5'-[3-(D-galactopyranosyluronic acid) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17262 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17263 biolink:ChemicalEntity estrone A 17-oxo steroid that is estra-1,3,5(10)-triene substituted by an hydroxy group at position 3 and an oxo group at position 17. cas:53-16-7|drugbank:DB00655|drugcentral:3188|gmelin:542591|hmdb:HMDB0000145|kegg.compound:C00468|kegg.drug:D00067|knapsack:C00003663|lincs.smallmolecule:LSM-3837|lipidmaps:LMST02010004|patent:FR1305992|patent:US1967350|patent:US1967351|pdb-ccd:J3Z|pubmed:11786692|pubmed:13908815|pubmed:15784278|pubmed:17447557|pubmed:19610377|pubmed:23647561|pubmed:24390165|pubmed:24398390|reaxys:1915077|wikipedia.en:Estrone Graph 3-Hydroxy-1,3,5(10)-estratrien-17-one|3-hydroxyestra-1,3,5(10)-trien-17-one|Estrone|estrone|follicular hormone|folliculin|oestrone 3-hydroxyestra-1,3,5(10)-trien-17-one 3-Hydroxy-1,3,5(10)-estratrien-17-one|3-hydroxyestra-1,3,5(10)-trien-17-one|Estrone|estrone|follicular hormone|folliculin|oestrone http://purl.obolibrary.org/obo/CHEBI_17263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17264 biolink:ChemicalEntity phosphatidylglycerol phosphate A phosphatidylglycerol in which one of the hydroxy groups of the glycerol moiety has been converted to the corresponding dihydrogen phosphate. Graph Phosphatidylglycerophosphate|phosphatidylglycerol phosphates Phosphatidylglycerophosphate|phosphatidylglycerol phosphates http://purl.obolibrary.org/obo/CHEBI_17264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17265 biolink:ChemicalEntity O-(1->4)-alpha-L-dihydrostreptosylstreptidine 6-phosphate A scyllo-inositol phosphate compound having the phosphate group at the 6-position, guanidino groups replacing hydroxy functions at the 1-position and an α-L-lyxofuranosyl residue at the 4-position. cas:59719-49-2|kegg.compound:C04767 Graph (1S,2R,3S,4S,5R,6S)-2,4-dicarbamimidamido-5-{[5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl]oxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate|DHSSP|Dihydrostreptosyl streptidine 6-phosphate|O-1,4-alpha-L-Dihydrostreptosyl-streptidine 6-phosphate (1S,2R,3S,4S,5R,6S)-2,4-dicarbamimidamido-5-{[5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl]oxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate (1S,2R,3S,4S,5R,6S)-2,4-dicarbamimidamido-5-{[5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl]oxy}-3,6-dihydroxycyclohexyl dihydrogen phosphate|DHSSP|Dihydrostreptosyl streptidine 6-phosphate|O-1,4-alpha-L-Dihydrostreptosyl-streptidine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_17265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17266 biolink:ChemicalEntity L-sorbose The L enantiomer of sorbose, a ketone-containing hexose (a six-carbon monosaccharide). cas:87-79-6|pubmed:22735334|reaxys:1724554|wikipedia.en:Sorbose Graph (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-Sor|L-sorbose|L-xylo-hex-2-ulose (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-sorbose|L-xylo-hex-2-ulose (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one|L-Sor|L-sorbose|L-xylo-hex-2-ulose http://purl.obolibrary.org/obo/CHEBI_17266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17268 biolink:ChemicalEntity myo-inositol An inositol having myo- configuration. cas:87-89-8|drugbank:DB03106|drugcentral:1444|gmelin:82918|hmdb:HMDB0000211|kegg.compound:C00137|kegg.drug:D08079|knapsack:C00001164|metacyc.compound:MYO-INOSITOL|pdb-ccd:INS|pubmed:11034685|pubmed:11244303|pubmed:11323092|pubmed:11772411|pubmed:12478879|pubmed:12832083|pubmed:14583919|pubmed:14681857|pubmed:15181167|pubmed:15295080|pubmed:15558078|pubmed:16410747|pubmed:1694860|pubmed:17439666|pubmed:17722064|pubmed:18650262|pubmed:18854045|pubmed:19097871|pubmed:19383710|pubmed:22285975|pubmed:22461977|pubmed:22517104|pubmed:838172|reaxys:1907329|wikipedia.en:Inositol Graph (1r,2R,3S,4s,5R,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE|1,2,3,5/4,6-cyclohexanehexol|1D-myo-Inositol|1L-myo-Inositol|Bios I|Cyclohexitol|D-myo-Inositol|Dambose|Inositol|Ins|L-myo-Inositol|Meat sugar|Myoinositol|cis-1,2,3,5-trans-4,6-cyclohexanehexol|i-inositol|inosite|meso-Inositol|myo-Inositol|myo-inositol myo-Inositol|myo-inositol (1r,2R,3S,4s,5R,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE|1,2,3,5/4,6-cyclohexanehexol|1D-myo-Inositol|1L-myo-Inositol|Bios I|Cyclohexitol|D-myo-Inositol|Dambose|Inositol|Ins|L-myo-Inositol|Meat sugar|Myoinositol|cis-1,2,3,5-trans-4,6-cyclohexanehexol|i-inositol|inosite|meso-Inositol|myo-Inositol|myo-inositol http://purl.obolibrary.org/obo/CHEBI_17268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17269 biolink:ChemicalEntity Latia luciferin An apo carotenoid sesquiterpenoid that consists of a cylohexene ring substituted by methyl groups at positions 2, 6 and 6 and a (1E)-1-(formyloxy)-2-methylbut-1-en-4-yl group at position 2. cas:21730-91-6|kegg.compound:C02293|lipidmaps:LMPR0103050003|metacyc.compound:LATIA-LUCIFERIN|pubmed:4506078|pubmed:5650377|reaxys:1876844 Graph (1E)-2-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-1-enyl formate|(9E)-7,8-dihydro-10-apo-beta-caroten-10-yl formate|Latia luciferin|latiluciferin (1E)-2-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-1-enyl formate (1E)-2-methyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-1-enyl formate|(9E)-7,8-dihydro-10-apo-beta-caroten-10-yl formate|Latia luciferin|latiluciferin http://purl.obolibrary.org/obo/CHEBI_17269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17270 biolink:ChemicalEntity glycerol 2-phosphate A glycerol monophosphate having the phosphate group at the 2-position. cas:17181-54-3|drugbank:DB01779|kegg.compound:C02979|knapsack:C00007407|metacyc.compound:CPD-536|pdb-ccd:G2H|pubmed:10952545|pubmed:19429609|pubmed:22770225|pubmed:6083437|reaxys:1706815 Graph 1,2,3-propanetriol, 2-(dihydrogen phosphate)|1,3-hydroxy-2-propyl dihydrogen phosphate|2-HYDROXY-1-(HYDROXYMETHYL)ETHYL DIHYDROGEN PHOSPHATE|2-glycerophosphate|Glycerol 2-phosphate|beta-glycerophosphate|beta-glycerophosphoric acid|glycerol 2-(dihydrogen phosphate) glycerol 2-(dihydrogen phosphate) 1,2,3-propanetriol, 2-(dihydrogen phosphate)|1,3-hydroxy-2-propyl dihydrogen phosphate|2-HYDROXY-1-(HYDROXYMETHYL)ETHYL DIHYDROGEN PHOSPHATE|2-glycerophosphate|Glycerol 2-phosphate|beta-glycerophosphate|beta-glycerophosphoric acid|glycerol 2-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17270 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17271 biolink:ChemicalEntity 3-phosphonatopyruvate(3-) A triply-charged monocarboxylic acid anion obtained by deprotonation of the carboxy and phospho groups of 3-phosphonopyruvic acid. beilstein:6201899|reaxys:6201899 Graph 2-oxo-3-phosphonatopropanoate|3-phosphonatopyruvate 2-oxo-3-phosphonatopropanoate 2-oxo-3-phosphonatopropanoate|3-phosphonatopyruvate http://purl.obolibrary.org/obo/CHEBI_17271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17272 biolink:ChemicalEntity propionate The conjugate base of propionic acid; a key precursor in lipid biosynthesis. beilstein:3587503|cas:72-03-7|gmelin:1820|kegg.compound:C00163|pubmed:17951291|pubmed:18375549|pubmed:2647392|umbbd.compound:c0277 Graph CH3-CH2-COO(-)|EtCO2 anion|carboxylatoethane|ethanecarboxylate|ethylformate|metacetonate|methylacetate|propanate|propanoate|propanoic acid, ion(1-)|propionate|pseudoacetate propanoate CH3-CH2-COO(-)|EtCO2 anion|carboxylatoethane|ethanecarboxylate|ethylformate|metacetonate|methylacetate|propanate|propanoate|propanoic acid, ion(1-)|propionate|pseudoacetate http://purl.obolibrary.org/obo/CHEBI_17272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17274 biolink:ChemicalEntity aldehydo-N-acyl-D-glucosamine The open-chain form of an N-acyl-D-glucosamine. Graph an N-acyl-D-glucosamine an N-acyl-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_17274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17276 biolink:ChemicalEntity phloretin A member of the class of dihydrochalcones that is dihydrochalcone substituted by hydroxy groups at positions 4, 2', 4' and 6'. cas:60-82-2|drugbank:DB07810|hmdb:HMDB0003306|kegg.compound:C00774|knapsack:C00007936|lincs.smallmolecule:LSM-6221|lipidmaps:LMPK12120525|metacyc.compound:PHLORETIN|patent:CN102701938|patent:CN103230408|pdb-ccd:G50|pubmed:18767070|pubmed:23907072|pubmed:24487097|pubmed:7126563|reaxys:1887240|wikipedia.en:Phloretin Graph 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone|3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one|Phloretin|phloretin 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone|3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one|Phloretin|phloretin http://purl.obolibrary.org/obo/CHEBI_17276 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17277 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine UDP-glycopeptide having N-acetylmuramoyl as the glyco portion and L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine as the peptide portion (attached via an amide bond between the amino terminus and the muramoyl carboxy group). Graph UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_17277 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17278 biolink:ChemicalEntity 5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol beilstein:6225599|cas:862-53-3|kegg.compound:C05446|lipidmaps:LMST04030014 Graph (3alpha,5beta,7alpha,12alpha)-cholestane-3,7,12,26-tetrol|3alpha,7alpha,12alpha,26-Tetrahydroxy-5beta-cholestane|5-beta-cholestane-3-alpha,7-alpha,12-alpha,26-tetrol|5beta-Cholestane-3alpha,7alpha,12alpha,26-tetraol|5beta-Cholestane-3alpha,7alpha,12alpha,26-tetrol|5beta-cholestane 3alpha,7alpha,12alpha,27-tetrol|5beta-cholestane-3alpha,7alpha,12alpha,26-tetraol|5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol|cholestane-3,7,12,26(27)-tetrol|cholestane-3,7,12,26-tetrol|cholestane-3,7,12,27-tetrol 5beta-Cholestane-3alpha,7alpha,12alpha,26-tetrol|5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol (3alpha,5beta,7alpha,12alpha)-cholestane-3,7,12,26-tetrol|3alpha,7alpha,12alpha,26-Tetrahydroxy-5beta-cholestane|5-beta-cholestane-3-alpha,7-alpha,12-alpha,26-tetrol|5beta-Cholestane-3alpha,7alpha,12alpha,26-tetraol|5beta-Cholestane-3alpha,7alpha,12alpha,26-tetrol|5beta-cholestane 3alpha,7alpha,12alpha,27-tetrol|5beta-cholestane-3alpha,7alpha,12alpha,26-tetraol|5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol|cholestane-3,7,12,26(27)-tetrol|cholestane-3,7,12,26-tetrol|cholestane-3,7,12,27-tetrol http://purl.obolibrary.org/obo/CHEBI_17278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17279 biolink:ChemicalEntity N-succinyl-LL-2,6-diaminopimelic acid A tricarboxylic acid consisting of LL-2,6-diaminopimelic acid having a succinoyl group attached to one of the nitrogens. kegg.compound:C04421|knapsack:C00007597 Graph (2S,6S)-2-amino-6-(3-carboxypropanamido)heptanedioic acid|N-Succinyl-L-2,6-diaminoheptanedioate|N-Succinyl-L-2,6-diaminopimelate|N-Succinyl-LL-2,6-diaminoheptanedioate|N-Succinyl-LL-2,6-diaminopimelate (2S,6S)-2-amino-6-(3-carboxypropanamido)heptanedioic acid (2S,6S)-2-amino-6-(3-carboxypropanamido)heptanedioic acid|N-Succinyl-L-2,6-diaminoheptanedioate|N-Succinyl-L-2,6-diaminopimelate|N-Succinyl-LL-2,6-diaminoheptanedioate|N-Succinyl-LL-2,6-diaminopimelate http://purl.obolibrary.org/obo/CHEBI_17279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17281 biolink:ChemicalEntity 2-deoxy-D-ribono-1,4-lactone beilstein:81260|cas:34371-14-7|kegg.compound:C02674 Graph (4S,5R)-4-hydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|2,4,5-TP|2,4,5-Trihydroxypentanoic acid gamma-lactone|2-Deoxy-ribono-1,4-lactone|2-Deoxyribonolactone|2-deoxy-D-erythro-pentonic acid gamma-lactone|2-deoxy-D-erythro-pentono-1,4-lactone|2-deoxy-D-ribono-1,4-lactone|Deoxyribonolactone (4S,5R)-4-hydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|2-deoxy-D-erythro-pentono-1,4-lactone (4S,5R)-4-hydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|2,4,5-TP|2,4,5-Trihydroxypentanoic acid gamma-lactone|2-Deoxy-ribono-1,4-lactone|2-Deoxyribonolactone|2-deoxy-D-erythro-pentonic acid gamma-lactone|2-deoxy-D-erythro-pentono-1,4-lactone|2-deoxy-D-ribono-1,4-lactone|Deoxyribonolactone http://purl.obolibrary.org/obo/CHEBI_17281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17282 biolink:ChemicalEntity 3-(indol-3-yl)lactate A 2-hydroxy carboxylate that is the conjugate base of 3-(indol-3-yl)lactic acid. kegg.compound:C02043 Graph 2-hydroxy-3-(1H-indol-3-yl)propanoate|3-(indol-3-yl)lactate|Indolelactate|indole lactate|indole-3-lactate 2-hydroxy-3-(1H-indol-3-yl)propanoate 2-hydroxy-3-(1H-indol-3-yl)propanoate|3-(indol-3-yl)lactate|Indolelactate|indole lactate|indole-3-lactate http://purl.obolibrary.org/obo/CHEBI_17282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17283 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 3-phosphate A phosphatidylinositol 3-phosphate in which the inositol moiety is the D-myo-isomer. kegg.compound:C04549 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3-phosphate|Phosphatidylinositol 3-phosphate|PtdIns-3-P|PtdIns3P 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3-(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-3'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 3-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 3-phosphate|Phosphatidylinositol 3-phosphate|PtdIns-3-P|PtdIns3P http://purl.obolibrary.org/obo/CHEBI_17283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17284 biolink:ChemicalEntity 5-phospho-D-ribosylamine A ribose monophosphate having the phosphate group at the 5-position and an amino group in place of hydroxy at the anomeric centre. Graph 5-O-phosphono-D-ribofuranosylamine 5-O-phosphono-D-ribofuranosylamine 5-O-phosphono-D-ribofuranosylamine http://purl.obolibrary.org/obo/CHEBI_17284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17285 biolink:ChemicalEntity L-cysteic acid The L-enantiomer of cysteic acid. beilstein:1725492|cas:498-40-8|drugbank:DB03661|hmdb:HMDB0002757|kegg.compound:C00506|metacyc.compound:L-CYSTEATE|pdb-ccd:OCS|pdb-ccd:OCS_LFOH|pubmed:11750815|pubmed:21719707|pubmed:8981569|reaxys:1725495 Graph (2R)-2-amino-3-sulfopropanoic acid|2-Amino-3-sulfopropionic acid|3-Sulfoalanine|3-sulfo-L-alanine|CYSTEINESULFONIC ACID|L-Cysteate|L-Cysteic acid|L-cysteic acid L-Cysteic acid|L-cysteic acid (2R)-2-amino-3-sulfopropanoic acid|2-Amino-3-sulfopropionic acid|3-Sulfoalanine|3-sulfo-L-alanine|CYSTEINESULFONIC ACID|L-Cysteate|L-Cysteic acid|L-cysteic acid http://purl.obolibrary.org/obo/CHEBI_17285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17286 biolink:ChemicalEntity deacetylisoipecoside Isoipecoside in which the acetyl group attaced to the nitrogen is replaced by hydrogen. beilstein:5787005|kegg.compound:C07304 Graph Deacetylisoipecoside|methyl (2S,3R,4S)-3-ethenyl-4-{[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate methyl (2S,3R,4S)-3-ethenyl-4-{[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate Deacetylisoipecoside|methyl (2S,3R,4S)-3-ethenyl-4-{[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_17286 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17287 biolink:ChemicalEntity N-phosphocreatine A phosphoamino acid consisting of creatine having a phospho group attached at the primary nitrogen of the guanidino group. cas:67-07-2|drugcentral:3464|hmdb:HMDB0001511|kegg.compound:C02305|metacyc.compound:CREATINE-P|pubmed:1160340|pubmed:11867929|pubmed:13772879|pubmed:13881337|pubmed:14421251|pubmed:5879486|reaxys:1797096|wikipedia.en:Phosphocreatine Graph Creatine phosphate|Creatine phosphic acid|N(omega)-phosphonocreatine|N-(N-phosphonoamido)sarcosine|N-(Phosphonoamidino)sarcosine|N-Phosphocreatine|N-Phosphorylcreatine|N-[imino(phosphonoamino)methyl]-N-methylglycine|N-phosphocreatine|Phosphocreatine|phosphorylcreatine|{[imino(phosphonoamino)methyl](methyl)amino}acetic acid N-[imino(phosphonoamino)methyl]-N-methylglycine Creatine phosphate|Creatine phosphic acid|N(omega)-phosphonocreatine|N-(N-phosphonoamido)sarcosine|N-(Phosphonoamidino)sarcosine|N-Phosphocreatine|N-Phosphorylcreatine|N-[imino(phosphonoamino)methyl]-N-methylglycine|N-phosphocreatine|Phosphocreatine|phosphorylcreatine|{[imino(phosphonoamino)methyl](methyl)amino}acetic acid http://purl.obolibrary.org/obo/CHEBI_17287 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172871 biolink:ChemicalEntity 8-oxo-dATP(4-) Graph ({[(2R,3S,5R)-5-(6-amino-8-oxo-8,9-dihydro-7H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|8-oxo-dATP ({[(2R,3S,5R)-5-(6-amino-8-oxo-8,9-dihydro-7H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate ({[(2R,3S,5R)-5-(6-amino-8-oxo-8,9-dihydro-7H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|8-oxo-dATP http://purl.obolibrary.org/obo/CHEBI_172871 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:172872 biolink:ChemicalEntity N(6)-methyl-dATP(4-) Graph ({[(2R,3S,5R)-3-hydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|N(6)-methyl-dATP ({[(2R,3S,5R)-3-hydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate ({[(2R,3S,5R)-3-hydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|N(6)-methyl-dATP http://purl.obolibrary.org/obo/CHEBI_172872 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:172873 biolink:ChemicalEntity N(6)-methyl-ATP(4-) Graph ({[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|N(6)-methyl-ATP ({[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate ({[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(methylamino)-9H-purin-9-yl]oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate|N(6)-methyl-ATP http://purl.obolibrary.org/obo/CHEBI_172873 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:172878 biolink:ChemicalEntity 2-oxo-ATP(4-) A nucleoside triphosphate(4−) obtained by global deprotonation of the triphosphate OH groups of 2-oxo-ATP; major microspecies at pH 7.3 pubmed:11139615 Graph 2-oxo-ATP|2-oxo-ATP tetraanion|2-oxo-adenosine 5'-triphosphate tetraanion 2-oxo-ATP|2-oxo-ATP tetraanion|2-oxo-adenosine 5'-triphosphate tetraanion http://purl.obolibrary.org/obo/CHEBI_172878 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17289 biolink:ChemicalEntity homoserine lactone A butan-4-olide having an amino substituent at the 2-position. beilstein:80584|cas:1192-20-7|drugbank:DB02624|kegg.compound:C02926|metacyc.compound:HOMOSERINE-LACTONE|pubmed:7545940|reaxys:80584 Graph 2-Aminobutan-4-olide|3-amino-4,5-dihydrofuran-2(3H)-one|HSL|HSLs|Homoserine lactone|Hsl|alpha-amino-gamma-butyrolactone|homoserine lactone 3-amino-4,5-dihydrofuran-2(3H)-one|homoserine lactone 2-Aminobutan-4-olide|3-amino-4,5-dihydrofuran-2(3H)-one|HSL|HSLs|Homoserine lactone|Hsl|alpha-amino-gamma-butyrolactone|homoserine lactone http://purl.obolibrary.org/obo/CHEBI_17289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17290 biolink:ChemicalEntity (S)-3-hydroxybutyric acid The S-enantiomer of 3-hydroxybutyric acid; a normal human metabolite, that has been found elevated in geriatric patients remitting from depression. cas:6168-83-8|hmdb:HMDB0000758|kegg.compound:C03197|metacyc.compound:CPD-1843|pdb-ccd:3HL|pubmed:17048218|pubmed:18461320|pubmed:19304817|reaxys:1720567 Graph (+)-3-hydroxybutyric acid|(3S)-3-hydroxybutanoic acid|(3S)-3-hydroxybutyric acid|(S)-3-Hydroxybutyric acid|(S)-3-hydroxybutanoic acid|(S)-3-hydroxybutyric acid|(S)-3HB|(S)-beta-hydroxybutyric acid|L-(+)-3-hydroxybutyric acid|L-3-hydroxybutyric acid (3S)-3-hydroxybutanoic acid (+)-3-hydroxybutyric acid|(3S)-3-hydroxybutanoic acid|(3S)-3-hydroxybutyric acid|(S)-3-Hydroxybutyric acid|(S)-3-hydroxybutanoic acid|(S)-3-hydroxybutyric acid|(S)-3HB|(S)-beta-hydroxybutyric acid|L-(+)-3-hydroxybutyric acid|L-3-hydroxybutyric acid http://purl.obolibrary.org/obo/CHEBI_17290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17291 biolink:ChemicalEntity L-fuconic acid beilstein:1724572|cas:26372-13-4|kegg.compound:C01720 Graph 6-deoxy-L-galactonic acid|L-Fuconate|L-fuconic acid 6-deoxy-L-galactonic acid 6-deoxy-L-galactonic acid|L-Fuconate|L-fuconic acid http://purl.obolibrary.org/obo/CHEBI_17291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172918 biolink:ChemicalEntity PF-00835231 A primary alcohol resulting from the cleavage of the phosphate group of the prodrug PF-07304814. It is an inhibitor of SARS-CoV-1 and -2 main protease (3CLpro) and exhibits potent in vitro antiviral activity. chemspider:9736673|patent:WO2005113580|pdb-ccd:V2M|pubmed:32045235|pubmed:32935104|pubmed:33054210|pubmed:33515606|pubmed:33622961|pubmed:33802860 Graph N-[(2S)-1-({(2S)-4-hydroxy-3-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide|PF 00835231|PF-00835231|PF00835231 N-[(2S)-1-({(2S)-4-hydroxy-3-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide N-[(2S)-1-({(2S)-4-hydroxy-3-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}amino)-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide|PF 00835231|PF-00835231|PF00835231 http://purl.obolibrary.org/obo/CHEBI_172918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172923 biolink:ChemicalEntity fluorescein (acid form) A xanthene dye that is highly fluorescent and commonly used as a fluorescent tracer. cas:518-45-6|chemspider:3266|pdb-ccd:FLU|pubmed:12945055|pubmed:15178254|pubmed:15465055|pubmed:17097086|pubmed:2508085|pubmed:26457839|pubmed:26756394|pubmed:28935590|pubmed:29058737|pubmed:8637844|wikipedia.en:Fluorescein Graph 2-(3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid|2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid|2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid|fluorescein (free acid)|fluorescein acid 2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid 2-(3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid|2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid|2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid|fluorescein (free acid)|fluorescein acid http://purl.obolibrary.org/obo/CHEBI_172923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:172925 biolink:ChemicalEntity beta-acoradiene A spiro compound that is 1,8-dimethyl-4-(prop-1-en-2-yl)spiro[4.5]decane that has been dehydrogenated to introduce a double bond at position 8-9 (the 1R,4S,5R isomer). cas:28477-64-7|knapsack:C00021580|metacyc.compound:CPD-8240|pubmed:15994044|pubmed:24517311|pubmed:25960759 Graph (-)-beta- acoradiene|(1R,4S,5R)-1,8-dimethyl-4-(1-methylethenyl)spiro[4.5]dec-7-ene|(1R,4S,5R)-1,8-dimethyl-4-(prop-1-en-2-yl)spiro[4.5]dec-7-ene|Beta-acoradiene|beta-acoradiene (1R,4S,5R)-1,8-dimethyl-4-(prop-1-en-2-yl)spiro[4.5]dec-7-ene (-)-beta- acoradiene|(1R,4S,5R)-1,8-dimethyl-4-(1-methylethenyl)spiro[4.5]dec-7-ene|(1R,4S,5R)-1,8-dimethyl-4-(prop-1-en-2-yl)spiro[4.5]dec-7-ene|Beta-acoradiene|beta-acoradiene http://purl.obolibrary.org/obo/CHEBI_172925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17293 biolink:ChemicalEntity 2-aminophenoxazin-3-one chemspider:65565|kegg.compound:C02161|knapsack:C00018683 Graph 2-Aminophenoxazin-3-one|2-amino-3H-phenoxazin-3-one|2-aminophenoxazin-3-one|Isophenoxazine|Questiomycin A 2-amino-3H-phenoxazin-3-one 2-Aminophenoxazin-3-one|2-amino-3H-phenoxazin-3-one|2-aminophenoxazin-3-one|Isophenoxazine|Questiomycin A http://purl.obolibrary.org/obo/CHEBI_17293 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17294 biolink:ChemicalEntity 4,21-dehydrogeissoschizine An indole alkaloid that is the enol tautomer of geissoschizine, which is also dehydrogenated at the 4,21-position. cas:73385-56-5|kegg.compound:C03677|knapsack:C00051782|metacyc.compound:421-DEHYDROGEISSOSCHIZINE|pubmed:16874388|reaxys:4723273|wikipedia.en:4,21-Dehydrogeissoschizine Graph 4,21-Dehydrogeissoschizine|4,21-dehydrogeissoschizine|methyl (19E)-16-(hydroxymethylidene)-4,21-didehydrocoryn-19-en-4-ium-17-oate|methyl (19E)-16-(hydroxymethylidene)coryna-4(21),19-dien-4-ium-17-oate methyl (19E)-16-(hydroxymethylidene)coryna-4(21),19-dien-4-ium-17-oate 4,21-Dehydrogeissoschizine|4,21-dehydrogeissoschizine|methyl (19E)-16-(hydroxymethylidene)-4,21-didehydrocoryn-19-en-4-ium-17-oate|methyl (19E)-16-(hydroxymethylidene)coryna-4(21),19-dien-4-ium-17-oate http://purl.obolibrary.org/obo/CHEBI_17294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17295 biolink:ChemicalEntity L-phenylalanine The L-enantiomer of phenylalanine. cas:63-91-2|drugbank:DB00120|drugcentral:2144|ecmdb:ECMDB00159|gmelin:50837|hmdb:HMDB0000159|kegg.compound:C00079|kegg.drug:D00021|knapsack:C00001386|metacyc.compound:PHE|pdb-ccd:PHE|pubmed:13945318|pubmed:16893175|pubmed:17784858|pubmed:21203787|pubmed:21956539|pubmed:22081386|pubmed:22112574|pubmed:22143120|pubmed:22209218|pubmed:22494897|pubmed:23836015|pubmed:24464217|pubmed:24733517|pubmed:24966042|reaxys:1910408|wikipedia.en:Phenylalanine|ymdb:YMDB00304 Graph (2S)-2-amino-3-phenylpropanoic acid|(S)-2-Amino-3-phenylpropionic acid|(S)-alpha-Amino-beta-phenylpropionic acid|3-phenyl-L-alanine|F|L-Phenylalanine|L-phenylalanine|PHENYLALANINE|Phe|beta-phenyl-L-alanine (2S)-2-amino-3-phenylpropanoic acid|L-Phenylalanine|L-phenylalanine (2S)-2-amino-3-phenylpropanoic acid|(S)-2-Amino-3-phenylpropionic acid|(S)-alpha-Amino-beta-phenylpropionic acid|3-phenyl-L-alanine|F|L-Phenylalanine|L-phenylalanine|PHENYLALANINE|Phe|beta-phenyl-L-alanine http://purl.obolibrary.org/obo/CHEBI_17295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17296 biolink:ChemicalEntity aniline A primary arylamine in which an amino functional group is substituted for one of the benzene hydrogens. cas:62-53-3|drugbank:DB06728|gmelin:2796|hmdb:HMDB0003012|kegg.compound:C00292|metacyc.compound:ANILINE|pdb-ccd:ANL|pubmed:11304127|pubmed:17135213|pubmed:23821252|pubmed:3779628|pubmed:6205897|reaxys:605631|wikipedia.en:Aniline Graph ANILINE|Anilin|Aniline|Benzenamine|Phenylamine|aminobenzene|aminophen|aniline|benzeneamine|kyanol ANILINE|Aniline|aniline ANILINE|Anilin|Aniline|Benzenamine|Phenylamine|aminobenzene|aminophen|aniline|benzeneamine|kyanol http://purl.obolibrary.org/obo/CHEBI_17296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17297 biolink:ChemicalEntity UDP-sugar A pyrimidine nucleotide-sugar having UDP as the nucleotide component attached to an unspecified sugar via an anomeric diphosphate linkage. kegg.compound:C05227 Graph UDP-monosaccharide|UDP-sugar|UDP-sugars UDP-monosaccharide|UDP-sugar|UDP-sugars http://purl.obolibrary.org/obo/CHEBI_17297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17298 biolink:ChemicalEntity dolichyl D-xylosyl phosphate kegg.compound:C01191 Graph alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(D-xylopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl]|dolichyl D-xylosyl phosphates alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(D-xylopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl] alpha-(3-methylbut-2-en-1-yl)-omega-{4-[(D-xylopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl]|dolichyl D-xylosyl phosphates http://purl.obolibrary.org/obo/CHEBI_17298 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17299 biolink:ChemicalEntity 4-methylene-L-glutamate(2-) Graph (2S)-2-amino-4-methylenepentanedioate|(2S)-2-amino-4-methylidenepentanedioate (2S)-2-amino-4-methylidenepentanedioate (2S)-2-amino-4-methylenepentanedioate|(2S)-2-amino-4-methylidenepentanedioate http://purl.obolibrary.org/obo/CHEBI_17299 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17300 biolink:ChemicalEntity tetrachloroethene A chlorocarbon that is tetrachloro substituted ethene. cas:127-18-4|drugcentral:3587|gmelin:101142|hmdb:HMDB0041980|kegg.compound:C06789|lincs.smallmolecule:LSM-37168|metacyc.compound:TETRACHLOROETHENE|pubmed:23416178|pubmed:23466729|pubmed:25042713|pubmed:25605280|pubmed:25690329|reaxys:1304635|umbbd.compound:c0004|wikipedia.en:Tetrachloroethene Graph 1,1,2,2-tetrachloroethylene|PCE|PERC|PERK|Perchloroethylene|Tetrachloraethen|Tetrachloroethene|ethylene tetrachloride|perchloroethylene|tetrachlorethylene|tetrachloroethene|tetrachloroethylene Tetrachloroethene|tetrachloroethene 1,1,2,2-tetrachloroethylene|PCE|PERC|PERK|Perchloroethylene|Tetrachloraethen|Tetrachloroethene|ethylene tetrachloride|perchloroethylene|tetrachlorethylene|tetrachloroethene|tetrachloroethylene http://purl.obolibrary.org/obo/CHEBI_17300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17301 biolink:ChemicalEntity glucaric acid A hexaric acid derived by oxidation of sugar such as glucose with nitric acid. cas:25525-21-7|drugbank:DB03603|hmdb:HMDB0000663|kegg.compound:C00767|pubmed:6526537|reaxys:1728123 Graph Glucaric acid|glucaric acid|glucosaccharic acid|saccharic acid|tetrahydroxyadipic acid Glucaric acid|glucaric acid Glucaric acid|glucaric acid|glucosaccharic acid|saccharic acid|tetrahydroxyadipic acid http://purl.obolibrary.org/obo/CHEBI_17301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17302 biolink:ChemicalEntity pentadecanal A long-chain fatty aldehyde that is pentadecane carrying an oxo substituent at position 1. It is a component of essential oils from plants like Solanum erianthum and Cassia siamea. cas:2765-11-9|hmdb:HMDB0031078|kegg.compound:C01948|lipidmaps:LMFA06000083|pubmed:22136358|pubmed:23513740|reaxys:1706171 Graph 1-pentadecanal|Pentadecanal|n-pentadecanal|pentadecanal Pentadecanal|pentadecanal 1-pentadecanal|Pentadecanal|n-pentadecanal|pentadecanal http://purl.obolibrary.org/obo/CHEBI_17302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17303 biolink:ChemicalEntity morphine A morphinane alkaloid that is a highly potent opiate analgesic psychoactive drug. Morphine acts directly on the central nervous system (CNS) to relieve pain but has a high potential for addiction, with tolerance and both physical and psychological dependence developing rapidly. Morphine is the most abundant opiate found in Papaver somniferum (the opium poppy). cas:57-27-2|drugbank:DB00295|drugcentral:1845|kegg.compound:C01516|kegg.drug:D08233|knapsack:C00001889|metacyc.compound:MORPHINE|pdb-ccd:MOI|pdb:1Q0Y|pubmed:12593758|pubmed:15019787|pubmed:17171884|pubmed:17667569|pubmed:19371311|pubmed:20071451|pubmed:21061062|pubmed:23292329|pubmed:23325235|pubmed:23555556|pubmed:23927484|pubmed:23988259|pubmed:24096538|pubmed:24306419|pubmed:27735107|pubmed:27815868|pubmed:27866460|pubmed:29368335|pubmed:9231550|reaxys:93704|vsdb:2982|wikipedia.en:Morphine Graph (-)-morphine|(5R,6S,9R,13S,14R)-4,5-epoxy-N-methyl-7-morphinen-3,6-diol|(5alpha,6alpha)-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol|(5alpha,6alpha)-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol|(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-E]ISOQUINOLINE-7,9-DIOL|17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diol|Morphia|Morphin|Morphine|morfina|morphinum|morphium 17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diol (-)-morphine|(5R,6S,9R,13S,14R)-4,5-epoxy-N-methyl-7-morphinen-3,6-diol|(5alpha,6alpha)-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol|(5alpha,6alpha)-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol|(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-E]ISOQUINOLINE-7,9-DIOL|17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diol|Morphia|Morphin|Morphine|morfina|morphinum|morphium http://purl.obolibrary.org/obo/CHEBI_17303 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17304 biolink:ChemicalEntity piperitenone beilstein:6717316|cas:491-09-8|kegg.compound:C01951|knapsack:C00010889|pubmed:24211775 Graph Piperitenone|p-mentha-1,4(8)-dien-3-one|piperitenone p-mentha-1,4(8)-dien-3-one Piperitenone|p-mentha-1,4(8)-dien-3-one|piperitenone http://purl.obolibrary.org/obo/CHEBI_17304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17305 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-glucaric acid kegg.compound:C03921 Graph 2-Dehydro-3-deoxy-D-glucarate|2-dehydro-3-deoxy-D-glucarate|3-deoxy-D-erythro-hex-2-ulosaric acid 3-deoxy-D-erythro-hex-2-ulosaric acid 2-Dehydro-3-deoxy-D-glucarate|2-dehydro-3-deoxy-D-glucarate|3-deoxy-D-erythro-hex-2-ulosaric acid http://purl.obolibrary.org/obo/CHEBI_17305 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17306 biolink:ChemicalEntity maltose A glycosylglucose consisting of two D-glucopyranose units connected by an α-(1→4)-linkage. cas:69-79-4|drugbank:DB03323|kegg.compound:C00208|kegg.drug:D00044|kegg.glycan:G00275|knapsack:C00001140|pubmed:16332759|pubmed:17723085|pubmed:22094343|pubmed:22185612|pubmed:22246222|pubmed:22252265|pubmed:22411612|pubmed:22424089|pubmed:22451670|pubmed:22469630|pubmed:22529943|pubmed:22573161|pubmed:22669197|reaxys:1292747|wikipedia.en:Maltose Graph 1-alpha-D-Glucopyranosyl-4-alpha-D-glucopyranose|4-(alpha-D-glucopyranosido)-alpha-glucopyranose|4-(alpha-D-glucosido)-D-glucose|4-O-alpha-D-glucopyranosyl-D-glucopyranose|4-O-alpha-D-glucopyranosyl-D-glucose|Cextromaltose|D-(+)-maltose|D-maltose|Malt sugar|Maltose|Malzzucker|alpha-D-Glcp-(1->4)-D-Glcp|alpha-D-Glucopyranosyl-(1->4)-D-glucopyranose|alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|alpha-D-glucopyranosyl-(1->4)-D-glucose|alpha-malt sugar|maltobiose alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|alpha-D-glucopyranosyl-(1->4)-D-glucose 1-alpha-D-Glucopyranosyl-4-alpha-D-glucopyranose|4-(alpha-D-glucopyranosido)-alpha-glucopyranose|4-(alpha-D-glucosido)-D-glucose|4-O-alpha-D-glucopyranosyl-D-glucopyranose|4-O-alpha-D-glucopyranosyl-D-glucose|Cextromaltose|D-(+)-maltose|D-maltose|Malt sugar|Maltose|Malzzucker|alpha-D-Glcp-(1->4)-D-Glcp|alpha-D-Glucopyranosyl-(1->4)-D-glucopyranose|alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|alpha-D-glucopyranosyl-(1->4)-D-glucose|alpha-malt sugar|maltobiose http://purl.obolibrary.org/obo/CHEBI_17306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17307 biolink:ChemicalEntity dTDP-6-deoxy-L-talose Graph thymidine 5'-[3-(6-deoxy-L-talopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-L-talopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-L-talopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173072 biolink:ChemicalEntity 5H-furo[3,2-g]chromen-5-one A member of the class of furanochromones that is 5H-furo[3,2-g][1]benzopyran carrying an oxo group a position 5. cas:67777-61-1|chemspider:114232|pubmed:2576851 Graph 5H-furo[3,2-g][1]benzopyran-5-one|5H-furo[3,2-g]chromen-5-one|FBPO|furo[3,2-g]chromen-5-one 5H-furo[3,2-g]chromen-5-one 5H-furo[3,2-g][1]benzopyran-5-one|5H-furo[3,2-g]chromen-5-one|FBPO|furo[3,2-g]chromen-5-one http://purl.obolibrary.org/obo/CHEBI_173072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17308 biolink:ChemicalEntity 2-oxohexanoic acid A straight-chain fatty acid consisting of hexanoic acid having an oxo group at position 2. cas:2492-75-3|kegg.compound:C00902|lipidmaps:LMFA01060007|pubmed:16014804|pubmed:7045091|reaxys:1749831 Graph 2-Oxohexanoate|2-Oxohexanoic acid|2-keto-n-caproic acid|2-ketohexanoic acid|2-oxo 6:0|2-oxo C6:0|2-oxohexanoic acid|alpha-Ketocaproic acid|alpha-ketocaproic acid|alpha-ketohexanoic acid 2-Oxohexanoic acid|2-oxohexanoic acid 2-Oxohexanoate|2-Oxohexanoic acid|2-keto-n-caproic acid|2-ketohexanoic acid|2-oxo 6:0|2-oxo C6:0|2-oxohexanoic acid|alpha-Ketocaproic acid|alpha-ketocaproic acid|alpha-ketohexanoic acid http://purl.obolibrary.org/obo/CHEBI_17308 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173082 biolink:ChemicalEntity aceneuramic acid An N-acetylneuraminic acid that is keto-neuraminic acid in which one of the hydrogens of the amino group is replaced by an acetyl group. cas:131-48-6|drugbank:DB11797|foodb.food:FDB001209|kegg.drug:D11016|pdb-ccd:SI3|pubmed:24152047|pubmed:24521460|pubmed:31636419|pubmed:32058180|pubmed:33895133 Graph (4S,5R,6R,7S,8R)-5-acetamido-4,6,7,8,9-pentahydroxy-2-oxononanoic acid|5-(acetylamino)-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid|N-acetyl-keto-neuraminic acid|N-acetylneuraminic acid|NPC-09|Neu5Ac|UX-001|UX001|aceneuramic acid|acide aceneuramique|acido aceneuramico|acidum aceneuramicum 5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid (4S,5R,6R,7S,8R)-5-acetamido-4,6,7,8,9-pentahydroxy-2-oxononanoic acid|5-(acetylamino)-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid|N-acetyl-keto-neuraminic acid|N-acetylneuraminic acid|NPC-09|Neu5Ac|UX-001|UX001|aceneuramic acid|acide aceneuramique|acido aceneuramico|acidum aceneuramicum http://purl.obolibrary.org/obo/CHEBI_173082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173083 biolink:ChemicalEntity aceneuramate An N-acetylneuraminate that is the conjugate base of aceneuramic acid arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3. metacyc.compound:CPD0-2701|pubmed:30422107|pubmed:33895133 Graph (4S,5R,6R,7S,8R)-5-acetamido-4,6,7,8,9-pentahydroxy-2-oxononanoate|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate|N-acetyl-keto-neuraminate|N-acetylneuraminate|Neu5Ac(1-)|aceneuramate 5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate (4S,5R,6R,7S,8R)-5-acetamido-4,6,7,8,9-pentahydroxy-2-oxononanoate|5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate|N-acetyl-keto-neuraminate|N-acetylneuraminate|Neu5Ac(1-)|aceneuramate http://purl.obolibrary.org/obo/CHEBI_173083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173084 biolink:ChemicalEntity ferroptosis inhibitor Any substance that inhibits the process of ferroptosis (a type of programmed cell death dependent on iron and characterized by the accumulation of lipid peroxides) in organisms. pubmed:32015325|pubmed:32256352|pubmed:32413317|pubmed:33495651|wikipedia.en:Ferroptosis Graph ferroptosis inhibitors ferroptosis inhibitors http://purl.obolibrary.org/obo/CHEBI_173084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173085 biolink:ChemicalEntity ferroptosis inducer Any substance that induces or promotes ferroptosis (a type of programmed cell death dependent on iron and characterized by the accumulation of lipid peroxides) in organisms. pubmed:31899616|pubmed:32015325|pubmed:33167414|pubmed:34012798|wikipedia.en:Ferroptosis Graph ferroptosis inducers ferroptosis inducers http://purl.obolibrary.org/obo/CHEBI_173085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173086 biolink:ChemicalEntity ferrostatin-1 An ethyl ester resulting from the formal condensation of the carboxy group of 3-amino-4-(cyclohexylamino)benzoic acid with ethanol. It is a potent inhibitor of ferroptosis, a distinct non-apoptotic form of cell death caused by lipid peroxidation. It is also a radical-trapping antioxidant and has the ability to reduce the accumulation of lipid peroxides and chain-carrying peroxyl radicals. cas:347174-05-4|pubmed:22632970|pubmed:26385697|pubmed:26410073|pubmed:26696014|pubmed:28250973|pubmed:28386601|pubmed:28783875|pubmed:30354101|pubmed:31531196|pubmed:31571665|pubmed:31574461|pubmed:31864943|pubmed:32161620|pubmed:32984038|pubmed:33109343|pubmed:33126055|pubmed:33278745|pubmed:33464146|pubmed:33631670|pubmed:33669598|pubmed:33991524 Graph 3-amino-4-cyclohexylaminobenzoic acid ethyl ester|Fer-1|ethyl 3-amino-4-(cyclohexylamino)benzoate|ferrrostatin 1 ethyl 3-amino-4-(cyclohexylamino)benzoate 3-amino-4-cyclohexylaminobenzoic acid ethyl ester|Fer-1|ethyl 3-amino-4-(cyclohexylamino)benzoate|ferrrostatin 1 http://purl.obolibrary.org/obo/CHEBI_173086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17309 biolink:ChemicalEntity pectin A heteropolysaccharide containing a large proportion of D-galactopyranosyluronic acid residues in α-(1→4) linkage, of which the hydroxy groups at positions C2 and C3 may be acetylated and carboxy groups at positions C6 may be esterified to varying degrees by methyl groups or be partially or completely converted into salts. cas:9000-69-5|drugbank:DB11158|foodb.food:FDB023162|glytoucan:G72929NG|hmdb:HMDB0003402|kegg.compound:C00714|kegg.drug:D02316|kegg.glycan:G10591|metacyc.compound:Pectin|pubmed:10093966|pubmed:17930085|pubmed:24751282|pubmed:24798790|pubmed:39829568|pubmed:40376805|pubmed:7446458|pubmed:7960137|pubmed:890983|reaxys:8539058|wikipedia.en:Pectin Graph Pectin|Pektin|Pektine|Poly(1,4-alpha-D-galacturonide)|pectic substance|pectina|pectinas|pectine|pectines|pectins|poly[(1->4)-alpha-D-GalpA] Pectin|Pektin|Pektine|Poly(1,4-alpha-D-galacturonide)|pectic substance|pectina|pectinas|pectine|pectines|pectins|poly[(1->4)-alpha-D-GalpA] http://purl.obolibrary.org/obo/CHEBI_17309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173094 biolink:ChemicalEntity EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitor An EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor that interferes with the action of inositol-phosphate phosphatase (EC 3.1.3.25). wikipedia.en:Inositol-phosphate_phosphatase Graph EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitors|EC 3.1.3.25 inhibitor|EC 3.1.3.25 inhibitors|IMPase inhibitor|IMPase inhibitors|L-myo-inositol-1-phosphate phosphatase inhibitor|L-myo-inositol-1-phosphate phosphatase inhibitors|inositol 1-phosphatase inhibitor|inositol 1-phosphatase inhibitors|inositol monophosphatase inhibitor|inositol monophosphatase inhibitors|inositol monophosphate phosphatase inhibitor|inositol monophosphate phosphatase inhibitors|inositol phosphatase inhibitor|inositol phosphatase inhibitors|inositol phosphate phosphatase inhibitor|inositol phosphate phosphatase inhibitors|inositol-1(or 4)-monophosphatase inhibitor|inositol-1(or 4)-monophosphatase inhibitors|inositol-phosphate phosphatase inhibitor|inositol-phosphate phosphatase inhibitors|myo-inositol 1-phosphatase inhibitor|myo-inositol 1-phosphatase inhibitors|myo-inositol monophosphatase inhibitor|myo-inositol monophosphatase inhibitors|myo-inositol-1(or 4)-monophosphatase inhibitor|myo-inositol-1(or 4)-monophosphatase inhibitors|myo-inositol-1(or 4)-phosphate phosphohydrolase inhibitor|myo-inositol-1(or 4)-phosphate phosphohydrolase inhibitors|myo-inositol-1-phosphatase inhibitor|myo-inositol-1-phosphatase inhibitors EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitors|EC 3.1.3.25 inhibitor|EC 3.1.3.25 inhibitors|IMPase inhibitor|IMPase inhibitors|L-myo-inositol-1-phosphate phosphatase inhibitor|L-myo-inositol-1-phosphate phosphatase inhibitors|inositol 1-phosphatase inhibitor|inositol 1-phosphatase inhibitors|inositol monophosphatase inhibitor|inositol monophosphatase inhibitors|inositol monophosphate phosphatase inhibitor|inositol monophosphate phosphatase inhibitors|inositol phosphatase inhibitor|inositol phosphatase inhibitors|inositol phosphate phosphatase inhibitor|inositol phosphate phosphatase inhibitors|inositol-1(or 4)-monophosphatase inhibitor|inositol-1(or 4)-monophosphatase inhibitors|inositol-phosphate phosphatase inhibitor|inositol-phosphate phosphatase inhibitors|myo-inositol 1-phosphatase inhibitor|myo-inositol 1-phosphatase inhibitors|myo-inositol monophosphatase inhibitor|myo-inositol monophosphatase inhibitors|myo-inositol-1(or 4)-monophosphatase inhibitor|myo-inositol-1(or 4)-monophosphatase inhibitors|myo-inositol-1(or 4)-phosphate phosphohydrolase inhibitor|myo-inositol-1(or 4)-phosphate phosphohydrolase inhibitors|myo-inositol-1-phosphatase inhibitor|myo-inositol-1-phosphatase inhibitors http://purl.obolibrary.org/obo/CHEBI_173094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17310 biolink:ChemicalEntity pyridoxal A pyridinecarbaldehyde that is pyridine-4-carbaldehyde bearing methyl, hydroxy and hydroxymethyl substituents at positions 2, 3 and 5 respectively. The 4-carboxyaldehyde form of vitamin B6, it is converted into pyridoxal phosphate, a coenzyme for the synthesis of amino acids, neurotransmitters, sphingolipids and aminolevulinic acid. cas:66-72-8|chemspider:1021|drugbank:DB00147|drugcentral:4134|gmelin:218674|hmdb:HMDB0001545|kegg.compound:C00250|knapsack:C00007509|metacyc.compound:PYRIDOXAL|pdb-ccd:PXL|pubmed:12001008|pubmed:150790|pubmed:1621875|pubmed:16495081|pubmed:16710308|pubmed:17765195|pubmed:20381632|pubmed:22770225|pubmed:23801094|pubmed:24365359|pubmed:31915818|pubmed:3663392|pubmed:4051187|pubmed:433818|pubmed:6853710|pubmed:7159754|pubmed:7440576|pubmed:8116826|reaxys:383768|wikipedia.en:Pyridoxal Graph 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE|3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde|Pyridoxal|pyridoxal|pyridoxaldehyde 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE|3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde|Pyridoxal|pyridoxal|pyridoxaldehyde http://purl.obolibrary.org/obo/CHEBI_17310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173100 biolink:ChemicalEntity voltage-dependent anion channel inhibitor Any agent that inhibits voltage-dependent anion channels. wikipedia.en:Voltage-dependent_anion_channel Graph VDAC blocker|VDAC blockers|VDAC inhibitor|VDAC inhibitors|voltage-dependent anion channel blocker|voltage-dependent anion channel blockers|voltage-dependent anion channel inhibitors|voltage-dependent anion-selective channel blocker|voltage-dependent anion-selective channel blockers|voltage-dependent anion-selective channel inhibitor|voltage-dependent anion-selective channel inhibitors VDAC blocker|VDAC blockers|VDAC inhibitor|VDAC inhibitors|voltage-dependent anion channel blocker|voltage-dependent anion channel blockers|voltage-dependent anion channel inhibitors|voltage-dependent anion-selective channel blocker|voltage-dependent anion-selective channel blockers|voltage-dependent anion-selective channel inhibitor|voltage-dependent anion-selective channel inhibitors http://purl.obolibrary.org/obo/CHEBI_173100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17311 biolink:ChemicalEntity N(6),N(6),N(6)-trimethyl-L-lysine An α-amino-acid cation that is the N6-trimethyl derivative of L-lysine. beilstein:4133409|cas:19253-88-4|drugbank:DB03977|kegg.compound:C03793|pdb-ccd:M3L Graph (S)-2-amino-6-(trimethylammonio)hexanoic acid|(S)-5-amino-5-carboxy-N,N,N-trimethyl-1-pentanaminium|N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium|N(epsilon)-trimethyllysine|N-TRIMETHYLLYSINE|N6,N6,N6-Trimethyl-L-lysine|epsilon-N-trimethyl-L-lysine|epsilon-trimethyl-L-lysine|epsilon-trimethyllysine|trimethyllysine N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium (S)-2-amino-6-(trimethylammonio)hexanoic acid|(S)-5-amino-5-carboxy-N,N,N-trimethyl-1-pentanaminium|N(6),N(6),N(6)-trimethyl-L-lysin-N(6)-ium|N(epsilon)-trimethyllysine|N-TRIMETHYLLYSINE|N6,N6,N6-Trimethyl-L-lysine|epsilon-N-trimethyl-L-lysine|epsilon-trimethyl-L-lysine|epsilon-trimethyllysine|trimethyllysine http://purl.obolibrary.org/obo/CHEBI_17311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173112 biolink:ChemicalEntity DNA 5'-phosphate polyanion Graph DNA 5'-phosphate polymer DNA 5'-phosphate polymer http://purl.obolibrary.org/obo/CHEBI_173112 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:173113 biolink:ChemicalEntity 3'-end ribonucleotide 2'-phosphate(3-) residue Graph 3'-terminal ribonucleotide 2'-phosphate residue 3'-terminal ribonucleotide 2'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_173113 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:173114 biolink:ChemicalEntity tRNA 5'-phosphate polyanion Graph tRNA 5'-phosphate polymer tRNA 5'-phosphate polymer http://purl.obolibrary.org/obo/CHEBI_173114 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:173115 biolink:ChemicalEntity poly(RNA)-3'-adenine ribonucleotide polyanion Graph poly(RNA)-3'-adenine ribonucleotide polymer poly(RNA)-3'-adenine ribonucleotide polymer http://purl.obolibrary.org/obo/CHEBI_173115 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:173116 biolink:ChemicalEntity poly(RNA)-3'-uridine ribonucleotide polyanion Graph poly(RNA)-3'-uridine ribonucleotide polymer poly(RNA)-3'-uridine ribonucleotide polymer http://purl.obolibrary.org/obo/CHEBI_173116 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:173118 biolink:ChemicalEntity ribonucleotide-ribonucleotide(2-) residue Graph ribonucleotide-ribonucleotide residue ribonucleotide-ribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_173118 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17312 biolink:ChemicalEntity N(1)-acetylspermine An acetylspermine carrying an acetyl group at position N1. cas:25593-72-0|hmdb:HMDB0001186|kegg.compound:C02567|metacyc.compound:N1-ACETYLSPERMINE|pdb-ccd:SP5|pubmed:22959971|pubmed:3757213|pubmed:4065178|pubmed:7260107|reaxys:4180788 Graph N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide|N1-Acetylspermine N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide|N1-Acetylspermine http://purl.obolibrary.org/obo/CHEBI_17312 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17313 biolink:ChemicalEntity 7,8-dihydroxycoumarin cas:486-35-1|kegg.compound:C03093|knapsack:C00002462|lincs.smallmolecule:LSM-3366 Graph 7,8-Dihydroxy-2H-1-benzopyran-2-one|7,8-Dihydroxycoumarin|7,8-dihydroxy-2H-chromen-2-one|7,8-dihydroxycoumarin|Daphnetin|Daphnetol 7,8-dihydroxy-2H-chromen-2-one 7,8-Dihydroxy-2H-1-benzopyran-2-one|7,8-Dihydroxycoumarin|7,8-dihydroxy-2H-chromen-2-one|7,8-dihydroxycoumarin|Daphnetin|Daphnetol http://purl.obolibrary.org/obo/CHEBI_17313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17314 biolink:ChemicalEntity 13-hydroxydocosanoic acid A C22 hydroxy fatty acid with the hydroxy group at the 13-position and intermediate in the synthesis of sophorosyloxydocosanoate; a yeast glycolipid with potential medical and chemical engineering applications. cas:13980-16-0|kegg.compound:C03049|lipidmaps:LMFA01050210|pubmed:422563|pubmed:5075510|reaxys:1795554 Graph 13-Hydroxydocosanoate|13-Hydroxydocosanoic acid|13-hydroxydocosanoic acid|HDA 13-Hydroxydocosanoic acid|13-hydroxydocosanoic acid 13-Hydroxydocosanoate|13-Hydroxydocosanoic acid|13-hydroxydocosanoic acid|HDA http://purl.obolibrary.org/obo/CHEBI_17314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17315 biolink:ChemicalEntity D-glucosamine An amino sugar whose structure comprises D-glucose having an amino substituent at position 2. hmdb:HMDB0001514|pubmed:19067146|pubmed:59831|reaxys:1724602 Graph 2-amino-2-deoxy-D-glucose|2-amino-D-2-deoxyglucose|2-deoxy-2-amino-D-glucose|D-GlcN|D-glucosamine 2-amino-2-deoxy-D-glucose|D-glucosamine 2-amino-2-deoxy-D-glucose|2-amino-D-2-deoxyglucose|2-deoxy-2-amino-D-glucose|D-GlcN|D-glucosamine http://purl.obolibrary.org/obo/CHEBI_17315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17316 biolink:ChemicalEntity 2-N,6-O-disulfo-D-glucosamine kegg.compound:C03789|pdb-ccd:SGN Graph 2-N-sulfo-6-O-sulfo-D-glucosamine|2-deoxy-2-sulfoamino-D-glucose 6-(hydrogen sulfate)|2-deoxy-6-O-sulfo-2-sulfoamino-D-glucose|N,6-O-Disulfo-D-glucosamine|N2,6-Disulfo-D-glucosamine 2-N-sulfo-6-O-sulfo-D-glucosamine|2-deoxy-2-sulfoamino-D-glucose 6-(hydrogen sulfate)|2-deoxy-6-O-sulfo-2-sulfoamino-D-glucose 2-N-sulfo-6-O-sulfo-D-glucosamine|2-deoxy-2-sulfoamino-D-glucose 6-(hydrogen sulfate)|2-deoxy-6-O-sulfo-2-sulfoamino-D-glucose|N,6-O-Disulfo-D-glucosamine|N2,6-Disulfo-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_17316 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17317 biolink:ChemicalEntity D-sorbose Any form of sorbose that has D-configuration. Graph D-Sor|D-Sorbose|D-sorbose|D-xylo-Hexulose|D-xylo-hex-2-ulose D-Sorbose|D-sorbose|D-xylo-hex-2-ulose D-Sor|D-Sorbose|D-sorbose|D-xylo-Hexulose|D-xylo-hex-2-ulose http://purl.obolibrary.org/obo/CHEBI_17317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17318 biolink:ChemicalEntity N-(3,4-dichlorophenyl)malonamate A monocarboxylic acid anion that is the conjugate base of N-(3,4-dichlorophenyl)malonamic acid arising from deprotonation of the carboxy group. kegg.compound:C04205 Graph 3-[(3,4-dichlorophenyl)amino]-3-oxopropanoate|N-(3,4-Dichlorophenyl)-malonamate|N-(3,4-dichlorophenyl)malonamate 3-[(3,4-dichlorophenyl)amino]-3-oxopropanoate 3-[(3,4-dichlorophenyl)amino]-3-oxopropanoate|N-(3,4-Dichlorophenyl)-malonamate|N-(3,4-dichlorophenyl)malonamate http://purl.obolibrary.org/obo/CHEBI_17318 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17319 biolink:ChemicalEntity 5'-deoxyadenosine A 5'-deoxyribonucleoside compound having adenosine as the nucleobase. cas:4754-39-6|hmdb:HMDB0001983|kegg.compound:C05198|metacyc.compound:CH33ADO|pdb-ccd:5AD|pubmed:15116424|pubmed:23615610|reaxys:91536 Graph 5'-DEOXYADENOSINE|5'-Deoxyadenosine|5'-deoxyadenosine 5'-DEOXYADENOSINE|5'-Deoxyadenosine|5'-deoxyadenosine 5'-DEOXYADENOSINE|5'-Deoxyadenosine|5'-deoxyadenosine http://purl.obolibrary.org/obo/CHEBI_17319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17321 biolink:ChemicalEntity 5,6,7,8-tetrahydromethanopterin cas:92481-94-2|kegg.compound:C01217 Graph 1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphonato]-alpha-D-ribofuranosyl}-D-ribitol|1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5,6,7,8-Tetrahydromethanopterin|H4MPT|Pentitol, 1-(4-((1-(2-amino-1,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl)ethyl)amino)phenyl)-1-deoxy-5-O-(5-O-((1,3-dicarboxypropoxy)hydroxyphosphinyl)-alpha-D-ribofuranosyl)-, (16alpha)-|tetrahydromethanopterin 1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol 1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphonato]-alpha-D-ribofuranosyl}-D-ribitol|1-(4-{(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5,6,7,8-Tetrahydromethanopterin|H4MPT|Pentitol, 1-(4-((1-(2-amino-1,4,5,6,7,8-hexahydro-7-methyl-4-oxo-6-pteridinyl)ethyl)amino)phenyl)-1-deoxy-5-O-(5-O-((1,3-dicarboxypropoxy)hydroxyphosphinyl)-alpha-D-ribofuranosyl)-, (16alpha)-|tetrahydromethanopterin http://purl.obolibrary.org/obo/CHEBI_17321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17322 biolink:ChemicalEntity chloric acid cas:7790-93-4|gmelin:1492|kegg.compound:C01485|pdb-ccd:LCO Graph Chlorate|Chloric acid|Chlorsaeure|HClO3|[ClO2(OH)]|chloric acid|hydroxidodioxidochlorine Chloric acid|chloric acid|hydroxidodioxidochlorine Chlorate|Chloric acid|Chlorsaeure|HClO3|[ClO2(OH)]|chloric acid|hydroxidodioxidochlorine http://purl.obolibrary.org/obo/CHEBI_17322 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173225 biolink:ChemicalEntity UDP-3-O-[(3R)-hydroxyacyl]-N-acetyl-alpha-D-glucosamine(2-) Graph a UDP-3-O-((3R)-3-hydroxyacyl)-N-acetyl-alpha-D-glucosamine a UDP-3-O-((3R)-3-hydroxyacyl)-N-acetyl-alpha-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_173225 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17323 biolink:ChemicalEntity trans-pinosylvin beilstein:1870942|cas:102-61-4|cas:22139-77-1|kegg.compound:C01745|knapsack:C00002897 Graph (E)-3,5-stilbenediol|(E)-5-(2-phenylethenyl)-1,3-benzenediol|(E)-pinosylvin|5-[(1E)-2-phenylethenyl]benzene-1,3-diol|5-[(E)-2-phenylvinyl]benzene-1,3-diol|pinosylvine|trans-3,5-dihydroxystilbene 5-[(1E)-2-phenylethenyl]benzene-1,3-diol (E)-3,5-stilbenediol|(E)-5-(2-phenylethenyl)-1,3-benzenediol|(E)-pinosylvin|5-[(1E)-2-phenylethenyl]benzene-1,3-diol|5-[(E)-2-phenylvinyl]benzene-1,3-diol|pinosylvine|trans-3,5-dihydroxystilbene http://purl.obolibrary.org/obo/CHEBI_17323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17325 biolink:ChemicalEntity 3-hydroxy-3-methylglutarate(2-) A dicarboxylic acid dianion that results from the removal of a proton from both of the carboxylic acid groups of 3-hydroxy-3-methylglutaric acid. kegg.compound:C03761|metacyc.compound:CPD-547 Graph 3-hydroxy-3-methylglutarate|3-hydroxy-3-methylpentanedioate 3-hydroxy-3-methylpentanedioate 3-hydroxy-3-methylglutarate|3-hydroxy-3-methylpentanedioate http://purl.obolibrary.org/obo/CHEBI_17325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17326 biolink:ChemicalEntity nucleoside 5'-triphoshate kegg.compound:C00201 Graph NTP|Nucleoside triphosphate|nucleoside triphosphates NTP|Nucleoside triphosphate|nucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_17326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17327 biolink:ChemicalEntity phytol A diterpenoid that is hexadec-2-en-1-ol substituted by methyl groups at positions 3, 7, 11 and 15. cas:150-86-7|cas:7541-49-3|hmdb:HMDB0002019|kegg.compound:C01389|knapsack:C00003467|lipidmaps:LMPR0104010002|metacyc.compound:PHYTOL|pubmed:17015885|pubmed:24333358|pubmed:24392173|pubmed:24422895|reaxys:7855349 Graph (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-ol|(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol|Phytol|phytol|trans-Phytol (2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-ol|(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol|Phytol|phytol|trans-Phytol http://purl.obolibrary.org/obo/CHEBI_17327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17328 biolink:ChemicalEntity N(6)-[(indol-3-yl)acetyl]-L-lysine beilstein:6153789|kegg.compound:C04211 Graph (2S)-2-amino-6-(1H-indol-3-ylacetamido)hexanoic acid|N(6)-(1H-indol-3-ylacetyl)-L-lysine|N6-[(Indol-3-yl)acetyl]-L-lysine|N6-[(Indole-3-yl)acetyl]-L-lysine (2S)-2-amino-6-(1H-indol-3-ylacetamido)hexanoic acid|N(6)-(1H-indol-3-ylacetyl)-L-lysine (2S)-2-amino-6-(1H-indol-3-ylacetamido)hexanoic acid|N(6)-(1H-indol-3-ylacetyl)-L-lysine|N6-[(Indol-3-yl)acetyl]-L-lysine|N6-[(Indole-3-yl)acetyl]-L-lysine http://purl.obolibrary.org/obo/CHEBI_17328 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17329 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N(6)-(L-alanyl)-L-lysyl-D-alanyl-D-alanine kegg.compound:C04894 Graph UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N6-(L-alanyl)-L-lysyl-D-alanyl-D-alanine UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N6-(L-alanyl)-L-lysyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_17329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17331 biolink:ChemicalEntity N-benzoylanthranilate A benzoate that is the conjugate base of N-benzoylanthranilic acid arising from deprotonation of the carboxy group. cas:579-93-1|kegg.compound:C03141 Graph 2-(benzoylamino)benzoate|2-benzamidobenzoate|N-Benzoylanthranilate|N-benzoylanthranilate 2-benzamidobenzoate 2-(benzoylamino)benzoate|2-benzamidobenzoate|N-Benzoylanthranilate|N-benzoylanthranilate http://purl.obolibrary.org/obo/CHEBI_17331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17332 biolink:ChemicalEntity planteose cas:470-57-5|kegg.compound:C03848|kegg.glycan:G09080|knapsack:C00001144 Graph 6(F)-alpha-D-galactosylsucrose|6F-alpha-D-Galactosylsucrose|6F-alpha-D-galactosylsucrose|Planteose|alpha-D-galactopyranosyl-(1->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside alpha-D-galactopyranosyl-(1->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside 6(F)-alpha-D-galactosylsucrose|6F-alpha-D-Galactosylsucrose|6F-alpha-D-galactosylsucrose|Planteose|alpha-D-galactopyranosyl-(1->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_17332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17333 biolink:ChemicalEntity chorismic acid The (3R,4R)-stereoisomer of 5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid. beilstein:5038108|cas:617-12-9|ecmdb:ECMDB12199|hmdb:HMDB0012199|kegg.compound:C00251|knapsack:C00000733|pubmed:11745165|pubmed:23757404|pubmed:4897776|pubmed:5834235|pubmed:8744423|pubmed:8971708|reaxys:2217365|wikipedia.en:Chorismic_acid|ymdb:YMDB00148 Graph (3R,4R)-3-[(1-carboxyethenyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid|(3R,4R)-3-[(1-carboxyvinyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid|(3R-trans)-3-((1-carboxyethenyl)oxy)-4-hydroxy-1,5-cyclohexadiene-1-carboxylic acid|Chorismic acid (3R,4R)-3-[(1-carboxyethenyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid (3R,4R)-3-[(1-carboxyethenyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid|(3R,4R)-3-[(1-carboxyvinyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid|(3R-trans)-3-((1-carboxyethenyl)oxy)-4-hydroxy-1,5-cyclohexadiene-1-carboxylic acid|Chorismic acid http://purl.obolibrary.org/obo/CHEBI_17333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17334 biolink:ChemicalEntity penicillin Any member of the group of substituted penams containing two methyl substituents at position 2, a carboxylate substituent at position 3 and a carboxamido group at position 6. kegg.compound:C00395|pubmed:11851248|pubmed:12833570|pubmed:1502708|pubmed:16033609|pubmed:7061385|pubmed:7798534|wikipedia.en:Penicillin Graph Penicillin|penicillins penicillins Penicillin|penicillins http://purl.obolibrary.org/obo/CHEBI_17334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17335 biolink:ChemicalEntity 4-O-beta-D-glucosyl-4-coumaric acid beilstein:6528358|kegg.compound:C04415 Graph 3-[4-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid|4-O-[4-(2-carboxyvinyl)phenyl]-beta-D-glucopyranose 3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid 3-[4-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|3-[4-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid|4-O-[4-(2-carboxyvinyl)phenyl]-beta-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_17335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17336 biolink:ChemicalEntity all-trans-retinol A retinol in which all four exocyclic double bonds have E- (trans-) geometry. beilstein:403040|cas:11103-57-4|cas:68-26-8|chemspider:393012|drugbank:DB00162|drugcentral:2831|gmelin:247497|hmdb:HMDB0000305|kegg.compound:C00473|kegg.compound:C17276|kegg.drug:D00069|kegg.drug:D06543|knapsack:C00031437|lipidmaps:LMPR01090001|metacyc.compound:CPD-13524|pdb-ccd:RTL|pubmed:10637381|pubmed:12074187|pubmed:12221269|pubmed:12229281|pubmed:12548314|pubmed:12600856|pubmed:1414975|pubmed:15041701|pubmed:15051608|pubmed:15531678|pubmed:15622799|pubmed:15929633|pubmed:16469975|pubmed:16507353|pubmed:16825693|pubmed:17790232|pubmed:19264891|pubmed:20697621|pubmed:2217163|pubmed:22444309|pubmed:2295828|pubmed:25478840|pubmed:30510477|pubmed:31484771|pubmed:7971717|pubmed:8464067|pubmed:8496140|pubmed:9155646|pubmed:9736606|wikipedia.en:Retinol Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol|(all-E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraen-1-ol|Alphalin|Aquasol A|Chocola A|Vitamin A1|all-trans retinol|all-trans-Retinol|all-trans-retinol|all-trans-retinyl alcohol|all-trans-vitamin A|all-trans-vitamin A alcohol|retinol|retinol (vit A)|retinolum|trans-retinol|vitamin A|vitamin A alcohol|vitamin A1|vitamin A1 alcohol all-trans-Retinol|all-trans-retinol (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol|(all-E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraen-1-ol|Alphalin|Aquasol A|Chocola A|Vitamin A1|all-trans retinol|all-trans-Retinol|all-trans-retinol|all-trans-retinyl alcohol|all-trans-vitamin A|all-trans-vitamin A alcohol|retinol|retinol (vit A)|retinolum|trans-retinol|vitamin A|vitamin A alcohol|vitamin A1|vitamin A1 alcohol http://purl.obolibrary.org/obo/CHEBI_17336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17337 biolink:ChemicalEntity (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid kegg.compound:C04522 Graph (2-chloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2-Chloro-2,5-dihydro-5-oxofuran-2-acetate|2-Chloro-5-oxo-2,5-dihydrofuran-2-acetate|2-chloro-5-oxo-2,5-dihydrofuran-2-acetate|5-Chloro-2,5-dihydro-2-oxofuran-5-acetate|5-chloro-2,5-dihydro-2-oxofuran-5-acetate (2-chloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid (2-chloro-5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2-Chloro-2,5-dihydro-5-oxofuran-2-acetate|2-Chloro-5-oxo-2,5-dihydrofuran-2-acetate|2-chloro-5-oxo-2,5-dihydrofuran-2-acetate|5-Chloro-2,5-dihydro-2-oxofuran-5-acetate|5-chloro-2,5-dihydro-2-oxofuran-5-acetate http://purl.obolibrary.org/obo/CHEBI_17337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17338 biolink:ChemicalEntity CDP-3,6-dideoxy-D-glucose A CDP-sugar having 3,6-dideoxy-D-glucose as the sugar component. Graph cytidine 5'-[3-(3,6-dideoxy-D-ribo-hexopyranosyl) dihydrogen diphosphate] cytidine 5'-[3-(3,6-dideoxy-D-ribo-hexopyranosyl) dihydrogen diphosphate] cytidine 5'-[3-(3,6-dideoxy-D-ribo-hexopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17339 biolink:ChemicalEntity N(5)-acyl-L-ornithine An L-ornithine compound having an acyl substituent at the N5-position. kegg.compound:C02858 Graph N5-Acyl-L-ornithine N5-Acyl-L-ornithine http://purl.obolibrary.org/obo/CHEBI_17339 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17340 biolink:ChemicalEntity cetraxate A cyclohexanecarboxylate ester that consists of 4-(2-carboxyethyl)phenyl cyclohexanecarboxylate bearing an aminomethyl substituent at the 4-position. cas:34675-84-8|drugcentral:582|kegg.compound:C01564|kegg.drug:D07663|pubmed:1003703|pubmed:12436309|pubmed:15099451|pubmed:17323190|pubmed:3367546|pubmed:3435599|pubmed:4029808|pubmed:8020637|pubmed:8350665|pubmed:8871449|reaxys:2820321|wikipedia.en:Cetraxate Graph 3-[4-({[(1r,4r)-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid|3-[4-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid|Cetraxate|p-hydroxyhydrocinnamic acid trans-(4-aminomethyl)cyclohexanecarboxylate|trans-4-(((4-(aminomethyl)cyclohexyl)carbonyl)oxy)benzenepropanoic acid 3-[4-({[(1r,4r)-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid 3-[4-({[(1r,4r)-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid|3-[4-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid|Cetraxate|p-hydroxyhydrocinnamic acid trans-(4-aminomethyl)cyclohexanecarboxylate|trans-4-(((4-(aminomethyl)cyclohexyl)carbonyl)oxy)benzenepropanoic acid http://purl.obolibrary.org/obo/CHEBI_17340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17342 biolink:ChemicalEntity L-2-aminohexano-6-lactam A 2-aminohexano-6-lactam derived from L-lysine. beilstein:80946|kegg.compound:C02837|reaxys:80946 Graph (3S)-3-aminoazepan-2-one|L-2-Amino-hexano-6-lactam|L-Lysine 1,6-lactam|L-alpha-Aminocaprolactam|L-alpha-amino-epsilon-caprolactam (3S)-3-aminoazepan-2-one (3S)-3-aminoazepan-2-one|L-2-Amino-hexano-6-lactam|L-Lysine 1,6-lactam|L-alpha-Aminocaprolactam|L-alpha-amino-epsilon-caprolactam http://purl.obolibrary.org/obo/CHEBI_17342 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173421 biolink:ChemicalEntity Ethyl pyruvate cas:617-35-6|chemspider:11544|drugbank:DB05869|hmdb:HMDB0031643|pdb-ccd:9X7 Graph ethyl 2-oxopropanoate ethyl 2-oxopropanoate ethyl 2-oxopropanoate http://purl.obolibrary.org/obo/CHEBI_173421 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17344 biolink:ChemicalEntity 2-carboxy-cis,cis-muconic acid kegg.compound:C03666 Graph (3Z)-buta-1,3-diene-1,1,4-tricarboxylic acid|2-Carboxy-cis,cis-muconate|2-carboxy-cis,cis-muconate (3Z)-buta-1,3-diene-1,1,4-tricarboxylic acid (3Z)-buta-1,3-diene-1,1,4-tricarboxylic acid|2-Carboxy-cis,cis-muconate|2-carboxy-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_17344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17345 biolink:ChemicalEntity guanosine 5'-monophosphate A purine ribonucleoside 5'-monophosphate having guanine as the nucleobase. cas:85-32-5|drugbank:DB01972|hmdb:HMDB0001397|kegg.compound:C00144|knapsack:C00019635|metacyc.compound:GMP|pdb-ccd:5GP|pubmed:11233304|pubmed:11670950|pubmed:22735334|pubmed:2559771|pubmed:3569407|reaxys:59430|wikipedia.en:Guanosine_monophosphate Graph 5'-GMP|5'-guanylic acid|GMP|Guanosine 5'-monophosphate|Guanosine 5'-phosphate|Guanosine monophosphate|Guanylic acid|[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate|guanosine-5'-monophosphate|pG 5'-guanylic acid|[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate 5'-GMP|5'-guanylic acid|GMP|Guanosine 5'-monophosphate|Guanosine 5'-phosphate|Guanosine monophosphate|Guanylic acid|[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate|guanosine-5'-monophosphate|pG http://purl.obolibrary.org/obo/CHEBI_17345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17346 biolink:ChemicalEntity 4-chlorophenylacetonitrile A nitrile that is acetonitrile in which one of the hydrogens has been replaced by a p-chlorophenyl group. beilstein:971171|cas:140-53-4|gmelin:1125640|kegg.compound:C03679 Graph (4-chlorophenyl)acetonitrile|(p-chlorophenyl)acetonitrile|4-Chlorobenzyl cyanide|4-Chlorophenylacetonitrile|4-chlorobenzeneacetonitrile|4-chlorophenylacetonitrile|p-chlorobenzyl cyanide (4-chlorophenyl)acetonitrile (4-chlorophenyl)acetonitrile|(p-chlorophenyl)acetonitrile|4-Chlorobenzyl cyanide|4-Chlorophenylacetonitrile|4-chlorobenzeneacetonitrile|4-chlorophenylacetonitrile|p-chlorobenzyl cyanide http://purl.obolibrary.org/obo/CHEBI_17346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17347 biolink:ChemicalEntity testosterone An androstanoid having 17β-hydroxy and 3-oxo groups, together with unsaturation at C-4‒C-5.. beilstein:3653705|cas:58-22-0|drugbank:DB00624|drugcentral:2607|gmelin:538843|hmdb:HMDB0000234|kegg.compound:C00535|kegg.drug:D00075|knapsack:C00003675|lipidmaps:LMST02020002|pdb-ccd:TES|pubmed:10438974|pubmed:11786693|pubmed:18900503|pubmed:24498482|reaxys:1915399|wikipedia.en:Testosterone Graph 17beta-Hydroxy-4-androsten-3-one|17beta-hydroxy-4-androsten-3-one|17beta-hydroxyandrost-4-en-3-one|4-androsten-17beta-ol-3-one|Androderm|TESTOSTERONE|Testosteron|Testosterone|testosterona|testosterone|testosteronum 17beta-hydroxyandrost-4-en-3-one 17beta-Hydroxy-4-androsten-3-one|17beta-hydroxy-4-androsten-3-one|17beta-hydroxyandrost-4-en-3-one|4-androsten-17beta-ol-3-one|Androderm|TESTOSTERONE|Testosteron|Testosterone|testosterona|testosterone|testosteronum http://purl.obolibrary.org/obo/CHEBI_17347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17348 biolink:ChemicalEntity D-aldohexose 6-phosphate Any D-aldose having a six-carbon chain with a phosphate group at C-6. Graph 6-O-phosphono-D-glycero-hexose|D-glycero-hexose 6-(dihydrogen phosphate) 6-O-phosphono-D-glycero-hexose|D-glycero-hexose 6-(dihydrogen phosphate) 6-O-phosphono-D-glycero-hexose|D-glycero-hexose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17349 biolink:ChemicalEntity 5-methyl-5,6,7,8-tetrahydromethanopterin Graph 1-(4-{(1R)-1-[(6S,7S)-2-amino-5,7-dimethyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5-Methyl-5,6,7,8-tetrahydro-methanopterin|CH3-H4MPT|N(5)-Methyltetrahydromethanopterin 1-(4-{(1R)-1-[(6S,7S)-2-amino-5,7-dimethyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol 1-(4-{(1R)-1-[(6S,7S)-2-amino-5,7-dimethyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethylamino}phenyl)-1-deoxy-5-O-{5-O-[(1S)-1,3-dicarboxypropylphosphono]-alpha-D-ribofuranosyl}-D-ribitol|5-Methyl-5,6,7,8-tetrahydro-methanopterin|CH3-H4MPT|N(5)-Methyltetrahydromethanopterin http://purl.obolibrary.org/obo/CHEBI_17349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17351 biolink:ChemicalEntity linoleic acid An octadecadienoic acid in which the two double bonds are at positions 9 and 12 and have Z (cis) stereochemistry. cas:60-33-3|drugcentral:3323|gmelin:57557|hmdb:HMDB0000673|kegg.compound:C01595|knapsack:C00001224|lipidmaps:LMFA01030120|metacyc.compound:LINOLEIC_ACID|pdb-ccd:EIC|pubmed:11113630|pubmed:11304127|pubmed:11322990|pubmed:14667063|pubmed:14993245|pubmed:15115315|pubmed:15642793|pubmed:15969511|pubmed:16254037|pubmed:16563718|pubmed:17647039|pubmed:18044828|pubmed:18990554|pubmed:19628674|pubmed:19936816|pubmed:23900039|pubmed:24081493|pubmed:6205897|reaxys:1727101|wikipedia.en:Linoleic_acid Graph (9Z,12Z)-Octadecadienoic acid|(9Z,12Z)-octadeca-9,12-dienoic acid|(Z,Z)-9,12-octadecadienoic acid|9-cis,12-cis-Octadecadienoic acid|9Z,12Z-octadecadienoic acid|C18:2 9c, 12c omega6 todos cis-9,12-octadienoico|C18:2, n-6,9 all-cis|LA|LINOLEIC ACID|Linoleic acid|acide cis-linoleique|acide linoleique|acido linoleico|all-cis-9,12-octadecadienoic acid|cis,cis-9,12-octadecadienoic acid|cis,cis-linoleic acid|cis-Delta(9,12)-octadecadienoic acid|linolic acid (9Z,12Z)-octadeca-9,12-dienoic acid (9Z,12Z)-Octadecadienoic acid|(9Z,12Z)-octadeca-9,12-dienoic acid|(Z,Z)-9,12-octadecadienoic acid|9-cis,12-cis-Octadecadienoic acid|9Z,12Z-octadecadienoic acid|C18:2 9c, 12c omega6 todos cis-9,12-octadienoico|C18:2, n-6,9 all-cis|LA|LINOLEIC ACID|Linoleic acid|acide cis-linoleique|acide linoleique|acido linoleico|all-cis-9,12-octadecadienoic acid|cis,cis-9,12-octadecadienoic acid|cis,cis-linoleic acid|cis-Delta(9,12)-octadecadienoic acid|linolic acid http://purl.obolibrary.org/obo/CHEBI_17351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173517 biolink:ChemicalEntity N-Acetyl-p-benzoquinonimine chemspider:26532009 Graph N-(2,5-dioxocyclohex-3-en-1-ylidene)acetamide N-(2,5-dioxocyclohex-3-en-1-ylidene)acetamide N-(2,5-dioxocyclohex-3-en-1-ylidene)acetamide http://purl.obolibrary.org/obo/CHEBI_173517 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17352 biolink:ChemicalEntity (R)-mandelamide A mandelamide in which the stereocentre at position 2 has R-configuration. kegg.compound:C07301|reaxys:2575137 Graph (2R)-2-hydroxy-2-phenylacetamide|(R)-Mandelamide|(R)-mandelamide (2R)-2-hydroxy-2-phenylacetamide (2R)-2-hydroxy-2-phenylacetamide|(R)-Mandelamide|(R)-mandelamide http://purl.obolibrary.org/obo/CHEBI_17352 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17354 biolink:ChemicalEntity 16beta-hydroxy steroid A 16-hydroxy steroid in which the hydroxy group at position 16 has a β-configuration. kegg.compound:C03050|metacyc.compound:16-BETA-HYDROXYSTEROID Graph 16beta-Hydroxysteroid|16beta-hydroxy steroids|a 16-beta-hydroxysteroid 16beta-Hydroxysteroid|16beta-hydroxy steroids|a 16-beta-hydroxysteroid http://purl.obolibrary.org/obo/CHEBI_17354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17355 biolink:ChemicalEntity (S)-2-acetamido-6-oxopimelic acid kegg.compound:C05539 Graph (2S)-2-acetamido-6-oxoheptanedioic acid|L-2-Acetamido-6-oxoheptanedioate|L-2-Acetamido-6-oxopimelate|N-Acetyl-L-2-amino-6-oxopimelate (2S)-2-acetamido-6-oxoheptanedioic acid (2S)-2-acetamido-6-oxoheptanedioic acid|L-2-Acetamido-6-oxoheptanedioate|L-2-Acetamido-6-oxopimelate|N-Acetyl-L-2-amino-6-oxopimelate http://purl.obolibrary.org/obo/CHEBI_17355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17356 biolink:ChemicalEntity 2-acetamidofluorene The parent of the class of 2-acetamidofluorenes, being an ortho-fused polycyclic arene that consists of 9H-fluorene bearing an acetamido substituent at position 2. It is a carcinogenic and mutagenic derivative of fluorene. cas:53-96-3|kegg.compound:C02778|lincs.smallmolecule:LSM-37153|pdb-ccd:AFF|pubmed:15380103|pubmed:17434228|pubmed:21417629|pubmed:21668357|pubmed:22514719|pubmed:23536516|pubmed:24021430|pubmed:7151044|reaxys:2807677|wikipedia.en:2-Acetylaminofluorene Graph 2-(Acetylamino)fluorene|2-AAF|2-ACETYLAMINOFLUORENE-3-YL|2-Acetamidofluorene|2-Acetaminofluorene|2-Acetoaminofluorene|2-Acetylaminofluorene|2-FAA|2-acetamidofluorene|N-(9H-fluoren-2-yl)acetamide|N-2-Fluorenylacetamide|N-Acetyl-2-aminofluorene|N-fluoren-2-ylacetamide N-(9H-fluoren-2-yl)acetamide 2-(Acetylamino)fluorene|2-AAF|2-ACETYLAMINOFLUORENE-3-YL|2-Acetamidofluorene|2-Acetaminofluorene|2-Acetoaminofluorene|2-Acetylaminofluorene|2-FAA|2-acetamidofluorene|N-(9H-fluoren-2-yl)acetamide|N-2-Fluorenylacetamide|N-Acetyl-2-aminofluorene|N-fluoren-2-ylacetamide http://purl.obolibrary.org/obo/CHEBI_17356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17357 biolink:ChemicalEntity L-rhamnonic acid beilstein:1724577|cas:6422-34-0|kegg.compound:C01934 Graph 6-deoxy-L-mannonic acid|L-Rhamnonate 6-deoxy-L-mannonic acid 6-deoxy-L-mannonic acid|L-Rhamnonate http://purl.obolibrary.org/obo/CHEBI_17357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17358 biolink:ChemicalEntity N(4)-phosphoagmatine kegg.compound:C02726 Graph N4-Phosphoagmatine|[4-(carbamimidamido)butyl]phosphoramidic acid [4-(carbamimidamido)butyl]phosphoramidic acid N4-Phosphoagmatine|[4-(carbamimidamido)butyl]phosphoramidic acid http://purl.obolibrary.org/obo/CHEBI_17358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17359 biolink:ChemicalEntity sulfite A sulfur oxoanion that is the conjugate base of hydrogen sulfite (H2SO3). cas:14265-45-3|gmelin:1449|pdb-ccd:SO3 Graph SO3|SO3(2-)|SULFITE ION|[SO3](2-)|sulfite|sulphite|trioxidosulfate(2-)|trioxosulfate(2-)|trioxosulfate(IV) sulfite|trioxidosulfate(2-)|trioxosulfate(2-)|trioxosulfate(IV) SO3|SO3(2-)|SULFITE ION|[SO3](2-)|sulfite|sulphite|trioxidosulfate(2-)|trioxosulfate(2-)|trioxosulfate(IV) http://purl.obolibrary.org/obo/CHEBI_17359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17360 biolink:ChemicalEntity D-altronate Conjugate base of D-altronic acid. beilstein:3906526|kegg.compound:C00817 Graph D-Altronate|D-altronate D-Altronate|D-altronate D-Altronate|D-altronate http://purl.obolibrary.org/obo/CHEBI_17360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17361 biolink:ChemicalEntity cytidine 5'-monophosphate A pyrimidine ribonucleoside 5'-monophosphate having cytosine as the nucleobase. cas:63-37-6|drugbank:DB03403|hmdb:HMDB0000095|kegg.compound:C00055|kegg.glycan:G10621|metacyc.compound:CMP|pdb-ccd:C5P|pubmed:21968653|pubmed:22991951|pubmed:24053133|pubmed:2559771|reaxys:46982 Graph 5'-cytidylic acid|CMP|Cytidine-5'-monophosphate|Cytidylic acid|cytidine 5'-monophosphate|cytidylate|pC 5'-cytidylic acid 5'-cytidylic acid|CMP|Cytidine-5'-monophosphate|Cytidylic acid|cytidine 5'-monophosphate|cytidylate|pC http://purl.obolibrary.org/obo/CHEBI_17361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17362 biolink:ChemicalEntity quinoline The simplest member of the quinoline class of compounds, comprising a benzene ring ortho fused to C-2 and C-3 of a pyridine ring. cas:91-22-5|gmelin:27201|hmdb:HMDB0033731|kegg.compound:C06413|knapsack:C00026478|metacyc.compound:QUINOLINE|pubmed:16406213|pubmed:8070089|reaxys:107477|wikipedia.en:Quinoline Graph Chinolin|Quinoline|benzo[b]pyridine|quinoline Quinoline|quinoline Chinolin|Quinoline|benzo[b]pyridine|quinoline http://purl.obolibrary.org/obo/CHEBI_17362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17363 biolink:ChemicalEntity D-ribulose 5-phosphate The D-enantiomer of ribulose 5-phosphate that is one of the end-products of the pentose phosphate pathway. cas:4151-19-3|cas:551-85-9|drugbank:DB04034|hmdb:HMDB0000618|kegg.compound:C00199|metacyc.compound:RIBULOSE-5P|pdb-ccd:5RP|pubmed:21253719|wikipedia.en:Ribulose_5-phosphate Graph 5-O-phosphono-D-ribulose|D-Ribulose 5-phosphate|D-erythro-pent-2-ulose 5-(dihydrogen phosphate) 5-O-phosphono-D-ribulose 5-O-phosphono-D-ribulose|D-Ribulose 5-phosphate|D-erythro-pent-2-ulose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17364 biolink:ChemicalEntity D-aspartic acid The D-enantiomer of aspartic acid. cas:1783-96-6|drugbank:DB02655|gmelin:602084|hmdb:HMDB0006483|kegg.compound:C00402|metacyc.compound:CPD-302|pdb-ccd:DAS|pubmed:11419736|pubmed:17118457|pubmed:17407322|pubmed:18318836|pubmed:19860889|reaxys:1723529 Graph (2R)-2-aminobutanedioic acid|(R)-2-aminobutanedioic acid|(R)-2-aminosuccinic acid|D-Asparaginsaeure|D-Aspartic acid|D-aspartic acid|DAS|aspartic acid D-form (2R)-2-aminobutanedioic acid|D-Aspartic acid|D-aspartic acid (2R)-2-aminobutanedioic acid|(R)-2-aminobutanedioic acid|(R)-2-aminosuccinic acid|D-Asparaginsaeure|D-Aspartic acid|D-aspartic acid|DAS|aspartic acid D-form http://purl.obolibrary.org/obo/CHEBI_17364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17365 biolink:ChemicalEntity 2,4-dichloro-cis,cis-muconic acid beilstein:2091815|cas:22752-97-2|kegg.compound:C03918 Graph (2E,4E)-2,4-dichlorohexa-2,4-dienedioic acid|(E,E)-2,4-dichloro-2,4-hexadienedioic acid|2,4-Dichloro-cis,cis-muconate (2E,4E)-2,4-dichlorohexa-2,4-dienedioic acid (2E,4E)-2,4-dichlorohexa-2,4-dienedioic acid|(E,E)-2,4-dichloro-2,4-hexadienedioic acid|2,4-Dichloro-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_17365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17367 biolink:ChemicalEntity 2-hydroxy-6-oxonona-2,4-dienedioic acid Graph 2-hydroxy-6-oxonona-2,4-diene-1,9-dioic acid|2-hydroxy-6-oxonona-2,4-dienedioic acid 2-hydroxy-6-oxonona-2,4-dienedioic acid 2-hydroxy-6-oxonona-2,4-diene-1,9-dioic acid|2-hydroxy-6-oxonona-2,4-dienedioic acid http://purl.obolibrary.org/obo/CHEBI_17367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17368 biolink:ChemicalEntity hypoxanthine A purine nucleobase that consists of purine bearing an oxo substituent at position 6. cas:68-94-0|drugbank:DB04076|ecmdb:ECMDB00157|gmelin:464558|hmdb:HMDB0000157|kegg.compound:C00262|knapsack:C00001502|metacyc.compound:HYPOXANTHINE|pdb-ccd:HPA|pubmed:14253484|pubmed:1557408|pubmed:22735334|pubmed:23400363|pubmed:23670363|pubmed:8016081|reaxys:5811|wikipedia.en:Hypoxanthine|ymdb:YMDB00555 Graph 1,7-dihydro-6H-purin-6-one|6(1H)-purinone|6-oxopurine|9H-purin-6(1H)-one|HYPOXANTHINE|Hyp|Hypoxanthine|Purine-6-ol|hypoxanthine|purin-6(1H)-one 1,7-dihydro-6H-purin-6-one 1,7-dihydro-6H-purin-6-one|6(1H)-purinone|6-oxopurine|9H-purin-6(1H)-one|HYPOXANTHINE|Hyp|Hypoxanthine|Purine-6-ol|hypoxanthine|purin-6(1H)-one http://purl.obolibrary.org/obo/CHEBI_17368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17369 biolink:ChemicalEntity D-mannose 6-phosphate A mannose phosphate in which the phosphate group is attached to position 6. cas:3672-15-9|kegg.compound:C00275 Graph 6-O-phosphono-D-mannose|D-Mannose 6-phosphate|D-mannose 6-(dihydrogen phosphate)|Mannose 6-phosphate D-mannose 6-(dihydrogen phosphate) 6-O-phosphono-D-mannose|D-Mannose 6-phosphate|D-mannose 6-(dihydrogen phosphate)|Mannose 6-phosphate http://purl.obolibrary.org/obo/CHEBI_17369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17371 biolink:ChemicalEntity macrocin A macrolide antibiotic that is tylonolide having mono- and diglycosyl moieties attached to two of its hydroxy groups. cas:11049-15-3|kegg.compound:C00744|knapsack:C00018716|reaxys:6468979|wikipedia.en:Macrocin Graph 3(sup C)-O-Demethyltylosin|Macrocin|Tylosin C|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2-O-methyl-beta-D-allopyranoside [(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2-O-methyl-beta-D-allopyranoside 3(sup C)-O-Demethyltylosin|Macrocin|Tylosin C|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2-O-methyl-beta-D-allopyranoside http://purl.obolibrary.org/obo/CHEBI_17371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173719 biolink:ChemicalEntity Curcumol cas:4871-97-0|chemspider:10226466 Graph (1S,2S,5S,8R,9S)-2-methyl-6-methylidene-9-propan-2-yl-11-oxatricyclo[6.2.1.01,5]undecan-8-ol (1S,2S,5S,8R,9S)-2-methyl-6-methylidene-9-propan-2-yl-11-oxatricyclo[6.2.1.01,5]undecan-8-ol (1S,2S,5S,8R,9S)-2-methyl-6-methylidene-9-propan-2-yl-11-oxatricyclo[6.2.1.01,5]undecan-8-ol http://purl.obolibrary.org/obo/CHEBI_173719 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17372 biolink:ChemicalEntity 1,2-dihydrovomilenine An indole alkaloid obtained by selective hydrogenation of the 1,2-position of vomilenine. kegg.compound:C11808|metacyc.compound:12-DIHYDROVOMILENINE|pubmed:11937349|pubmed:12391554|pubmed:35368755|reaxys:10721827 Graph (2R)-1,2-dihydrovomilenine|1,2-Dihydrovomilenine|2-beta-(R)-1,2-Dihydrovomilenine|21alpha-hydroxy-22-norajmal-19-en-17alpha-yl acetate 21alpha-hydroxy-22-norajmal-19-en-17alpha-yl acetate (2R)-1,2-dihydrovomilenine|1,2-Dihydrovomilenine|2-beta-(R)-1,2-Dihydrovomilenine|21alpha-hydroxy-22-norajmal-19-en-17alpha-yl acetate http://purl.obolibrary.org/obo/CHEBI_17372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17374 biolink:ChemicalEntity N(6)-acetyl-N(6)-hydroxy-L-lysine cas:88492-29-9|kegg.compound:C03955 Graph N(6)-acetyl-N(6)-hydroxy-L-lysine|N6-Acetyl-N6-hydroxy-L-lysine|N6-Acetyl-N6-hydroxylysine|N6-acetyl-N6-hydroxy-L-lysine N(6)-acetyl-N(6)-hydroxy-L-lysine N(6)-acetyl-N(6)-hydroxy-L-lysine|N6-Acetyl-N6-hydroxy-L-lysine|N6-Acetyl-N6-hydroxylysine|N6-acetyl-N6-hydroxy-L-lysine http://purl.obolibrary.org/obo/CHEBI_17374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17375 biolink:ChemicalEntity (2S)-2-hydroxy monocarboxylic acid A 2-hydroxy monocarboxylic acid in which the carbon at position 2 has (S)-configuration. Graph (2S)-2-hydroxy monocarboxylic acids|(S)-2-Hydroxy acid|(S)-2-Hydroxyalkanoic acid|(S)-2-Hydroxycarboxylic acid|(S)-2-Hydroxymonocarboxylic acid (2S)-2-hydroxy monocarboxylic acids|(S)-2-Hydroxy acid|(S)-2-Hydroxyalkanoic acid|(S)-2-Hydroxycarboxylic acid|(S)-2-Hydroxymonocarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17376 biolink:ChemicalEntity cystine A sulfur-containing amino acid obtained by the oxidation of two cysteine molecules which are then linked via a disulfide bond. cas:923-32-0|gmelin:83347|kegg.compound:C01420|pubmed:18608550|pubmed:24327171|pubmed:24525029|pubmed:24525030|reaxys:1728091|wikipedia.en:Cystine Graph 3,3'-disulfanediylbis(2-aminopropanoic acid)|3,3'-dithiobis(2-aminopropanoic acid)|Cystin|Cystine|Dicysteine|Zystin|alpha-Diamino-beta-dithiolactic acid|cistina|cystine 3,3'-disulfanediylbis(2-aminopropanoic acid)|Cystine|cystine 3,3'-disulfanediylbis(2-aminopropanoic acid)|3,3'-dithiobis(2-aminopropanoic acid)|Cystin|Cystine|Dicysteine|Zystin|alpha-Diamino-beta-dithiolactic acid|cistina|cystine http://purl.obolibrary.org/obo/CHEBI_17376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17378 biolink:ChemicalEntity D-glyceraldehyde The D-enantiomer of glyceraldehyde. beilstein:5726453|cas:367-47-5|cas:453-17-8|ecmdb:ECMDB01051|kegg.compound:C00577|pdb-ccd:3GR|reaxys:1720474|ymdb:YMDB00575 Graph (2R)-2,3-dihydroxypropanal|D-(+)-glyceraldehyde|D-2,3-dihydroxypropanal|D-2,3-dihydroxypropionaldehyde|D-Glyceraldehyde|D-aldotriose|D-glyceraldehyde|D-glycerose|GLYCERALDEHYDE (2R)-2,3-dihydroxypropanal (2R)-2,3-dihydroxypropanal|D-(+)-glyceraldehyde|D-2,3-dihydroxypropanal|D-2,3-dihydroxypropionaldehyde|D-Glyceraldehyde|D-aldotriose|D-glyceraldehyde|D-glycerose|GLYCERALDEHYDE http://purl.obolibrary.org/obo/CHEBI_17378 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17379 biolink:ChemicalEntity isovitexin 2''-O-beta-D-glucoside "A disaccharide derivative that is the 2""-O-β-D-glucosyl derivative of isovitexin ." cas:60767-80-8|hmdb:HMDB0029484|kegg.compound:C04199|lipidmaps:LMPK12110217|metacyc.compound:ISOVITEXIN-2-O-B-D-GLUCOSIDE|pubmed:23123264|reaxys:1417079 Graph (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-2-O-beta-D-glucopyranosyl-D-glucitol|Isovitexin 2''-O-beta-D-glucoside|Meloside A (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-2-O-beta-D-glucopyranosyl-D-glucitol (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-2-O-beta-D-glucopyranosyl-D-glucitol|Isovitexin 2''-O-beta-D-glucoside|Meloside A http://purl.obolibrary.org/obo/CHEBI_17379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17380 biolink:ChemicalEntity 3-hydroxy-L-kynurenine cas:606-14-4|kegg.compound:C03227|knapsack:C00007443|metacyc.compound:3-HYDROXY-L-KYNURENINE|pdb-ccd:3DJ|ymdb:YMDB00105 Graph (2S)-2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid|3-(2-amino-3-hydroxybenzoyl)-L-alanine|3-(3-hydroxyanthraniloyl)-L-alanine|3-Hydroxy-L-kynurenine|L-3-hydroxykynurenine 3-(2-amino-3-hydroxybenzoyl)-L-alanine (2S)-2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid|3-(2-amino-3-hydroxybenzoyl)-L-alanine|3-(3-hydroxyanthraniloyl)-L-alanine|3-Hydroxy-L-kynurenine|L-3-hydroxykynurenine http://purl.obolibrary.org/obo/CHEBI_17380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17381 biolink:ChemicalEntity porphobilinogen A dicarboxylic acid that is pyrole bearing aminomethyl, carboxymethyl and 2-carboxyethyl substituents at positions 2, 3 and 4 respectively. cas:487-90-1|drugbank:DB02272|hmdb:HMDB0000245|kegg.compound:C00931|knapsack:C00007339|metacyc.compound:PORPHOBILINOGEN|pdb-ccd:PBG|pubmed:21383008|pubmed:21627493|pubmed:22279024|pubmed:22740490|pubmed:22770225|pubmed:22974111|reaxys:220051|wikipedia.en:Porphobilinogen Graph 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid|Porphobilinogen 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid 3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid|Porphobilinogen http://purl.obolibrary.org/obo/CHEBI_17381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:173817 biolink:ChemicalEntity Tetrahydroneopterin cas:25976-00-5|chemspider:141864|hmdb:HMDB0000942 Graph 2-amino-6-(1,2,3-trihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one 2-amino-6-(1,2,3-trihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one 2-amino-6-(1,2,3-trihydroxypropyl)-5,6,7,8-tetrahydro-3H-pteridin-4-one http://purl.obolibrary.org/obo/CHEBI_173817 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17382 biolink:ChemicalEntity 5'-O-beta-D-glucosylpyridoxine agr:ADL87012489|beilstein:1499713|cas:26545-80-2|chemspider:389176|kegg.compound:C03996|pubmed:12023280|pubmed:12221231|pubmed:12730423|pubmed:15051835|pubmed:1552357|pubmed:7722696|pubmed:8229303 Graph 5'-O-(beta-D-glucopyranosyl)pyridoxine|5'-O-(glucopyranosyl)pyridoxine|5'-O-beta-D-Glucosylpyridoxine|5'-O-beta-D-glucosylpyridoxine|5'-pyridoxine glucoside|[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl beta-D-glucopyranoside|beta-D-glucopyranoside pyridoxol|pyridoxine beta-glucoside|pyridoxine-5'-beta-D-glucoside [5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl beta-D-glucopyranoside 5'-O-(beta-D-glucopyranosyl)pyridoxine|5'-O-(glucopyranosyl)pyridoxine|5'-O-beta-D-Glucosylpyridoxine|5'-O-beta-D-glucosylpyridoxine|5'-pyridoxine glucoside|[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl beta-D-glucopyranoside|beta-D-glucopyranoside pyridoxol|pyridoxine beta-glucoside|pyridoxine-5'-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_17382 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17383 biolink:ChemicalEntity GDP-D-glucose kegg.compound:C00394 Graph GDP-glucose|guanosine 5'-[3-(D-glucopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(D-glucopyranosyl) dihydrogen diphosphate] GDP-glucose|guanosine 5'-[3-(D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17383 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17384 biolink:ChemicalEntity 17-O-acetylnorajmaline An indole alkaloid obtained by formal acetylation of the 17-hydroxy group of norajmaline. kegg.compound:C11809|metacyc.compound:17-O-ACETYLNORAJMALINE|pubmed:12391554 Graph (2beta,7beta,16xi,17R,20beta,21alpha)-21-hydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-17-yl acetate|17-O-Acetylnorajmaline|21alpha-hydroxy-22-norajmalan-17alpha-yl acetate (2beta,7beta,16xi,17R,20beta,21alpha)-21-hydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-17-yl acetate|21alpha-hydroxy-22-norajmalan-17alpha-yl acetate (2beta,7beta,16xi,17R,20beta,21alpha)-21-hydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-17-yl acetate|17-O-Acetylnorajmaline|21alpha-hydroxy-22-norajmalan-17alpha-yl acetate http://purl.obolibrary.org/obo/CHEBI_17384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17387 biolink:ChemicalEntity O-acylcarnitine Any carboxylic ester obtained by the O-acylation of carnitine. Graph http://purl.obolibrary.org/obo/CHEBI_17387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17388 biolink:ChemicalEntity (S)-1-pyrroline-5-carboxylate A 1-pyrroline-5-carboxylate resulting from the removal of the proton from the carboxy group of (S)-1-pyrroline-5-carboxylic acid. hmdb:HMDB0001301|kegg.compound:C03912 Graph (2S)-3,4-dihydro-2H-pyrrole-2-carboxylate|(S)-1-pyrroline-5-carboxylate|S-1-pyrroline-5-carboxylate (2S)-3,4-dihydro-2H-pyrrole-2-carboxylate (2S)-3,4-dihydro-2H-pyrrole-2-carboxylate|(S)-1-pyrroline-5-carboxylate|S-1-pyrroline-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_17388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17389 biolink:ChemicalEntity 2-monoglyceride A monoglyceride in which the acyl substituent is located at position 2. kegg.compound:C02112 Graph 2-Acylglycerol|2-Glyceride|2-Monoacylglycerol|2-monoglycerides|a 2-acylglycerol 2-monoglycerides 2-Acylglycerol|2-Glyceride|2-Monoacylglycerol|2-monoglycerides|a 2-acylglycerol http://purl.obolibrary.org/obo/CHEBI_17389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17390 biolink:ChemicalEntity allocryptopine cas:24240-04-8|cas:485-91-6|kegg.compound:C02134|knapsack:C00001799|pubmed:17144252|pubmed:21419197|pubmed:29323165|pubmed:30882133|pubmed:31389311|pubmed:31459055|pubmed:32219908|pubmed:34004513|pubmed:35695648|pubmed:36831001|pubmed:9352312 Graph 3,4-dimethoxy-6-methyl-5,7,8,15-tetrahydrobenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one|5,7,8,15-Tetrahydro-3,4-dimethoxy-6-methyl(1,3)benzodioxolo(5,6-e)(2)benzazecin-14(6H)-one|Allocryptopine|Thalictrimine|allocryptopine|alpha-Allocryptopine|alpha-Fagarine|beta-Homochelidonine 3,4-dimethoxy-6-methyl-5,7,8,15-tetrahydrobenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one 3,4-dimethoxy-6-methyl-5,7,8,15-tetrahydrobenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one|5,7,8,15-Tetrahydro-3,4-dimethoxy-6-methyl(1,3)benzodioxolo(5,6-e)(2)benzazecin-14(6H)-one|Allocryptopine|Thalictrimine|allocryptopine|alpha-Allocryptopine|alpha-Fagarine|beta-Homochelidonine http://purl.obolibrary.org/obo/CHEBI_17390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17391 biolink:ChemicalEntity 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside kegg.compound:C04695 Graph (1S,2S,3R,4S,5S,6S)-3-(D-galactopyranosyloxy)-2,4,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate|5-O-(Indol-3-ylacetyl-myo-inositol) D-galactoside|5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside (1S,2S,3R,4S,5S,6S)-3-(D-galactopyranosyloxy)-2,4,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate (1S,2S,3R,4S,5S,6S)-3-(D-galactopyranosyloxy)-2,4,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate|5-O-(Indol-3-ylacetyl-myo-inositol) D-galactoside|5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside http://purl.obolibrary.org/obo/CHEBI_17391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17393 biolink:ChemicalEntity D-allose Graph D-All|D-allo-hexose|D-allose D-allo-hexose|D-allose D-All|D-allo-hexose|D-allose http://purl.obolibrary.org/obo/CHEBI_17393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17394 biolink:ChemicalEntity N(5)-ethyl-L-glutamine A N5-alkylglutamine where the alkyl group is ethyl. It has been isolated from green tea. cas:3081-61-6|hmdb:HMDB0034365|kegg.compound:C01047|pdb-ccd:85G|pubmed:20416364|pubmed:22422488|pubmed:23096008|pubmed:23097345|pubmed:23395732|pubmed:24304633|reaxys:1725586|wikipedia.en:L-theanine Graph (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid|L-Theanine|L-theanine|N(5)-ethyl-L-glutamine|N5-Ethyl-L-glutamine (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid|N(5)-ethyl-L-glutamine (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid|L-Theanine|L-theanine|N(5)-ethyl-L-glutamine|N5-Ethyl-L-glutamine http://purl.obolibrary.org/obo/CHEBI_17394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17396 biolink:ChemicalEntity (R)-prunasin beilstein:91509|cas:99-18-3|kegg.compound:C00844 Graph (2R)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(R)-(beta-D-glucopyranosyloxy)phenylacetonitrile|(R)-Prunasin|(R)-alpha-(beta-D-glucopyranosyloxy)benzene-acetonitrile|(R)-mandelonitrile beta-D-glucopyranoside|(R)-mandelonitrile beta-D-glucoside|(R)-prunasin|D-prunasin|prunasin (2R)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile (2R)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(R)-(beta-D-glucopyranosyloxy)phenylacetonitrile|(R)-Prunasin|(R)-alpha-(beta-D-glucopyranosyloxy)benzene-acetonitrile|(R)-mandelonitrile beta-D-glucopyranoside|(R)-mandelonitrile beta-D-glucoside|(R)-prunasin|D-prunasin|prunasin http://purl.obolibrary.org/obo/CHEBI_17396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17397 biolink:ChemicalEntity 3-methyloxindole A member of the class of oxindoles that is oxindole (1,3-dihydro-2H-indol-2-one) in which one of the hydrogens at position 3 has been replaced by a methyl group. cas:1504-06-9|kegg.compound:C02366 Graph 1,3-Dihydro-3-methyl-2H-indol-2-one|3-Methyloxindole|3-methyl-1,3-dihydro-2H-indol-2-one|3-methyl-1,3-dihydroindol-2-one|3-methyloxindole 3-methyl-1,3-dihydro-2H-indol-2-one 1,3-Dihydro-3-methyl-2H-indol-2-one|3-Methyloxindole|3-methyl-1,3-dihydro-2H-indol-2-one|3-methyl-1,3-dihydroindol-2-one|3-methyloxindole http://purl.obolibrary.org/obo/CHEBI_17397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17399 biolink:ChemicalEntity L-xylulose cas:527-50-4|kegg.compound:C00312 Graph L-Lyxulose|L-Xul|L-Xylulose|L-threo-Pentulose|L-threo-pent-2-ulose|L-xylulose L-Xylulose|L-xylulose L-Lyxulose|L-Xul|L-Xylulose|L-threo-Pentulose|L-threo-pent-2-ulose|L-xylulose http://purl.obolibrary.org/obo/CHEBI_17399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17400 biolink:ChemicalEntity raucaffricine cas:31282-07-2|kegg.compound:C02074|knapsack:C00024300|knapsack:C00024346 Graph (16S,17R,19E)-21alpha-(beta-D-glucopyranosyloxy)-1,2-didehydro-2,7-dihydro-7beta,17-cyclosarpagan-17-yl acetate|Raucaffricine|raucaffricine (16S,17R,19E)-21alpha-(beta-D-glucopyranosyloxy)-1,2-didehydro-2,7-dihydro-7beta,17-cyclosarpagan-17-yl acetate (16S,17R,19E)-21alpha-(beta-D-glucopyranosyloxy)-1,2-didehydro-2,7-dihydro-7beta,17-cyclosarpagan-17-yl acetate|Raucaffricine|raucaffricine http://purl.obolibrary.org/obo/CHEBI_17400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17401 biolink:ChemicalEntity myo-inositol hexakisphosphate A myo-inositol hexakisphosphate in which each hydroxy group of myo-inositol is monophosphorylated. cas:83-86-3|drugcentral:3465|kegg.compound:C01204|metacyc.compound:HEXAKISPHOSPHATE|pubmed:11217149|pubmed:11545369|pubmed:12070948|pubmed:12162428|pubmed:12816787|pubmed:12949395|pubmed:15325752|pubmed:15743020|pubmed:15918884|pubmed:15952339|pubmed:15998131|pubmed:16438310|pubmed:17162330|pubmed:18536177|pubmed:19331859|pubmed:21292245|pubmed:22023391|pubmed:6095072|reaxys:2201952|wikipedia.en:Phytic_acid Graph 1D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate|1D-myo-Inositol hexakisphosphate|D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate|Inosithexaphosphorsaeure|Phytate|Phytic acid|Phytine|Saeure des phytins|acide fytique|acido fitico|acidum fyticum|myo-Inositol hexakisphosphate|myo-inositol 1,2,3,4,5,6-hexakisphosphate|myo-inositol hexakis(dihydrogen phosphate) myo-Inositol hexakisphosphate|myo-inositol hexakis(dihydrogen phosphate) 1D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate|1D-myo-Inositol hexakisphosphate|D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate|Inosithexaphosphorsaeure|Phytate|Phytic acid|Phytine|Saeure des phytins|acide fytique|acido fitico|acidum fyticum|myo-Inositol hexakisphosphate|myo-inositol 1,2,3,4,5,6-hexakisphosphate|myo-inositol hexakis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17402 biolink:ChemicalEntity 2-methylpropanoyl phosphate kegg.compound:C03754 Graph 2-Methylpropanoyl phosphate|2-Methylpropionyl phosphate|2-methylpropanoyl dihydrogen phosphate|isobutyryl phosphate 2-Methylpropanoyl phosphate|2-methylpropanoyl dihydrogen phosphate 2-Methylpropanoyl phosphate|2-Methylpropionyl phosphate|2-methylpropanoyl dihydrogen phosphate|isobutyryl phosphate http://purl.obolibrary.org/obo/CHEBI_17402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17403 biolink:ChemicalEntity 3-chloro-L-alanine A 3-chloroalanine that has R configutation at the chiral centre. cas:2731-73-9|kegg.compound:C02635|lincs.smallmolecule:LSM-6205|pdb-ccd:C22|pubmed:33167 Graph 3-Chloro-L-alanine|3-chloro-L-alanine 3-Chloro-L-alanine|3-chloro-L-alanine 3-Chloro-L-alanine|3-chloro-L-alanine http://purl.obolibrary.org/obo/CHEBI_17403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17405 biolink:ChemicalEntity 4-pyridoxic acid A methylpyridine that is 2-methylpyridine substituted by a hydroxy group at C-3, a carboxy group at C-4, and a hydroxymethyl group at C-5. It is the catabolic product of vitamin B6 and is excreted in the urine. cas:82-82-6|chemspider:6467|foodb.food:FDB021874|hmdb:HMDB0000017|kegg.compound:C00847|knapsack:C00052160|metacyc.compound:CPD-1112|pubmed:11756060|pubmed:1462525|pubmed:14747687|pubmed:1783639|pubmed:17868768|pubmed:22770225|pubmed:23535534|pubmed:2580028|pubmed:28778380|pubmed:30845778|pubmed:32346589|pubmed:8505768|reaxys:384006 Graph 2-methyl-3-hydroxy-4-carboxy-5-hydroxymethylpyridine|3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinecarboxylic acid|3-hydroxy-5-(hydroxymethyl)-2-methylisonicotinic acid|3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carboxylic acid|4-Pyridoxic acid|4-Pyridoxinsaeure|4-pyridoxinecarboxylic acid|4-pyridoxinic acid|4-pyridoxylic acid|pyridoxic acid 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carboxylic acid 2-methyl-3-hydroxy-4-carboxy-5-hydroxymethylpyridine|3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinecarboxylic acid|3-hydroxy-5-(hydroxymethyl)-2-methylisonicotinic acid|3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carboxylic acid|4-Pyridoxic acid|4-Pyridoxinsaeure|4-pyridoxinecarboxylic acid|4-pyridoxinic acid|4-pyridoxylic acid|pyridoxic acid http://purl.obolibrary.org/obo/CHEBI_17405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17406 biolink:ChemicalEntity 3-(imidazol-5-yl)pyruvic acid An oxo carboxylic acid that is pyruvic acid in which one of the methyl hydrogens has been replaced by an imidazol-5-yl group. kegg.compound:C03277 Graph 3-(1H-imidazol-5-yl)-2-oxopropanoic acid|3-(Imidazol-5-yl)pyruvate|Imidazol-5-yl-pyruvate|Imidazole pyruvate|Imidazole pyruvic acid 3-(1H-imidazol-5-yl)-2-oxopropanoic acid 3-(1H-imidazol-5-yl)-2-oxopropanoic acid|3-(Imidazol-5-yl)pyruvate|Imidazol-5-yl-pyruvate|Imidazole pyruvate|Imidazole pyruvic acid http://purl.obolibrary.org/obo/CHEBI_17406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17407 biolink:ChemicalEntity 2-trans,6-trans-farnesyl diphosphate The trans,trans-stereoisomer of farnesyl diphosphate. cas:13058-04-3|cas:372-97-4|kegg.compound:C00448|knapsack:C00000907|knapsack:C00007268|lipidmaps:LMPR0103010002|pdb-ccd:FPP|pubmed:7753173|reaxys:2482197 Graph (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate|(2E,6E)-Farnesyl diphosphate|(2E,6E)-farnesol diphosphate|(2E,6E)-farnesyl diphosphate|(2E,6E)-farnesyl pyrophosphate|(E,E)-farnesyl pyrophosphate|(all-E)-farnesyl diphosphate|2-trans,6-trans-Farnesyl diphosphate|2-trans,6-trans-farnesyl diphosphate|2-trans,6-trans-farnesyl pyrophosphate|FARNESYL DIPHOSPHATE|Farnesyl diphosphate|Farnesyl pyrophosphate|all-trans-farnesyl pyrophosphate|trans,trans-Farnesyl diphosphate|trans,trans-farnesyl diphosphate|trans-trans-farnesyl diphosphate (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate|(2E,6E)-Farnesyl diphosphate|(2E,6E)-farnesol diphosphate|(2E,6E)-farnesyl diphosphate|(2E,6E)-farnesyl pyrophosphate|(E,E)-farnesyl pyrophosphate|(all-E)-farnesyl diphosphate|2-trans,6-trans-Farnesyl diphosphate|2-trans,6-trans-farnesyl diphosphate|2-trans,6-trans-farnesyl pyrophosphate|FARNESYL DIPHOSPHATE|Farnesyl diphosphate|Farnesyl pyrophosphate|all-trans-farnesyl pyrophosphate|trans,trans-Farnesyl diphosphate|trans,trans-farnesyl diphosphate|trans-trans-farnesyl diphosphate http://purl.obolibrary.org/obo/CHEBI_17407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17408 biolink:ChemicalEntity monoacylglycerol A glyceride in which any one of the R groups (position not specified) is an acyl group while the remaining two R groups can be either H or alkyl groups. kegg.compound:C15590|metacyc.compound:Monoacylglycerols|wikipedia.en:Monoglyceride Graph Acylglycerol|Glyceride|Monoacylglycerol|Monoglyceride|a monoacylglycerol|mono-O-acylglycerols|monoacylglycerols|monoglycerides Acylglycerol|Glyceride|Monoacylglycerol|Monoglyceride|a monoacylglycerol|mono-O-acylglycerols|monoacylglycerols|monoglycerides http://purl.obolibrary.org/obo/CHEBI_17408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17409 biolink:ChemicalEntity 10-hydroxycapric acid A 10-carbon, ω-hydroxy fatty acid, shown to be the preferred hydroxylation product (together with the 9-OH isomer) of capric acid in biosystems, and used as a standard in lipid assays; reported to have cytotoxic effects. cas:1679-53-4|kegg.compound:C02774|lipidmaps:LMFA01050033|metacyc.compound:10-HYDROXYDECANOATE|pubmed:113393|pubmed:15134144|pubmed:1839651|reaxys:1705390 Graph 10-Hydroxydecanoate|10-Hydroxydecanoic acid|10-OH-capric acid|10-OH-decanoic acid|10-hydroxycapric acid|10-hydroxydecanoic acid 10-Hydroxydecanoic acid|10-hydroxydecanoic acid 10-Hydroxydecanoate|10-Hydroxydecanoic acid|10-OH-capric acid|10-OH-decanoic acid|10-hydroxycapric acid|10-hydroxydecanoic acid http://purl.obolibrary.org/obo/CHEBI_17409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17410 biolink:ChemicalEntity pteridine-2,4,6,7-tetrol beilstein:791466|kegg.compound:C03178 Graph Tetrahydroxypteridine|pteridine-2,4,6,7-tetrol pteridine-2,4,6,7-tetrol Tetrahydroxypteridine|pteridine-2,4,6,7-tetrol http://purl.obolibrary.org/obo/CHEBI_17410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17411 biolink:ChemicalEntity aldehydo-N-acetyl-D-glucosamine The open-chain form of N-acetyl-D-glucosamine. drugbank:DB00141 Graph 2-Acetamido-2-deoxy-D-glucose|2-acetamido-2-deoxy-D-glucose|D-GlcNAc|N-Acetyl-D-glucosamine|N-Acetylchitosamine 2-Acetamido-2-deoxy-D-glucose|2-acetamido-2-deoxy-D-glucose 2-Acetamido-2-deoxy-D-glucose|2-acetamido-2-deoxy-D-glucose|D-GlcNAc|N-Acetyl-D-glucosamine|N-Acetylchitosamine http://purl.obolibrary.org/obo/CHEBI_17411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17412 biolink:ChemicalEntity R'C(R)S-S(R)CR' Any disulfide with structure R'C(R)S-S(R)CR' in which R and R' can be =S or =O, or a variety of other groups. kegg.compound:C02318 Graph R'C(R)S-S(R)CR' R'C(R)S-S(R)CR' http://purl.obolibrary.org/obo/CHEBI_17412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17413 biolink:ChemicalEntity 2-(hydroxymethyl)-4-oxobutanoic acid A 4-oxo monocarboxylic acid that is 4-oxobutanoic acid which is substituted by a hydroxymethyl group at position 2. kegg.compound:C04106 Graph 2-(Hydroxymethyl)-4-oxobutanoate|2-(hydroxymethyl)-4-oxobutanoic acid|2-Hydroxymethyl succinate semialdehyde|alpha-Hydroxymethyl succinate semialdehyde 2-(Hydroxymethyl)-4-oxobutanoate|2-(hydroxymethyl)-4-oxobutanoic acid 2-(Hydroxymethyl)-4-oxobutanoate|2-(hydroxymethyl)-4-oxobutanoic acid|2-Hydroxymethyl succinate semialdehyde|alpha-Hydroxymethyl succinate semialdehyde http://purl.obolibrary.org/obo/CHEBI_17413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17415 biolink:ChemicalEntity 2,5-dioxopentanoic acid kegg.compound:C00433|pdb-ccd:DO4 Graph 2,5-Dioxopentanoate|2,5-dioxopentanoic acid|2-Oxoglutarate semialdehyde 2,5-Dioxopentanoate|2,5-dioxopentanoic acid 2,5-Dioxopentanoate|2,5-dioxopentanoic acid|2-Oxoglutarate semialdehyde http://purl.obolibrary.org/obo/CHEBI_17415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17416 biolink:ChemicalEntity 3,4-dihydroxyphthalic acid cas:82784-82-5|kegg.compound:C03223 Graph 3,4-Dihydroxyphthalate|3,4-Dihydroxyphthalic acid|3,4-dihydroxyphthalic acid 3,4-dihydroxyphthalic acid 3,4-Dihydroxyphthalate|3,4-Dihydroxyphthalic acid|3,4-dihydroxyphthalic acid http://purl.obolibrary.org/obo/CHEBI_17416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17417 biolink:ChemicalEntity N-caffeoylputrescine knapsack:C00002719 Graph (2E)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)acrylamide|(2E)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)prop-2-enamide|N-Caffeoylputrescine (2E)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)prop-2-enamide (2E)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)acrylamide|(2E)-N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)prop-2-enamide|N-Caffeoylputrescine http://purl.obolibrary.org/obo/CHEBI_17417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17418 biolink:ChemicalEntity valeric acid A straight-chain saturated fatty acid containing five carbon atoms. cas:109-52-4|drugbank:DB02406|gmelin:26714|hmdb:HMDB0000892|kegg.compound:C00803|knapsack:C00001208|lipidmaps:LMFA01010005|pdb-ccd:LEA|ppdb:3130|pubmed:20507156|reaxys:969454|wikipedia.en:Valeric_acid Graph 1-butanecarboxylic acid|CH3-[CH2]3-COOH|PENTANOIC ACID|Pentanoate|Pentanoic acid|Valerate|Valerianic acid|Valeriansaeure|Valeric acid|n-BuCOOH|n-Pentanoate|n-Valeric acid|n-pentanoic acid|n-valeric acid|pentanoic acid|pentoic acid|propylacetic acid|valeric acid, normal PENTANOIC ACID|Pentanoate|Pentanoic acid|pentanoic acid 1-butanecarboxylic acid|CH3-[CH2]3-COOH|PENTANOIC ACID|Pentanoate|Pentanoic acid|Valerate|Valerianic acid|Valeriansaeure|Valeric acid|n-BuCOOH|n-Pentanoate|n-Valeric acid|n-pentanoic acid|n-valeric acid|pentanoic acid|pentoic acid|propylacetic acid|valeric acid, normal http://purl.obolibrary.org/obo/CHEBI_17418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17419 biolink:ChemicalEntity 3-hydroxy-cis,cis-muconic acid kegg.compound:C03676 Graph (2E,4Z)-3-hydroxyhexa-2,4-dienedioic acid|3-Hydroxy-cis,cis-muconate|3-hydroxy-cis,cis-muconate (2E,4Z)-3-hydroxyhexa-2,4-dienedioic acid (2E,4Z)-3-hydroxyhexa-2,4-dienedioic acid|3-Hydroxy-cis,cis-muconate|3-hydroxy-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_17419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17420 biolink:ChemicalEntity tetrahydropteroyltri-L-glutamic acid kegg.compound:C04144 Graph N-{[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid|Tetrahydropteroyltri-L-glutamate N-{[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid N-{[4-({[(6S)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid|Tetrahydropteroyltri-L-glutamate http://purl.obolibrary.org/obo/CHEBI_17420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17421 biolink:ChemicalEntity heparan sulfate N-acetyl-alpha-D-glucosaminide A heparan sulfate having an N-acetyl-α-D-glucosaminyl residue at the non-reducing end. The heparan sulfate part consists of a variably sulfated repeating disaccharide unit. kegg.compound:C04649 Graph Heparan sulfate N-acetyl-alpha-D-glucosaminide Heparan sulfate N-acetyl-alpha-D-glucosaminide http://purl.obolibrary.org/obo/CHEBI_17421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17422 biolink:ChemicalEntity P(1),P(4)-bis(5'-adenosyl) tetraphosphate A diadenosyl tetraphosphate compound having the two 5'-adenosyl residues attached at the P1- and P4-positions. kegg.compound:C01260|pdb-ccd:B4P Graph (ppA)2|A(5')p4(5')A|AppppA|P1,P4-Bis(5'-adenosyl) tetraphosphate|adenosine(5')tetraphospho(5')adenosine|bis(5'-adenylyl) diphosphate adenosine(5')tetraphospho(5')adenosine (ppA)2|A(5')p4(5')A|AppppA|P1,P4-Bis(5'-adenosyl) tetraphosphate|adenosine(5')tetraphospho(5')adenosine|bis(5'-adenylyl) diphosphate http://purl.obolibrary.org/obo/CHEBI_17422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174220 biolink:ChemicalEntity Atherosperminine cas:5531-98-6|chemspider:87510|hmdb:HMDB0030304 Graph 2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine 2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine 2-(3,4-dimethoxyphenanthren-1-yl)-N,N-dimethylethanamine http://purl.obolibrary.org/obo/CHEBI_174220 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17424 biolink:ChemicalEntity 4-carboxy-2-hydroxy-cis,cis-muconic acid kegg.compound:C04324|reaxys:2265115 Graph (1E,3E)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid|4-Carboxy-2-hydroxy-cis,cis-muconate|4-Carboxy-2-hydroxyhexa-2,4-cis,cis-dienedioate|4-carboxy-2-hydroxy-cis,cis-muconate (1E,3E)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid (1E,3E)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid|4-Carboxy-2-hydroxy-cis,cis-muconate|4-Carboxy-2-hydroxyhexa-2,4-cis,cis-dienedioate|4-carboxy-2-hydroxy-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_17424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17425 biolink:ChemicalEntity 1-pyrroline-2-carboxylate The anion resulting from the removal of a proton from the carboxylic acid group of 1-pyrroline-2-carboxylic acid. beilstein:6191120|kegg.compound:C03564 Graph 3,4-dihydro-2H-pyrrole-5-carboxylate|Delta(1)-pyrroline 2-carboxylate 3,4-dihydro-2H-pyrrole-5-carboxylate 3,4-dihydro-2H-pyrrole-5-carboxylate|Delta(1)-pyrroline 2-carboxylate http://purl.obolibrary.org/obo/CHEBI_17425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17426 biolink:ChemicalEntity 5-dehydro-D-gluconic acid kegg.compound:C01062 Graph 5-Dehydro-D-gluconate|5-Dehydrogluconate|5-dehydro-D-gluconate|D-xylo-hex-5-ulosonic acid D-xylo-hex-5-ulosonic acid 5-Dehydro-D-gluconate|5-Dehydrogluconate|5-dehydro-D-gluconate|D-xylo-hex-5-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_17426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17427 biolink:ChemicalEntity 3-hydroxy-L-aspartate residue An anionic amino-acid residue resulting from the deprotonation of the carboxy group of a 3-hydroxy-L-aspartic acid residue. kegg.compound:C03957|metacyc.compound:Peptide-3-hydroxy-L-Aspartates Graph (2S)-3-hydroxyaspartate residue|3-hydroxy-L-aspartate residue|Peptide 3-hydroxy-L-aspartate (2S)-3-hydroxyaspartate residue|3-hydroxy-L-aspartate residue|Peptide 3-hydroxy-L-aspartate http://purl.obolibrary.org/obo/CHEBI_17427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17428 biolink:ChemicalEntity (R)-reticuline beilstein:1553521|beilstein:4716908|cas:3968-19-2|kegg.compound:C05178|wikipedia.en:Reticuline Graph (-)-reticuline|(1R)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1R)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-(-)-reticuline|(R)-Reticuline (1R)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (-)-reticuline|(1R)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol|(1R)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-(-)-reticuline|(R)-Reticuline http://purl.obolibrary.org/obo/CHEBI_17428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174288 biolink:ChemicalEntity 4-Nerolidylcatechol cas:74683-11-7|chemspider:4509046|hmdb:HMDB0031924 Graph 4-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]benzene-1,2-diol 4-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]benzene-1,2-diol 4-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]benzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_174288 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17429 biolink:ChemicalEntity 3-ketosucrose A glycosyl glycoside which is an intermediate in the breakdown of sucrose. The structure is that of sucrose in which the glucosyl 3-hydroxy group has been reduced to a keto group. cas:1883-12-1|kegg.compound:C05731|kegg.glycan:G10585|metacyc.compound:CPD-384|pubmed:13960188|pubmed:6038493|pubmed:7546608|pubmed:8180983|pubmed:9210346 Graph 3'-ketosucrose|3-Dehydro-alpha-D-glucosyl-beta-D-fructofuranoside|3-Ketosucrose|3-Oxosucrose|3-dehydro-alpha-D-glucosyl beta-D-fructofuranoside|3-dehydro-alpha-D-glucosyl-beta-D-fructofuranoside|beta-D-fructofuranosyl alpha-D-ribo-hexopyranosid-3-ulose beta-D-fructofuranosyl alpha-D-ribo-hexopyranosid-3-ulose 3'-ketosucrose|3-Dehydro-alpha-D-glucosyl-beta-D-fructofuranoside|3-Ketosucrose|3-Oxosucrose|3-dehydro-alpha-D-glucosyl beta-D-fructofuranoside|3-dehydro-alpha-D-glucosyl-beta-D-fructofuranoside|beta-D-fructofuranosyl alpha-D-ribo-hexopyranosid-3-ulose http://purl.obolibrary.org/obo/CHEBI_17429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17431 biolink:ChemicalEntity agmatine cas:306-60-5|kegg.compound:C00179|knapsack:C00001400 Graph (4-Aminobutyl) guanidine|(4-aminobutyl)guanidine|1-(4-aminobutyl)guanidine|Agmatine|N-(4-aminobutyl)guanidine 1-(4-aminobutyl)guanidine (4-Aminobutyl) guanidine|(4-aminobutyl)guanidine|1-(4-aminobutyl)guanidine|Agmatine|N-(4-aminobutyl)guanidine http://purl.obolibrary.org/obo/CHEBI_17431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174315 biolink:ChemicalEntity Cocaethylene cas:529-38-4|chemspider:559082 Graph ethyl (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate ethyl (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate ethyl (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_174315 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17433 biolink:ChemicalEntity queuine cas:72496-59-4|drugbank:DB02245|kegg.compound:C01449|metacyc.compound:QUEUINE|pdb-ccd:QEI Graph 2-amino-5-{[(1S,4S,5R)-4,5-dihydroxycyclopent-2-en-1-ylamino]methyl}-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one|7-(3,4-trans-4,5-cis-dihydroxy-1-cyclopenten-3-ylaminomethyl)-7-deazaguanine|Base Q|Queuine|queuine 2-amino-5-{[(1S,4S,5R)-4,5-dihydroxycyclopent-2-en-1-ylamino]methyl}-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one 2-amino-5-{[(1S,4S,5R)-4,5-dihydroxycyclopent-2-en-1-ylamino]methyl}-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one|7-(3,4-trans-4,5-cis-dihydroxy-1-cyclopenten-3-ylaminomethyl)-7-deazaguanine|Base Q|Queuine|queuine http://purl.obolibrary.org/obo/CHEBI_17433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17434 biolink:ChemicalEntity trimethylsulfonium A sulfonium compound in which the substituents on sulfur are three methyl groups. It is found in the midgut gland of the sea hare, Aplysia brasiliana, and exhibits probable ability to inhibit cholinergic responses. cas:676-84-6|gmelin:305401|hmdb:HMDB0012295|kegg.compound:C01008|pubmed:11960200|reaxys:1811612|wikipedia.en:Trimethylsulfonium Graph Trimethylsulfonium|trimethylsulfonium Trimethylsulfonium|trimethylsulfonium Trimethylsulfonium|trimethylsulfonium http://purl.obolibrary.org/obo/CHEBI_17434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17435 biolink:ChemicalEntity naphthalene-1,2-diol beilstein:1908498|cas:574-00-5|drugbank:DB07610|gmelin:241000|kegg.compound:C03012|umbbd.compound:c0129 Graph 1,2-Dihydroxynaphthalene|1,2-Naphthalenediol|1,2-naphthohydroquinone|Naphthalene-1,2-diol|beta-Naphthohydroquinone|beta-naphthohydroquinone|naphthalene-1,2-diol Naphthalene-1,2-diol|naphthalene-1,2-diol 1,2-Dihydroxynaphthalene|1,2-Naphthalenediol|1,2-naphthohydroquinone|Naphthalene-1,2-diol|beta-Naphthohydroquinone|beta-naphthohydroquinone|naphthalene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_17435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17436 biolink:ChemicalEntity (R)-5-phosphomevalonic acid A carboxyalkyl phosphate that is mevalonic acid phosphorylated at position 5. kegg.compound:C01107|knapsack:C00007304|pdb-ccd:PMV Graph (3R)-3-hydroxy-3-methyl-5-(phosphonooxy)pentanoic acid|(R)-5-Phosphomevalonate|(R)-5-Phosphomevaloonic acid|(R)-5-phosphomevalonate|(R)-Mevalonic acid 5-phosphate (3R)-3-hydroxy-3-methyl-5-(phosphonooxy)pentanoic acid (3R)-3-hydroxy-3-methyl-5-(phosphonooxy)pentanoic acid|(R)-5-Phosphomevalonate|(R)-5-Phosphomevaloonic acid|(R)-5-phosphomevalonate|(R)-Mevalonic acid 5-phosphate http://purl.obolibrary.org/obo/CHEBI_17436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17437 biolink:ChemicalEntity dimethyl sulfide A methyl sulfide in which the sulfur atom is substituted by two methyl groups. It is produced naturally by some marine algae. cas:75-18-3|hmdb:HMDB0002303|kegg.compound:C00580|metacyc.compound:CPD-7670|molbase:1888|pdb-ccd:MSM|pubmed:17347819|pubmed:19505855|pubmed:24591607|pubmed:24601952|reaxys:1696847|umbbd.compound:c0237|wikipedia.en:Dimethyl_sulfide Graph (METHYLSULFANYL)METHANE|(methylsulfanyl)methane|2-thiapropane|DMS|Dimethyl sulfide|Methyl sulfide|Methyl thioether|[SMe2]|dimethyl sulfide|dimethyl sulphide (METHYLSULFANYL)METHANE|(methylsulfanyl)methane (METHYLSULFANYL)METHANE|(methylsulfanyl)methane|2-thiapropane|DMS|Dimethyl sulfide|Methyl sulfide|Methyl thioether|[SMe2]|dimethyl sulfide|dimethyl sulphide http://purl.obolibrary.org/obo/CHEBI_17437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174376 biolink:ChemicalEntity rhapontigenin A stilbenol that is trans-stilbene in which one of the phenyl groups is substituted by hydroxy groups at positions 3 and 5, while the other phenyl group is substituted by a hydroxy group at position 3 and a methoxy group at position 4. cas:500-65-2|foodb.food:FDB008524|hmdb:HMDB0031842|knapsack:C00015562|pubmed:11259321|pubmed:16401387|pubmed:17132206|pubmed:17558811|pubmed:20134237|pubmed:21628883|pubmed:21782194|pubmed:22662760|pubmed:23221688|pubmed:24828286|pubmed:25127020|pubmed:26598549|pubmed:26986649|pubmed:30203690|pubmed:30666906|pubmed:30820014|pubmed:34363627|pubmed:35520676|pubmed:36535555|pubmed:36558013|pubmed:37295229|pubmed:37507902|pubmed:37627335|pubmed:38746013|pubmed:39344244|wikipedia.en:Rhapontigenin Graph (E)-3,3',5-trihydroxy-4'-methoxystibene|3,3',5-trihydroxy-4'-methoxystilbene|4'-methoxy-3,3',5-trihydroxystilbene|5-[(1E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1,3-benzenediol|5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol|piceatannol 4'-methyl ether|pontigenin|prontigenin|protigenin|rhapontigenin|rhapontin aglycone|rhapontin genin 5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol (E)-3,3',5-trihydroxy-4'-methoxystibene|3,3',5-trihydroxy-4'-methoxystilbene|4'-methoxy-3,3',5-trihydroxystilbene|5-[(1E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1,3-benzenediol|5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol|piceatannol 4'-methyl ether|pontigenin|prontigenin|protigenin|rhapontigenin|rhapontin aglycone|rhapontin genin http://purl.obolibrary.org/obo/CHEBI_174376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17438 biolink:ChemicalEntity O-beta-D-xylosylzeatin kegg.compound:C03300 Graph 2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-yl beta-D-xylopyranoside|O-beta-D-Xylosylzeatin|O-beta-D-Xyloxylzeatin|O-beta-D-xylosylzeatin 2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-yl beta-D-xylopyranoside 2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-yl beta-D-xylopyranoside|O-beta-D-Xylosylzeatin|O-beta-D-Xyloxylzeatin|O-beta-D-xylosylzeatin http://purl.obolibrary.org/obo/CHEBI_17438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17439 biolink:ChemicalEntity cyanocob(III)alamin A complex cob(III)alamin in which cobalt is positioned in the centre of a planar corrin tetrapyrrole ring and bound axially to a 5,6-dimethylbenzimidazole moiety and a cyano group. It is one of several forms of the vitamin known as vitamin B12. cas:68-19-9|drugbank:DB00115|gmelin:249901|gmelin:457955|kegg.compound:C02823|kegg.drug:D00166|knapsack:C00001534|pdb-ccd:CNC|pubmed:29286160 Graph CN-Cbl|CO-CYANOCOBALAMIN|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-cyanocobamide|Cyanocob(III)alamin|Dicopac|Vitamin B12 complex|cyanocob(III)alamin|cyanocobalamin|vitamin B-12 Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-cyanocobamide|Cyanocob(III)alamin|cyanocob(III)alamin CN-Cbl|CO-CYANOCOBALAMIN|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-cyanocobamide|Cyanocob(III)alamin|Dicopac|Vitamin B12 complex|cyanocob(III)alamin|cyanocobalamin|vitamin B-12 http://purl.obolibrary.org/obo/CHEBI_17439 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17441 biolink:ChemicalEntity chlorite cas:14998-27-7 Graph ClO2(-)|[ClO2](-)|chlorite|dioxidochlorate(1-) dioxidochlorate(1-) ClO2(-)|[ClO2](-)|chlorite|dioxidochlorate(1-) http://purl.obolibrary.org/obo/CHEBI_17441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17442 biolink:ChemicalEntity 4-(2-aminophenyl)-2,4-dioxobutanoic acid kegg.compound:C01252 Graph 4-(2-Aminophenyl)-2,4-dioxobutanoate|4-(2-aminophenyl)-2,4-dioxobutanoic acid 4-(2-Aminophenyl)-2,4-dioxobutanoate|4-(2-aminophenyl)-2,4-dioxobutanoic acid 4-(2-Aminophenyl)-2,4-dioxobutanoate|4-(2-aminophenyl)-2,4-dioxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_17442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17443 biolink:ChemicalEntity L-homocitrulline A L-lysine derivative that is L-lysine having a carbamoyl group at the N6-position. It is found in individuals with urea cycle disorders. cas:1190-49-4|hmdb:HMDB0000679|kegg.compound:C02427|metacyc.compound:CPD-161|pubmed:2432665|pubmed:2474087|pubmed:518684|pubmed:6821687|pubmed:901434|pubmed:901435|reaxys:1726129 Graph (2S)-2-amino-6-(carbamoylamino)hexanoic acid|L-Homocitrulline|N(6)-(aminocarbonyl)-L-lysine|N(6)-carbamoyl-L-lysine (2S)-2-amino-6-(carbamoylamino)hexanoic acid|N(6)-carbamoyl-L-lysine (2S)-2-amino-6-(carbamoylamino)hexanoic acid|L-Homocitrulline|N(6)-(aminocarbonyl)-L-lysine|N(6)-carbamoyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_17443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17445 biolink:ChemicalEntity 3-hydroxyphenylacetic acid A monocarboxylic acid that is phenylacetic acid in which the hydrogen at position 3 on the benzene ring is replaced by a hydroxy group. cas:621-37-4|hmdb:HMDB0000440|kegg.compound:C05593|metacyc.compound:3-HYDROXYPHENYLACETATE|patent:US5639643|pdb-ccd:3HP|pubmed:19083460|pubmed:20579527|pubmed:22919580|pubmed:23319439|pubmed:24287915|pubmed:5350345|pubmed:7264927|reaxys:2086506 Graph (3-hydroxyphenyl)acetic acid|(m-hydroxyphenyl)acetic acid|3-Hydroxyphenylacetic acid|3-hydroxybenzeneacetic acid|m-hydroxyphenylacetic acid (3-hydroxyphenyl)acetic acid (3-hydroxyphenyl)acetic acid|(m-hydroxyphenyl)acetic acid|3-Hydroxyphenylacetic acid|3-hydroxybenzeneacetic acid|m-hydroxyphenylacetic acid http://purl.obolibrary.org/obo/CHEBI_17445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17446 biolink:ChemicalEntity 3-D-glucuronosyl-N(2),6-disulfo-beta-D-glucosamine kegg.compound:C04674|kegg.glycan:G10530 Graph 2-deoxy-3-O-(D-glucopyranosyluronic acid)-6-O-sulfo-2-(sulfoamino)-beta-D-glucopyranose|3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine 2-deoxy-3-O-(D-glucopyranosyluronic acid)-6-O-sulfo-2-(sulfoamino)-beta-D-glucopyranose 2-deoxy-3-O-(D-glucopyranosyluronic acid)-6-O-sulfo-2-(sulfoamino)-beta-D-glucopyranose|3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_17446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17447 biolink:ChemicalEntity geraniol A monoterpenoid consisting of two prenyl units linked head-to-tail and functionalised with a hydroxy group at its tail end. beilstein:1722456|bpdb:2374|cas:106-24-1|gmelin:185248|kegg.compound:C01500|knapsack:C00000845|lipidmaps:LMPR0102010016|pubmed:18824010|pubmed:20573166|pubmed:23102596|pubmed:23108028|pubmed:23168261|pubmed:23200656|pubmed:23399806|pubmed:23415329|pubmed:23499697|pubmed:23510343|vsdb:2374|wikipedia.en:Geraniol Graph (2E)-3,7-dimethyl-2,6-octadien-1-ol|(2E)-3,7-dimethylocta-2,6-dien-1-ol|(2E)-geraniol|(E)-3,7-dimethyl-2,6-octadien-1-ol|(E)-geraniol|(E)-nerol|2-trans-3,7-Dimethyl-2,6-octadien-1-ol|3,7-dimethyl-trans-2,6-octadien-1-ol|Geraniol|geranyl alcohol|lemonol|t-geraniol|trans-3,7-dimethyl-2,6-octadien-1-ol|trans-geraniol (2E)-3,7-dimethylocta-2,6-dien-1-ol (2E)-3,7-dimethyl-2,6-octadien-1-ol|(2E)-3,7-dimethylocta-2,6-dien-1-ol|(2E)-geraniol|(E)-3,7-dimethyl-2,6-octadien-1-ol|(E)-geraniol|(E)-nerol|2-trans-3,7-Dimethyl-2,6-octadien-1-ol|3,7-dimethyl-trans-2,6-octadien-1-ol|Geraniol|geranyl alcohol|lemonol|t-geraniol|trans-3,7-dimethyl-2,6-octadien-1-ol|trans-geraniol http://purl.obolibrary.org/obo/CHEBI_17447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17448 biolink:ChemicalEntity methanofuran cas:89873-36-9|kegg.compound:C00862 Graph 4-[N-(4,5,7-tricarboxyheptanoyl)-gamma-L-glutamyl-gamma-L-glutamyl-4-(2-aminoethyl)phenoxymethyl]-2-(aminomethyl)furan|Carbon dioxide reduction factor|Cdr factor|L-Glutamine, N-(2-(4-((5-(aminomethyl)-3-furanyl)methoxy)phenyl)ethyl)-N2-(N-(4,5,7-tricarboxy-1-oxoheptyl)-L-gamma-glutamyl)-|Methanofuran|N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(aminomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(aminomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine 4-[N-(4,5,7-tricarboxyheptanoyl)-gamma-L-glutamyl-gamma-L-glutamyl-4-(2-aminoethyl)phenoxymethyl]-2-(aminomethyl)furan|Carbon dioxide reduction factor|Cdr factor|L-Glutamine, N-(2-(4-((5-(aminomethyl)-3-furanyl)methoxy)phenyl)ethyl)-N2-(N-(4,5,7-tricarboxy-1-oxoheptyl)-L-gamma-glutamyl)-|Methanofuran|N(2)-[rel-(4R,5S)-4,5,7-tricarboxyheptanoyl]-L-gamma-glutamyl-N(5)-[2-(4-{[5-(aminomethyl)-3-furyl]methoxy}phenyl)ethyl]-L-glutamine http://purl.obolibrary.org/obo/CHEBI_17448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17450 biolink:ChemicalEntity cis-4-coumaric acid The cis-form of 4-coumaric acid. cas:4501-31-9|kegg.compound:C06738|knapsack:C00038791|reaxys:2207382 Graph (2Z)-3-(4-hydroxyphenyl)acrylic acid|(2Z)-3-(4-hydroxyphenyl)prop-2-enoic acid|(Z)-3-(4-hydroxyphenyl)-2-propenoic acid|(Z)-p-coumaric acid|(Z)-p-hydroxycinnamic acid|cis-4-hydroxycinnamic acid|cis-p-Coumarate|cis-p-coumaric acid|cis-p-coumarinic acid|cis-p-hydroxycinnamic acid (2Z)-3-(4-hydroxyphenyl)prop-2-enoic acid (2Z)-3-(4-hydroxyphenyl)acrylic acid|(2Z)-3-(4-hydroxyphenyl)prop-2-enoic acid|(Z)-3-(4-hydroxyphenyl)-2-propenoic acid|(Z)-p-coumaric acid|(Z)-p-hydroxycinnamic acid|cis-4-hydroxycinnamic acid|cis-p-Coumarate|cis-p-coumaric acid|cis-p-coumarinic acid|cis-p-hydroxycinnamic acid http://purl.obolibrary.org/obo/CHEBI_17450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17453 biolink:ChemicalEntity methylmalonate(2-) A C4-dicarboxylate resulting from the removal of a proton from both carboxylic acid groups of methylmalonic acid. gmelin:142212|kegg.compound:C02170|metacyc.compound:CPD-546|reaxys:3904597 Graph methylmalonate|methylmalonate dianion|methylpropanedioate methylpropanedioate methylmalonate|methylmalonate dianion|methylpropanedioate http://purl.obolibrary.org/obo/CHEBI_17453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17454 biolink:ChemicalEntity UDP-L-rhamnose A UDP-rhamnose in which the rhamnose component has L-configuration. Graph uridine 5'-[3-(6-deoxy-L-mannopyranosyl) dihydrogen diphosphate]|uridine 5'-[3-(L-rhamnopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(6-deoxy-L-mannopyranosyl) dihydrogen diphosphate]|uridine 5'-[3-(L-rhamnopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(6-deoxy-L-mannopyranosyl) dihydrogen diphosphate]|uridine 5'-[3-(L-rhamnopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17454 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174541 biolink:ChemicalEntity Licochalcone A cas:58749-22-7|chemspider:4477422|lincs.smallmolecule:LSM-44661|lipidmaps:LMPK12120424 Graph (E)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one (E)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one (E)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_174541 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17455 biolink:ChemicalEntity N-(2,3-dihydroxybenzoyl)-L-serine kegg.compound:C04204|pdb-ccd:DBS Graph 2,3-Dihydroxy-N-benzoyl-L-serine|N-(2,3-Dihydroxybenzoyl)-L-serine|N-(2,3-dihydroxybenzoyl)-L-serine N-(2,3-Dihydroxybenzoyl)-L-serine|N-(2,3-dihydroxybenzoyl)-L-serine 2,3-Dihydroxy-N-benzoyl-L-serine|N-(2,3-Dihydroxybenzoyl)-L-serine|N-(2,3-dihydroxybenzoyl)-L-serine http://purl.obolibrary.org/obo/CHEBI_17455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17456 biolink:ChemicalEntity dithioerythritol The meso-diastereomer of 1,4-dimercaptobutane-2,3-diol; a sulfur-containing sugar derived from the monosaccharide erythrose; and an epimer of dithiothreitol. cas:6892-68-8|drugbank:DB01692|gmelin:863505|kegg.compound:C00950|pdb-ccd:DTU|pubmed:14192894|pubmed:16901854|pubmed:22684514|pubmed:22845804|pubmed:23402788|reaxys:1719756|wikipedia.en:Dithioerythritol Graph (2R*,3S*)-1,4-dimercapto-2,3-butanediol|(2R,3S)-1,4-dimercaptobutane-2,3-diol|(2R,3S)-1,4-disulfanylbutane-2,3-diol|1,4-dithioerythritol|DTE|Dithioerythritol|dithioerythritol|erythro-1,4-Dimercapto-2,3-butanediol (2R,3S)-1,4-disulfanylbutane-2,3-diol (2R*,3S*)-1,4-dimercapto-2,3-butanediol|(2R,3S)-1,4-dimercaptobutane-2,3-diol|(2R,3S)-1,4-disulfanylbutane-2,3-diol|1,4-dithioerythritol|DTE|Dithioerythritol|dithioerythritol|erythro-1,4-Dimercapto-2,3-butanediol http://purl.obolibrary.org/obo/CHEBI_17456 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17457 biolink:ChemicalEntity 14'-apo-beta-carotenal beilstein:2056663|cas:6985-27-9|kegg.compound:C06734 Graph 14'-apo-beta,psi-carotenal|14'-apo-beta-Carotenal|14'-apo-beta-caroten-14'-al|14'-apo-beta-carotenal|beta-apo-14'-carotenal 14'-apo-beta-caroten-14'-al 14'-apo-beta,psi-carotenal|14'-apo-beta-Carotenal|14'-apo-beta-caroten-14'-al|14'-apo-beta-carotenal|beta-apo-14'-carotenal http://purl.obolibrary.org/obo/CHEBI_17457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17458 biolink:ChemicalEntity N-methyltyramine cas:370-98-9|kegg.compound:C02442|knapsack:C00027432|lincs.smallmolecule:LSM-37200 Graph 4-Hydroxy-N-methylphenethylamine|4-[2-(methylamino)ethyl]phenol|Methyl-4-tyramine|N-Methyltyramine|p-(2-Methylaminoethyl)phenol 4-[2-(methylamino)ethyl]phenol 4-Hydroxy-N-methylphenethylamine|4-[2-(methylamino)ethyl]phenol|Methyl-4-tyramine|N-Methyltyramine|p-(2-Methylaminoethyl)phenol http://purl.obolibrary.org/obo/CHEBI_17458 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17459 biolink:ChemicalEntity D-iditol The D-enantiomer of iditol. cas:25878-23-3|kegg.compound:C01489|metacyc.compound:CPD-357|pubmed:16232515|pubmed:18175917|reaxys:1721905 Graph (2R,3S,4S,5R)-hexane-1,2,3,4,5,6-hexol|D-Idit|D-Iditol|D-iditol D-Iditol|D-iditol (2R,3S,4S,5R)-hexane-1,2,3,4,5,6-hexol|D-Idit|D-Iditol|D-iditol http://purl.obolibrary.org/obo/CHEBI_17459 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17460 biolink:ChemicalEntity lipoamide A monocarboxylic acid amide resulting from the formal condensation of the carboxy group of lipoic acid with ammonia. cas:940-69-2|gmelin:1126642|hmdb:HMDB0000962|kegg.compound:C00248|kegg.drug:D00048|lipidmaps:LMFA08010006|metacyc.compound:LIPOAMIDE|pubmed:10224250|pubmed:21108628|pubmed:21521794|reaxys:122470|wikipedia.en:Lipoamide Graph 1,2-dithiolane-3-pentanamide|5-(1,2-dithiolan-3-yl)pentanamide|Lipoamide|Thioctamide|Thioctic acid amide|alpha-lipoic acid amide|lipoacin|vitamin N 5-(1,2-dithiolan-3-yl)pentanamide 1,2-dithiolane-3-pentanamide|5-(1,2-dithiolan-3-yl)pentanamide|Lipoamide|Thioctamide|Thioctic acid amide|alpha-lipoic acid amide|lipoacin|vitamin N http://purl.obolibrary.org/obo/CHEBI_17460 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174623 biolink:ChemicalEntity Gamma-glutamyl-Lysine chemspider:58747|hmdb:HMDB0029154 Graph (2S)-6-amino-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]hexanoic acid (2S)-6-amino-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]hexanoic acid (2S)-6-amino-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]hexanoic acid http://purl.obolibrary.org/obo/CHEBI_174623 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17464 biolink:ChemicalEntity L-galactono-1,4-lactone A galactonolactone that is 3,4-dihydroxydihydrofuran-2(3H)-one substituted by a 1,2-dihydroxyethyl group at position 5 (the 3S,4S,5R-isomer). cas:1668-08-2|kegg.compound:C01115|knapsack:C00007388|metacyc.compound:CPD-330|pubmed:11005203|reaxys:83005 Graph (3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-one|L-Galactono-1,4-lactone|L-galactono-1,4-lactone (3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-one (3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-one|L-Galactono-1,4-lactone|L-galactono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_17464 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17465 biolink:ChemicalEntity phaseollidin hydrate A member of the class of pterocarpans that is phaseollidin in which the prenyl group is replaced by a 3-hydroxy-3-methylbutyl group. kegg.compound:C05229 Graph (6aR,11aR)-10-(3-hydroxy-3-methylbutyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol|Phaseollidin hydrate|phaseollidin hydrate (6aR,11aR)-10-(3-hydroxy-3-methylbutyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol (6aR,11aR)-10-(3-hydroxy-3-methylbutyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol|Phaseollidin hydrate|phaseollidin hydrate http://purl.obolibrary.org/obo/CHEBI_17465 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17466 biolink:ChemicalEntity GDP-D-mannuronate A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of GDP-D-mannuronic acid; major species at pH 7.3. metacyc.compound:CPD-1828 Graph guanosine 5'-[3-(D-mannopyranosyluronate) diphosphate] guanosine 5'-[3-(D-mannopyranosyluronate) diphosphate] guanosine 5'-[3-(D-mannopyranosyluronate) diphosphate] http://purl.obolibrary.org/obo/CHEBI_17466 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17467 biolink:ChemicalEntity 4-(dimethylamino)phenylazoxybenzene kegg.compound:C04291 Graph 1-[4-(dimethylamino)phenyl]-2-phenyldiazene 2-oxide|4-(Dimethylamino)phenylazoxybenzene|4-(dimethylamino)phenylazoxybenzene|N,N-dimethyl-4-(phenyl-ONN-azoxy)aniline 1-[4-(dimethylamino)phenyl]-2-phenyldiazene 2-oxide 1-[4-(dimethylamino)phenyl]-2-phenyldiazene 2-oxide|4-(Dimethylamino)phenylazoxybenzene|4-(dimethylamino)phenylazoxybenzene|N,N-dimethyl-4-(phenyl-ONN-azoxy)aniline http://purl.obolibrary.org/obo/CHEBI_17467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17468 biolink:ChemicalEntity (4-bromophenylsulfanyl)pyruvate A 2-oxo monocarboxylic acid anion that is the conjugate base of (4-bromophenylsulfanyl)pyruvic acid, arising from deprotonation of the carboxy group. kegg.compound:C04264 Graph 3-((4-bromophenyl)sulfanyl)-2-oxopropanoate|3-[(4-bromophenyl)sulfanyl]-2-oxopropanoate|S-(4-Bromophenyl)-mercaptopyruvate|S-(4-bromophenyl)sulfanylpyruvate 3-[(4-bromophenyl)sulfanyl]-2-oxopropanoate 3-((4-bromophenyl)sulfanyl)-2-oxopropanoate|3-[(4-bromophenyl)sulfanyl]-2-oxopropanoate|S-(4-Bromophenyl)-mercaptopyruvate|S-(4-bromophenyl)sulfanylpyruvate http://purl.obolibrary.org/obo/CHEBI_17468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174690 biolink:ChemicalEntity clenbuterol A substituted aniline that is 2,6-dichloroaniline in which the hydrogen at position 4 has been replaced by a 2-(tert-butylamino)-1-hydroxyethyl group. cas:37148-27-9|drugbank:DB01407|drugcentral:673|kegg.drug:D07713|lincs.smallmolecule:LSM-5144|patent:US3536712|pubmed:22071161|pubmed:22241580|pubmed:22341861|pubmed:22447758|pubmed:22505058|reaxys:1076467|vsdb:1884 Graph (+-)-clenbuterol|1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butylamino-ethanol|1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol|4-amino-3,5-dichloro-alpha-(((1,1-dimethylethyl)amino)methyl)benzenemethanol|4-amino-alpha-((tert-butylamino)methyl)-3,5-dichlorobenzyl alcohol|CLENBUTEROL|clenbuterol|clenbuterolum 1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol (+-)-clenbuterol|1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butylamino-ethanol|1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol|4-amino-3,5-dichloro-alpha-(((1,1-dimethylethyl)amino)methyl)benzenemethanol|4-amino-alpha-((tert-butylamino)methyl)-3,5-dichlorobenzyl alcohol|CLENBUTEROL|clenbuterol|clenbuterolum http://purl.obolibrary.org/obo/CHEBI_174690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17470 biolink:ChemicalEntity 2-O-caffeoylglucaric acid kegg.compound:C03062 Graph 2-O-Caffeoylglucarate|2-O-[3-(3,4-dihydroxyphenyl)prop-2-enoyl]-D-glucaric acid|2-O-caffeoylglucarate 2-O-[3-(3,4-dihydroxyphenyl)prop-2-enoyl]-D-glucaric acid 2-O-Caffeoylglucarate|2-O-[3-(3,4-dihydroxyphenyl)prop-2-enoyl]-D-glucaric acid|2-O-caffeoylglucarate http://purl.obolibrary.org/obo/CHEBI_17470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17473 biolink:ChemicalEntity 1-alkyl-2-acetyl-3-acyl-sn-glycerol A 1-alkyl-2,3-diacylglycerol in which the acyl group at position 2 is specified as acetyl. kegg.compound:C04361 Graph 1-alkyl-2-acetyl-3-acyl-sn-glycerols|a 1-O-alkyl-2-acetyl-3-acyl-sn-glycerol 1-alkyl-2-acetyl-3-acyl-sn-glycerols|a 1-O-alkyl-2-acetyl-3-acyl-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_17473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:174733 biolink:ChemicalEntity Licochalcone B cas:58749-23-8|chemspider:4477423|hmdb:HMDB0037320|lipidmaps:LMPK12120434 Graph (E)-3-(3,4-dihydroxy-2-methoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one (E)-3-(3,4-dihydroxy-2-methoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one (E)-3-(3,4-dihydroxy-2-methoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_174733 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17474 biolink:ChemicalEntity estrone 3-sulfate A steroid sulfate that is the 3-sulfate of estrone. cas:481-97-0|drugcentral:4857|hmdb:HMDB0001425|kegg.compound:C02538|lincs.smallmolecule:LSM-3126|pubmed:15356081|pubmed:23717534|reaxys:2399598 Graph 17-oxoestra-1,3,5(10)-trien-3-yl hydrogen sulfate|3-hydroxyestra-1,3,5(10)-trien-17-one hydrogen sulphate|Estrone 3-sulfate|estrone hydrogen sulfate|estrone sulfate|estrone sulphate 17-oxoestra-1,3,5(10)-trien-3-yl hydrogen sulfate 17-oxoestra-1,3,5(10)-trien-3-yl hydrogen sulfate|3-hydroxyestra-1,3,5(10)-trien-17-one hydrogen sulphate|Estrone 3-sulfate|estrone hydrogen sulfate|estrone sulfate|estrone sulphate http://purl.obolibrary.org/obo/CHEBI_17474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17475 biolink:ChemicalEntity aminomalonic acid An amino dicarboxylic acid that is malonic acid in which one of the methylene hydrogens has been replaced by an amino group. cas:1068-84-4|drugbank:DB02289|ecmdb:ECMDB21430|hmdb:HMDB0001147|kegg.compound:C00872|metacyc.compound:AMINOMALONATE|pdb-ccd:FGL|pubmed:1621954|pubmed:20117838|reaxys:1704564 Graph 2-Aminomalonic acid|Aminomalonate|Aminomalonic acid|aminopropanedioic acid aminopropanedioic acid 2-Aminomalonic acid|Aminomalonate|Aminomalonic acid|aminopropanedioic acid http://purl.obolibrary.org/obo/CHEBI_17475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17476 biolink:ChemicalEntity 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine A glycerophosphoethanolamine compound having an alk-1-enyl substituent at the 1-position and an acyl substituent at the 2-position. kegg.compound:C04756 Graph 1-Alkenyl-2-acylglycerophosphoethanolamine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphoethanolamine|1-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine|1-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamines|2-Acyl-1-(1-alkenyl)-sn-glycero-3-phosphoethanolamine|Ethanolamineplasmalogen|O-1-Alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine|Phosphatidalethanolamine|Plasmenylethanolamine 1-Alkenyl-2-acylglycerophosphoethanolamine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphoethanolamine|1-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine|1-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamines|2-Acyl-1-(1-alkenyl)-sn-glycero-3-phosphoethanolamine|Ethanolamineplasmalogen|O-1-Alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine|Phosphatidalethanolamine|Plasmenylethanolamine http://purl.obolibrary.org/obo/CHEBI_17476 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17477 biolink:ChemicalEntity uracil-5-carboxylic acid A pyrimidinemonocarboxylic acid that is uracil carrying a carboxy group at position 5. cas:23945-44-0|kegg.compound:C03030|pubmed:27146565|pubmed:33337857|pubmed:33439519|pubmed:4260374|pubmed:5440840|pubmed:5482775|pubmed:5574400 Graph 1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarboxylic acid|2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid|5-carboxyuracil|5-uracilcarboxylic acid|isoorotic acid|uracil-5-carboxylic acid 2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid 1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarboxylic acid|2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid|5-carboxyuracil|5-uracilcarboxylic acid|isoorotic acid|uracil-5-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_17477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17478 biolink:ChemicalEntity aldehyde A compound RC(=O)H, in which a carbonyl group is bonded to one hydrogen atom and to one R group. kegg.compound:C00071 Graph Aldehyd|Aldehyde|RC(=O)H|RCHO|aldehido|aldehidos|aldehyde|aldehydes|aldehydum|an aldehyde Aldehyde|aldehyde|aldehydes Aldehyd|Aldehyde|RC(=O)H|RCHO|aldehido|aldehidos|aldehyde|aldehydes|aldehydum|an aldehyde http://purl.obolibrary.org/obo/CHEBI_17478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17479 biolink:ChemicalEntity enol-oxaloacetate A C4-dicarboxylate resulting from the removal of a proton from both carboxylic acid groups of enol-oxaloacetic acid. metacyc.compound:ENOL-OXALOACETATE|pubmed:1864383|pubmed:38287013|reaxys:3942454 Graph (2Z)-2-hydroxybut-2-enedioate|2-Hydroxyethylenedicarboxylate|enol-oxaloacetate|hydroxyfumarate (2Z)-2-hydroxybut-2-enedioate (2Z)-2-hydroxybut-2-enedioate|2-Hydroxyethylenedicarboxylate|enol-oxaloacetate|hydroxyfumarate http://purl.obolibrary.org/obo/CHEBI_17479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17482 biolink:ChemicalEntity L-cystathionine A modified amino acid generated by enzymic means from L-homocysteine and L-serine. cas:56-88-2|hmdb:HMDB0000099|kegg.compound:C02291|knapsack:C00007498|metacyc.compound:CYSTATHIONINE|pubmed:1025897|reaxys:2331423|wikipedia.en:Cystathionine Graph (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanoic acid|(R)-S-(2-amino-2-carboxyethyl)-L-Homocysteine|L-(+)-Cystathionine|L-Cystathionine|L-cystathionine|S-(beta-amino-beta-carboxyethyl)homocysteine (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanoic acid|L-Cystathionine|L-cystathionine (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanoic acid|(R)-S-(2-amino-2-carboxyethyl)-L-Homocysteine|L-(+)-Cystathionine|L-Cystathionine|L-cystathionine|S-(beta-amino-beta-carboxyethyl)homocysteine http://purl.obolibrary.org/obo/CHEBI_17482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17485 biolink:ChemicalEntity homocystine An organic disulfide obtained by oxidative dimerisation of homocysteine. cas:462-10-2|hmdb:HMDB0000575|kegg.compound:C01817|pubmed:11592966|pubmed:11896744|reaxys:1728581 Graph 4,4'-Dithiobis(2-aminobutyric acid)|4,4'-disulfanediylbis(2-aminobutanoic acid)|4,4'-dithiobis(2-aminobutyric acid)|Homocystine 4,4'-disulfanediylbis(2-aminobutanoic acid) 4,4'-Dithiobis(2-aminobutyric acid)|4,4'-disulfanediylbis(2-aminobutanoic acid)|4,4'-dithiobis(2-aminobutyric acid)|Homocystine http://purl.obolibrary.org/obo/CHEBI_17485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17486 biolink:ChemicalEntity (S)-atropine An atropine with a 2S-configuration. cas:101-31-5|drugbank:DB00424|drugcentral:1402|kegg.compound:C02046|kegg.drug:D00147|knapsack:C00002293|pdb-ccd:OIN|reaxys:91259 Graph (-)-atropine|(-)-hyoscyamine|(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate|(S)-(-)-hyoscyamine|Daturine|Duboisine|L-Hyoscyamine|L-Tropine tropate|[3(S)-endo]-alpha-(hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester|hyoscyamine|l-hyoscyamine|tropan-3alpha-yl (2S)-3-hydroxy-2-phenylpropanoate|tropine, (-)-tropate (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate|tropan-3alpha-yl (2S)-3-hydroxy-2-phenylpropanoate (-)-atropine|(-)-hyoscyamine|(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate|(S)-(-)-hyoscyamine|Daturine|Duboisine|L-Hyoscyamine|L-Tropine tropate|[3(S)-endo]-alpha-(hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester|hyoscyamine|l-hyoscyamine|tropan-3alpha-yl (2S)-3-hydroxy-2-phenylpropanoate|tropine, (-)-tropate http://purl.obolibrary.org/obo/CHEBI_17486 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17488 biolink:ChemicalEntity scopoletin A hydroxycoumarin that is umbelliferone bearing a methoxy substituent at position 6. cas:92-61-5|kegg.compound:C01752|knapsack:C00002499|lincs.smallmolecule:LSM-6694|pubmed:20686865|pubmed:21078410|pubmed:21163341|pubmed:21383663|pubmed:21417386|pubmed:21544717|pubmed:21598418|pubmed:21604276|pubmed:21605187|pubmed:21657075|pubmed:21751840|reaxys:156296 Graph 6-Methoxy-7-hydroxycoumarin|6-Methylesculetin|6-O-Methylesculetin|7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one|7-hydroxy-6-methoxy-2H-chromen-2-one|7-hydroxy-6-methoxycoumarin|Scopoletin|scopoletin 7-hydroxy-6-methoxy-2H-chromen-2-one 6-Methoxy-7-hydroxycoumarin|6-Methylesculetin|6-O-Methylesculetin|7-Hydroxy-6-methoxy-2H-1-benzopyran-2-one|7-hydroxy-6-methoxy-2H-chromen-2-one|7-hydroxy-6-methoxycoumarin|Scopoletin|scopoletin http://purl.obolibrary.org/obo/CHEBI_17488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17489 biolink:ChemicalEntity 3',5'-cyclic AMP A 3',5'-cyclic purine nucleotide having having adenine as the nucleobase. cas:60-92-4|drugbank:DB02527|hmdb:HMDB0000058|kegg.compound:C00575|knapsack:C00001497|metacyc.compound:CAMP|pdb-ccd:CMP|pubmed:16295522|pubmed:18372334|pubmed:22770225|reaxys:52645|wikipedia.en:Cyclic_AMP Graph 3',5'-Cyclic AMP|ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE|Adenosine 3',5'-cyclic phosphate|Adenosine 3',5'-phosphate|Cyclic AMP|Cyclic adenylic acid|adenosine 3',5'-(hydrogen phosphate)|adenosine 3',5'-cyclic monophosphate|cAMP Adenosine 3',5'-phosphate|adenosine 3',5'-(hydrogen phosphate) 3',5'-Cyclic AMP|ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE|Adenosine 3',5'-cyclic phosphate|Adenosine 3',5'-phosphate|Cyclic AMP|Cyclic adenylic acid|adenosine 3',5'-(hydrogen phosphate)|adenosine 3',5'-cyclic monophosphate|cAMP http://purl.obolibrary.org/obo/CHEBI_17489 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17490 biolink:ChemicalEntity O-palmitoyl-L-carnitine An O-acyl-L-carnitine in which the acyl group is specified as palmitoyl (hexadecanoyl). cas:2364-67-2|hmdb:HMDB0000222|kegg.compound:C02990|lipidmaps:LMFA07070004|metacyc.compound:CPD-419|pubmed:11211104|pubmed:1328655|pubmed:2331016|pubmed:24057015|pubmed:24321516|pubmed:2829871|pubmed:9048248|reaxys:4152034 Graph (3R)-3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate|(3R)-3-hexadecanoyloxy-4-(trimethylammonio)butanoate|(3R)-3-palmitoyloxy-4-(trimethylammonio)butanoate|Hexadecanoyl-L-carnitine|Hexadecenoyl carnitine|L-Carnitine palmitoyl ester|L-Palmitoylcarnitine|O-hexadecanoyl-(R)-carnitine|O-hexadecanoyl-R-carnitine|Palmitoyl-L-carnitine|Palmitoylcarnitine|hexadecanoylcarnitine (3R)-3-hexadecanoyloxy-4-(trimethylammonio)butanoate (3R)-3-(hexadecanoyloxy)-4-(trimethylazaniumyl)butanoate|(3R)-3-hexadecanoyloxy-4-(trimethylammonio)butanoate|(3R)-3-palmitoyloxy-4-(trimethylammonio)butanoate|Hexadecanoyl-L-carnitine|Hexadecenoyl carnitine|L-Carnitine palmitoyl ester|L-Palmitoylcarnitine|O-hexadecanoyl-(R)-carnitine|O-hexadecanoyl-R-carnitine|Palmitoyl-L-carnitine|Palmitoylcarnitine|hexadecanoylcarnitine http://purl.obolibrary.org/obo/CHEBI_17490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17491 biolink:ChemicalEntity S-(2-hydroxyacyl)glutathione Glutathione substituted on sulfor by a 2-hydroxyacyl group. kegg.compound:C03899|pubmed:4200890|pubmed:4745654 Graph S-(2-Hydroxyacyl)glutathione|S-(2-hydroxyacyl)glutathiones S-(2-Hydroxyacyl)glutathione|S-(2-hydroxyacyl)glutathiones http://purl.obolibrary.org/obo/CHEBI_17491 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17494 biolink:ChemicalEntity CDP-4-dehydro-6-deoxy-D-glucose Graph cytidine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] cytidine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] cytidine 5'-[3-(6-deoxy-D-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17495 biolink:ChemicalEntity cholesteryl beta-D-glucoside cas:26671-80-7|kegg.compound:C03855 Graph (3beta)-cholest-5-en-3-yl D-glucopyranoside|Cholesterol glucoside|Cholesteryl glucoside|Cholesteryl-beta-D-glucoside|cholest-5-en-3beta-yl beta-D-glucopyranoside|cholesteryl 3-beta-D-glucoside cholest-5-en-3beta-yl beta-D-glucopyranoside (3beta)-cholest-5-en-3-yl D-glucopyranoside|Cholesterol glucoside|Cholesteryl glucoside|Cholesteryl-beta-D-glucoside|cholest-5-en-3beta-yl beta-D-glucopyranoside|cholesteryl 3-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_17495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17497 biolink:ChemicalEntity glycolic acid A 2-hydroxy monocarboxylic acid that is acetic acid where the methyl group has been hydroxylated. cas:79-14-1|drugcentral:4645|hmdb:HMDB0000115|kegg.compound:C00160|knapsack:C00007461|lipidmaps:LMFA01050148|metacyc.compound:GLYCOLLATE|pdb-ccd:GOA|pubmed:14585457|pubmed:15662707|pubmed:15716481|pubmed:15716482|pubmed:18498500|pubmed:19025792|pubmed:21950544|pubmed:22044748|pubmed:22128110|pubmed:22360337|pubmed:22421647|reaxys:1209322|wikipedia.en:Glycolic_acid Graph 2-Hydroxyacetic acid|2-Hydroxyethanoic acid|GLYCOLIC ACID|Glycolic acid|Glycollic acid|HOCH2COOH|Hydroxyacetic acid|Hydroxyethanoic acid|alpha-Hydroxyacetic acid|alpha-hydroxyacetic acid|hydroxyacetic acid Hydroxyacetic acid|hydroxyacetic acid 2-Hydroxyacetic acid|2-Hydroxyethanoic acid|GLYCOLIC ACID|Glycolic acid|Glycollic acid|HOCH2COOH|Hydroxyacetic acid|Hydroxyethanoic acid|alpha-Hydroxyacetic acid|alpha-hydroxyacetic acid|hydroxyacetic acid http://purl.obolibrary.org/obo/CHEBI_17497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17499 biolink:ChemicalEntity hydrogen donor A molecular entity that can undergo oxidation by the loss of hydrogen atom(s). kegg.compound:C00030 Graph AH(2)|AH2|Donor|Hydrogen-donor|Reduced acceptor AH(2)|AH2|Donor|Hydrogen-donor|Reduced acceptor http://purl.obolibrary.org/obo/CHEBI_17499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17500 biolink:ChemicalEntity 7alpha-hydroxycholesterol The 7α-hydroxy derivative of cholesterol. cas:566-26-7|chemspider:96891|foodb.food:FDB022655|hmdb:HMDB0001496|kegg.compound:C03594|lipidmaps:LMST01010013|metacyc.compound:CPD-266|pdb-ccd:5JK|pubmed:10529092|pubmed:14571793|pubmed:15576852|pubmed:16376175|pubmed:16455124|pubmed:16634125|pubmed:17364953|pubmed:17386651|pubmed:24370436|pubmed:27075612|pubmed:27268273|pubmed:31781930|pubmed:7557870|pubmed:8558093|pubmed:9632680|pubmed:9882415|wikipedia.en:7%CE%B1-Hydroxycholesterol Graph (3beta,7alpha)-cholest-5-ene-3,7-diol|5-cholesten-3beta,7alpha-diol|7-alpha-hydroxycholesterol|7alpha-Hydroxycholesterol|7alpha-hydroxy-cholesterol|Cholest-5-ene-3beta,7alpha-diol|cholest-5-en-3beta,7alpha-diol|cholest-5-ene-3beta,7alpha-diol Cholest-5-ene-3beta,7alpha-diol|cholest-5-ene-3beta,7alpha-diol (3beta,7alpha)-cholest-5-ene-3,7-diol|5-cholesten-3beta,7alpha-diol|7-alpha-hydroxycholesterol|7alpha-Hydroxycholesterol|7alpha-hydroxy-cholesterol|Cholest-5-ene-3beta,7alpha-diol|cholest-5-en-3beta,7alpha-diol|cholest-5-ene-3beta,7alpha-diol http://purl.obolibrary.org/obo/CHEBI_17500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17501 biolink:ChemicalEntity 3,3'-dimethoxystilbene-4,4'-diol beilstein:2057036|kegg.compound:C04547 Graph 1,2-Bis(4-hydroxy-3-methoxyphenyl)ethylene|1,2-bis(4-hydroxy-3-methoxyphenyl)ethylene|2,2'-dimethoxy-4,4'-(ethene-1,2-diyl)diphenol|4,4'-ethene-1,2-diylbis(2-methoxyphenol) 2,2'-dimethoxy-4,4'-(ethene-1,2-diyl)diphenol 1,2-Bis(4-hydroxy-3-methoxyphenyl)ethylene|1,2-bis(4-hydroxy-3-methoxyphenyl)ethylene|2,2'-dimethoxy-4,4'-(ethene-1,2-diyl)diphenol|4,4'-ethene-1,2-diylbis(2-methoxyphenol) http://purl.obolibrary.org/obo/CHEBI_17501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17502 biolink:ChemicalEntity 2-methylpropanal oxime An aldoxime derived from 2-methylpropanal. beilstein:1209325|cas:151-00-8|gmelin:217530|kegg.compound:C03219 Graph 1-(hydroxyimino)-2-methylpropane|2-Methylpropanal oxime|2-methyl-1-propanal oxime|2-methylpropanal oxime|Isobutyraldehyde oxime|N-hydroxy-2-methylpropanimine|isobutanal oxime|isobutylaldoxime N-hydroxy-2-methylpropanimine 1-(hydroxyimino)-2-methylpropane|2-Methylpropanal oxime|2-methyl-1-propanal oxime|2-methylpropanal oxime|Isobutyraldehyde oxime|N-hydroxy-2-methylpropanimine|isobutanal oxime|isobutylaldoxime http://purl.obolibrary.org/obo/CHEBI_17502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17503 biolink:ChemicalEntity N-acyl-D-glutamates(2-) A doubly-charged N-acyl-D-α-amino acid anion resulting from removal of protons from both carboxy groups of any N-acyl-D-glutamic acid. kegg.compound:C06379 Graph N-Acyl-D-glutamate|N-acyl-D-glutamate(2-)|an N-acyl-D-glutamate N-Acyl-D-glutamate|N-acyl-D-glutamate(2-)|an N-acyl-D-glutamate http://purl.obolibrary.org/obo/CHEBI_17503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17504 biolink:ChemicalEntity 1-O-acyl-sn-glycero-3-phosphocholine(1+) kegg.compound:C04230 Graph 1-Acyl-sn-glycero-3-phosphocholine|1-Acyl-sn-glycerol-3-phosphocholine|1-Acylglycerophosphocholine|1-acyl-sn-glycero-3-phosphocholines|2-Lysolecithin|2-Lysophosphatidylcholine|alpha-Acylglycerophosphocholine 1-Acyl-sn-glycero-3-phosphocholine|1-Acyl-sn-glycerol-3-phosphocholine|1-Acylglycerophosphocholine|1-acyl-sn-glycero-3-phosphocholines|2-Lysolecithin|2-Lysophosphatidylcholine|alpha-Acylglycerophosphocholine http://purl.obolibrary.org/obo/CHEBI_17504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17505 biolink:ChemicalEntity alpha-D-galactosyl-(1->3)-1D-myo-inositol An α-D-galactoside having a 1D-myo-inositol substituent at the anomeric position. cas:3687-64-7|hmdb:HMDB0005826|kegg.compound:C01235|kegg.glycan:G10488|knapsack:C00001162|metacyc.compound:CPD-458|pubmed:17439666|pubmed:7688662 Graph 1-O-alpha-D-Galactosyl-D-myo-inositol|1-alpha-D-Galactosyl-myo-inositol|3-O-alpha-D-Galactosyl-1D-myo-inositol|Galactinol|O-alpha-D-Galactosyl-(1->3)-1D-myo-inositol|alpha-D-galactosyl-(1->3)-1D-myo-inositol alpha-D-galactosyl-(1->3)-1D-myo-inositol 1-O-alpha-D-Galactosyl-D-myo-inositol|1-alpha-D-Galactosyl-myo-inositol|3-O-alpha-D-Galactosyl-1D-myo-inositol|Galactinol|O-alpha-D-Galactosyl-(1->3)-1D-myo-inositol|alpha-D-galactosyl-(1->3)-1D-myo-inositol http://purl.obolibrary.org/obo/CHEBI_17505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17506 biolink:ChemicalEntity 2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate kegg.compound:C04641 Graph (2R)-2-(alpha-D-galactopyranosyloxy)-3-hydroxypropyl dihydrogen phosphate|2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate|2-(alpha-D-galactopyranosyl)-sn-glycerol 3-(dihydrogen phosphate)|2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate (2R)-2-(alpha-D-galactopyranosyloxy)-3-hydroxypropyl dihydrogen phosphate (2R)-2-(alpha-D-galactopyranosyloxy)-3-hydroxypropyl dihydrogen phosphate|2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate|2-(alpha-D-galactopyranosyl)-sn-glycerol 3-(dihydrogen phosphate)|2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate http://purl.obolibrary.org/obo/CHEBI_17506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17507 biolink:ChemicalEntity psychosine sulfate kegg.compound:C02744 Graph (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 6-O-sulfo-beta-D-galactopyranoside|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside 6-(hydrogen sulfate)|Psychosine sulfate (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside 6-(hydrogen sulfate) (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 6-O-sulfo-beta-D-galactopyranoside|(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl beta-D-galactopyranoside 6-(hydrogen sulfate)|Psychosine sulfate http://purl.obolibrary.org/obo/CHEBI_17507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175077 biolink:ChemicalEntity Tryptophyl-Asparagine chemspider:16568398|hmdb:HMDB0029078 Graph 4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoic acid 4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoic acid 4-amino-2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_175077 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17508 biolink:ChemicalEntity 7,8-dihydroxykynurenic acid A hydroxyquinoline that is kynurenic acid in which the hydrogens at positions 7 and 8 are replaced by hydroxy groups. kegg.compound:C01111|reaxys:407716 Graph 4,7,8-trihydroxyquinoline-2-carboxylic acid|7,8-Dihydroxykynurenate 4,7,8-trihydroxyquinoline-2-carboxylic acid 4,7,8-trihydroxyquinoline-2-carboxylic acid|7,8-Dihydroxykynurenate http://purl.obolibrary.org/obo/CHEBI_17508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17509 biolink:ChemicalEntity 5'-S-methyl-5'-thioadenosine Adenosine with the hydroxy group at C-5' substituted with a methylthio (methylsulfanyl) group. beilstein:42420|cas:2457-80-9|drugbank:DB02282|hmdb:HMDB0001173|kegg.compound:C00170|metacyc.compound:5-METHYLTHIOADENOSINE|pubmed:22735334|reaxys:42420 Graph 5'-Deoxy-5'-(methylthio)adenosine|5'-Methylthioadenosine|5'-deoxy-5'-(methylsulfanyl)adenosine|5-Methylthioadenosine|9-(5-S-methyl-5-thio-beta-D-ribofuranosyl)-9H-purin-6-amine|MTA|Methylthioadenosine|S-Methyl-5'-thioadenosine|S-methyl-5'-thioadenosine|Thiomethyladenosine 5'-deoxy-5'-(methylsulfanyl)adenosine 5'-Deoxy-5'-(methylthio)adenosine|5'-Methylthioadenosine|5'-deoxy-5'-(methylsulfanyl)adenosine|5-Methylthioadenosine|9-(5-S-methyl-5-thio-beta-D-ribofuranosyl)-9H-purin-6-amine|MTA|Methylthioadenosine|S-Methyl-5'-thioadenosine|S-methyl-5'-thioadenosine|Thiomethyladenosine http://purl.obolibrary.org/obo/CHEBI_17509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17510 biolink:ChemicalEntity dTDP-D-fucose Graph thymidine 5'-[3-(6-deoxy-D-galactopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-D-galactopyranosyl) dihydrogen diphosphate] thymidine 5'-[3-(6-deoxy-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17511 biolink:ChemicalEntity 3-O-L-alanyl-1-O-phosphatidylglycerol Phosphatidylglycerol substituted at O-3 by a L-alanyl group. Graph 1-O-(3-O-L-alanylphosphatidyl)glycerol 1-O-(3-O-L-alanylphosphatidyl)glycerol http://purl.obolibrary.org/obo/CHEBI_17511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175111 biolink:ChemicalEntity Berberrubine cas:15401-69-1|chemspider:65547 Graph 17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-16-ol;chloride 17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-16-ol;chloride 17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-16-ol;chloride http://purl.obolibrary.org/obo/CHEBI_175111 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17512 biolink:ChemicalEntity methyl 2-O-alpha-L-fucopyranosyl-beta-D-galactoside kegg.compound:C04698|kegg.glycan:G10523 Graph Methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside|methyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranoside|methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside methyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranoside Methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside|methyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranoside|methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside http://purl.obolibrary.org/obo/CHEBI_17512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17514 biolink:ChemicalEntity cyanide A pseudohalide anion that is the conjugate base of hydrogen cyanide. cas:57-12-5|gmelin:89|hmdb:HMDB0002084|kegg.compound:C00177|metacyc.compound:CPD-13584|pdb-ccd:CYN|pubmed:11386635|pubmed:14871577|pubmed:17554165|pubmed:7839575|reaxys:1900509|wikipedia.en:Cyanide Graph CN(-)|CN-|CYANIDE ION|Cyanide|Prussiate|Zyanid|cyanide|nitridocarbonate(1-) Cyanide|cyanide|nitridocarbonate(1-) CN(-)|CN-|CYANIDE ION|Cyanide|Prussiate|Zyanid|cyanide|nitridocarbonate(1-) http://purl.obolibrary.org/obo/CHEBI_17514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17515 biolink:ChemicalEntity L-gamma-glutamyl-L-cysteine A molecular entity formed when L-cysteine amino group binds to the γ-carbonyl of L-glutamic acid. cas:636-58-8|drugbank:DB03408|hmdb:HMDB0001049|kegg.compound:C00669|knapsack:C00007507|metacyc.compound:L-GAMMA-GLUTAMYLCYSTEINE|pubmed:11409324|reaxys:1729154|wikipedia.en:Gamma-Glutamylcysteine Graph 5-L-Glutamyl-L-cysteine|Glu(-Cys)|L-gamma-Glutamylcysteine|L-gamma-glutamyl-L-cysteine|gamma-Glu-Cys|gamma-Glutamylcysteine|gamma-L-Glutamyl-L-cysteine|gammaGluCys L-gamma-glutamyl-L-cysteine 5-L-Glutamyl-L-cysteine|Glu(-Cys)|L-gamma-Glutamylcysteine|L-gamma-glutamyl-L-cysteine|gamma-Glu-Cys|gamma-Glutamylcysteine|gamma-L-Glutamyl-L-cysteine|gammaGluCys http://purl.obolibrary.org/obo/CHEBI_17515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17516 biolink:ChemicalEntity but-1-ene-1,2,4-tricarboxylic acid kegg.compound:C04002 Graph (1Z)-but-1-ene-1,2,4-tricarboxylic acid|(Z)-1,2,4-But-1-enetricarboxylic acid|But-1-ene-1,2,4-tricarboxylate|Homo-cis-aconitate|cis-Homoaconitate (1Z)-but-1-ene-1,2,4-tricarboxylic acid (1Z)-but-1-ene-1,2,4-tricarboxylic acid|(Z)-1,2,4-But-1-enetricarboxylic acid|But-1-ene-1,2,4-tricarboxylate|Homo-cis-aconitate|cis-Homoaconitate http://purl.obolibrary.org/obo/CHEBI_17516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17517 biolink:ChemicalEntity phosphatidylglycerol A glycerophosphoglycerol that is glycerol in which the hydrogen of one of the primary hydroxy groups has been replaced by a phosphatidyl group. kegg.compound:C00344 Graph phosphatidylglycerols phosphatidylglycerols http://purl.obolibrary.org/obo/CHEBI_17517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17519 biolink:ChemicalEntity N-methyl-L-alanine A methyl-L-alanine in which one of the the amino hydrogen of L-alanine is replaced by a methyl group. cas:3913-67-5|kegg.compound:C02721|metacyc.compound:CPD-298|pdb-ccd:MAA|pubmed:23681735|pubmed:4314464|pubmed:487287|pubmed:6187921|reaxys:1720922 Graph (2S)-2-(methylamino)propanoic acid|(S)-2-methylaminopropanoic acid|N-Methyl-L-alanine|N-Methylalanine|N-methyl-L-alanine (2S)-2-(methylamino)propanoic acid|N-Methyl-L-alanine|N-methyl-L-alanine (2S)-2-(methylamino)propanoic acid|(S)-2-methylaminopropanoic acid|N-Methyl-L-alanine|N-Methylalanine|N-methyl-L-alanine http://purl.obolibrary.org/obo/CHEBI_17519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17520 biolink:ChemicalEntity phenylthioacetohydroximic acid kegg.compound:C03719|knapsack:C00007672 Graph N-hydroxy-2-phenylethanimidothioic acid|Phenylthioacetohydroximate N-hydroxy-2-phenylethanimidothioic acid N-hydroxy-2-phenylethanimidothioic acid|Phenylthioacetohydroximate http://purl.obolibrary.org/obo/CHEBI_17520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17521 biolink:ChemicalEntity (-)-quinic acid The (−)-enantiomer of quinic acid. cas:77-95-2|hmdb:HMDB0003072|kegg.compound:C00296|knapsack:C00001201|metacyc.compound:QUINATE|pdb-ccd:QIC|pubmed:15589483|pubmed:22770225|reaxys:2212412|wikipedia.en:Quinic_acid Graph (-)-Quinic acid|(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid|1L-1(OH),3,4/5-tetrahydroxycyclohexanecarboxylic acid|Chinic acid|D-Quinic acid|Kinic acid|L-Quinic acid|Quinic acid (1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid|1L-1(OH),3,4/5-tetrahydroxycyclohexanecarboxylic acid (-)-Quinic acid|(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid|1L-1(OH),3,4/5-tetrahydroxycyclohexanecarboxylic acid|Chinic acid|D-Quinic acid|Kinic acid|L-Quinic acid|Quinic acid http://purl.obolibrary.org/obo/CHEBI_17521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17522 biolink:ChemicalEntity alditol A carbohydrate that is an acyclic polyol having the general formula HOCH2[CH(OH)]nCH2OH (formally derivable from an aldose by reduction of the carbonyl group). kegg.compound:C00717|wikipedia.en:Glycerin Graph Alditol|Glycitol|Sugar alcohol|alditol|alditols Alditol|Glycitol|Sugar alcohol|alditol|alditols http://purl.obolibrary.org/obo/CHEBI_17522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17524 biolink:ChemicalEntity 6-alkylaminopurine Any purine bearing an alkylamino substituent at the 6-position. kegg.compound:C02860 Graph 6-alkylaminopurines|N6-Alkylaminopurine|an N(6)-alkylaminopurine 6-alkylaminopurines|N6-Alkylaminopurine|an N(6)-alkylaminopurine http://purl.obolibrary.org/obo/CHEBI_17524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17525 biolink:ChemicalEntity testolic acid kegg.compound:C01618 Graph 13-hydroxy-3-oxo-13,17-secoandrost-4-en-17-oic acid|Testolate 13-hydroxy-3-oxo-13,17-secoandrost-4-en-17-oic acid 13-hydroxy-3-oxo-13,17-secoandrost-4-en-17-oic acid|Testolate http://purl.obolibrary.org/obo/CHEBI_17525 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17526 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 4-phosphate A phosphatidylinositol 4-phosphate having 1D-myo-configuration. kegg.compound:C01277 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-4'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 4-phosphate|1-phosphatidyl-1D-myo-inositol 4-monophosphate|Phosphatidylinositol 4-phosphate|PtdIns-4-P|PtdIns4P 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4-(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-4'-phosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4-(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 4-phosphate|1-phosphatidyl-1D-myo-inositol 4-monophosphate|Phosphatidylinositol 4-phosphate|PtdIns-4-P|PtdIns4P http://purl.obolibrary.org/obo/CHEBI_17526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17527 biolink:ChemicalEntity 1,2,3,6-tetrakis-O-galloyl-beta-D-glucose A galloyl-β-D-glucose compound having four galloyl groups in the 1-, 2-, 3- and 6-positions. beilstein:3584855|cas:79886-50-3|kegg.compound:C04516 Graph 1,2,3,6-Tetra-O-galloyl-beta-D-glucose|1,2,3,6-Tetrakis-O-galloyl-beta-D-glucose|1,2,3,6-tetrakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1,2,3,6-tetrakis-O-galloyl-beta-D-glucose 1,2,3,6-tetrakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose 1,2,3,6-Tetra-O-galloyl-beta-D-glucose|1,2,3,6-Tetrakis-O-galloyl-beta-D-glucose|1,2,3,6-tetrakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|1,2,3,6-tetrakis-O-galloyl-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_17527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17528 biolink:ChemicalEntity all-trans-hexaprenyl diphosphate kegg.compound:C01230 Graph (2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl trihydrogen diphosphate|all-trans-Hexaprenyl diphosphate|all-trans-hexaprenyl diphosphate (2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl trihydrogen diphosphate|all-trans-Hexaprenyl diphosphate|all-trans-hexaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_17528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17529 biolink:ChemicalEntity kievitone hydrate A hydroxyisoflavanone that is isoflavanone substituted by hydroxy groups at positions 5, 7, 2' and 4' and a 3-hydroxy-3-methylbutyl group at position 8. cas:62682-11-5|hmdb:HMDB0038111|kegg.compound:C02549|knapsack:C00020635|metacyc.compound:CPD-34|pubmed:1366757|reaxys:1333051 Graph 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydro-4H-chromen-4-one|Kievitone hydrate|kievitone hydrate 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydro-4H-chromen-4-one 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydro-4H-chromen-4-one|Kievitone hydrate|kievitone hydrate http://purl.obolibrary.org/obo/CHEBI_17529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17530 biolink:ChemicalEntity L-arogenic acid beilstein:4458841|cas:53078-86-7|kegg.compound:C00826|knapsack:C00007338 Graph 1-[(2S)-2-amino-2-carboxyethyl]-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid|L-Arogenate|L-Arogenic acid|Pretyrosine|alpha-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid 1-[(2S)-2-amino-2-carboxyethyl]-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid 1-[(2S)-2-amino-2-carboxyethyl]-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid|L-Arogenate|L-Arogenic acid|Pretyrosine|alpha-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid http://purl.obolibrary.org/obo/CHEBI_17530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17531 biolink:ChemicalEntity trans-beta-D-glucosyl-2-hydroxycinnamic acid kegg.compound:C05158 Graph (2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|(2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid|beta-D-Glucosyl-2-coumarate|trans-beta-D-Glucosyl-2-hydroxycinnamate|trans-beta-D-glucosyl-2-hydroxycinnamate (2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid (2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]acrylic acid|(2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid|beta-D-Glucosyl-2-coumarate|trans-beta-D-Glucosyl-2-hydroxycinnamate|trans-beta-D-glucosyl-2-hydroxycinnamate http://purl.obolibrary.org/obo/CHEBI_17531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17532 biolink:ChemicalEntity (S)-6-hydroxynicotine beilstein:7870799|kegg.compound:C01056|umbbd.compound:c0471 Graph (S)-5-(1-methyl-pyrrolidin-2-yl)-1H-pyridin-2-one|(S)-5-(1-methyl-pyrrolidin-2-yl)-pyridin-2-ol|(S)-6-Hydroxynicotine|5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol|l-6-hydroxynicotine 5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol (S)-5-(1-methyl-pyrrolidin-2-yl)-1H-pyridin-2-one|(S)-5-(1-methyl-pyrrolidin-2-yl)-pyridin-2-ol|(S)-6-Hydroxynicotine|5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol|l-6-hydroxynicotine http://purl.obolibrary.org/obo/CHEBI_17532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17533 biolink:ChemicalEntity N-acetyl-L-glutamic acid An N-acyl-L-amino acid that is L-glutamic acid in which one of the amine hydrogens is substituted by an acetyl group. cas:1188-37-0|drugbank:DB04075|hmdb:HMDB0001138|kegg.compound:C00624|pdb-ccd:NLG|pubmed:115331|pubmed:17190852|pubmed:17439666|pubmed:5924663|pubmed:6035272|pubmed:9037750|reaxys:1727473|wikipedia.en:N-Acetylglutamic_acid Graph (2S)-2-acetamidopentanedioic acid|(S)-2-(acetylamino)pentanedioic acid|Ac-Glu-OH|Acetyl-L-glutamic acid|Acetylglutamic acid|L-N-acetylglutamic acid|N-ACETYL-L-GLUTAMATE|N-Ac-Glu-OH|N-Acetyl-L-glutamic acid|N-Acetylglutamic acid|N-acetyl-L-glutamic acid|acetylglutamic acid (2S)-2-acetamidopentanedioic acid|N-Acetyl-L-glutamic acid|N-acetyl-L-glutamic acid (2S)-2-acetamidopentanedioic acid|(S)-2-(acetylamino)pentanedioic acid|Ac-Glu-OH|Acetyl-L-glutamic acid|Acetylglutamic acid|L-N-acetylglutamic acid|N-ACETYL-L-GLUTAMATE|N-Ac-Glu-OH|N-Acetyl-L-glutamic acid|N-Acetylglutamic acid|N-acetyl-L-glutamic acid|acetylglutamic acid http://purl.obolibrary.org/obo/CHEBI_17533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17534 biolink:ChemicalEntity 6-amino-2-oxohexanoic acid beilstein:1756646|kegg.compound:C03239|pdb-ccd:7C3 Graph 2-Oxo-6-aminocaproate|2-oxo-6-aminocaproate|6-Amino-2-oxohexanoate|6-amino-2-oxohexanoic acid 6-amino-2-oxohexanoic acid 2-Oxo-6-aminocaproate|2-oxo-6-aminocaproate|6-Amino-2-oxohexanoate|6-amino-2-oxohexanoic acid http://purl.obolibrary.org/obo/CHEBI_17534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17535 biolink:ChemicalEntity L-arabinopyranose The six-membered ring form of L-arabinose. cas:87-72-9|glytoucan:G88980IR|gmelin:82843|kegg.compound:C00259|pubmed:1177062|pubmed:17336832|pubmed:19913595|pubmed:28785254|reaxys:1680037 Graph L-Arabinopyranose|L-Arabinose|L-arabinopyranose|L-arabinose L-Arabinopyranose|L-Arabinose|L-arabinopyranose L-Arabinopyranose|L-Arabinose|L-arabinopyranose|L-arabinose http://purl.obolibrary.org/obo/CHEBI_17535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17536 biolink:ChemicalEntity allantoate A monocarboxylic acid anion that is the conjugate base of allantoic acid. kegg.compound:C00499|metacyc.compound:ALLANTOATE|pdb-ccd:1AL Graph 2,2-bis(aminocarbonylamino)ethanoate|allantoate|allantoate ion|bis(carbamoylamino)acetate|bis[(aminocarbonyl)amino]acetate|diureidoacetate bis(carbamoylamino)acetate 2,2-bis(aminocarbonylamino)ethanoate|allantoate|allantoate ion|bis(carbamoylamino)acetate|bis[(aminocarbonyl)amino]acetate|diureidoacetate http://purl.obolibrary.org/obo/CHEBI_17536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17537 biolink:ChemicalEntity Tyr-Arg A dipeptide composed of L-tyrosine and L-arginine joined by a peptide linkage. beilstein:2676962|cas:70904-56-2|kegg.compound:C02993 Graph Kyotorphin|L-Tyrosyl-L-arginine|L-tyrosyl-L-arginine|N(2)-L-tyrosyl-L-arginine|Tyr-Arg L-Tyrosyl-L-arginine|L-tyrosyl-L-arginine Kyotorphin|L-Tyrosyl-L-arginine|L-tyrosyl-L-arginine|N(2)-L-tyrosyl-L-arginine|Tyr-Arg http://purl.obolibrary.org/obo/CHEBI_17537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17539 biolink:ChemicalEntity 9-cis,11-trans-octadecadienoate An octadeca-9,11-dienoate that is the conjugate base of 9-cis,11-trans-octadecadienoic acid, formed by deprotonation of the carboxylic acid functional group. pubmed:16890934 Graph (9Z,11E)-octadeca-9,11-dienoate|(9Z,11E)-octadecadienoate (9Z,11E)-octadeca-9,11-dienoate (9Z,11E)-octadeca-9,11-dienoate|(9Z,11E)-octadecadienoate http://purl.obolibrary.org/obo/CHEBI_17539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17540 biolink:ChemicalEntity methyl beta-D-galactoside A β-D-galactopyranoside having a methyl substituent at the anomeric position. cas:1824-94-8|kegg.compound:C03619|pdb-ccd:MBG|pubmed:12392740|pubmed:14499848|pubmed:17340011|pubmed:18701091|pubmed:19913595|pubmed:2454629|pubmed:2546596|pubmed:6465901|pubmed:6865949|pubmed:7296561|pubmed:7407126|pubmed:7524207|pubmed:773938|pubmed:7763824|reaxys:81569 Graph GalbetaOMe|Methyl beta-D-galactopyranoside|Methyl beta-D-galactoside|Methyl beta-galactoside|Methyl galactoside|Methylgalactoside|beta-D-Galactopyranose methyl glycoside|methyl beta-D-galactopyranoside|methyl beta-D-galactoside Methyl beta-D-galactopyranoside|methyl beta-D-galactopyranoside GalbetaOMe|Methyl beta-D-galactopyranoside|Methyl beta-D-galactoside|Methyl beta-galactoside|Methyl galactoside|Methylgalactoside|beta-D-Galactopyranose methyl glycoside|methyl beta-D-galactopyranoside|methyl beta-D-galactoside http://purl.obolibrary.org/obo/CHEBI_17540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17541 biolink:ChemicalEntity 2-carboxy-D-arabinitol 1-phosphate cas:106777-19-9|kegg.compound:C04234|knapsack:C00001158 Graph 2-C-[(phosphonooxy)methyl]-D-ribonic acid|2-Carboxy-D-arabinitol 1-phosphate 2-C-[(phosphonooxy)methyl]-D-ribonic acid 2-C-[(phosphonooxy)methyl]-D-ribonic acid|2-Carboxy-D-arabinitol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_17541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17543 biolink:ChemicalEntity 1-phospho-alpha-D-galacturonic acid An uronic acid phosphate that is α-D-galacturonic acid carrying a phosphate group at position 1. kegg.compound:C04037|pubmed:14479161|reaxys:22719055 Graph 1-O-phosphono-alpha-D-galactopyranuronic acid|1-Phospho-alpha-D-galacturonate|D-Galacturonate 1-phosphate 1-O-phosphono-alpha-D-galactopyranuronic acid 1-O-phosphono-alpha-D-galactopyranuronic acid|1-Phospho-alpha-D-galacturonate|D-Galacturonate 1-phosphate http://purl.obolibrary.org/obo/CHEBI_17543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17544 biolink:ChemicalEntity hydrogencarbonate The carbon oxoanion resulting from the removal of a proton from carbonic acid. beilstein:3903504|cas:71-52-3|gmelin:49249|hmdb:HMDB0000595|kegg.compound:C00288|metacyc.compound:HCO3|pdb-ccd:BCT|pubmed:17215880|pubmed:17505962|pubmed:18439416|pubmed:28732801|pubmed:29150416|pubmed:29460248|pubmed:29466234|pubmed:4208463|wikipedia.en:Bicarbonate Graph Acid carbonate|BICARBONATE ION|Bicarbonate|HCO3(-)|HCO3-|Hydrogencarbonate|[CO2(OH)](-)|hydrogen carbonate|hydrogen(trioxidocarbonate)(1-)|hydrogencarbonate|hydrogencarbonate(1-)|hydrogentrioxocarbonate(1-)|hydrogentrioxocarbonate(IV)|hydroxidodioxidocarbonate(1-) Hydrogencarbonate|hydrogen(trioxidocarbonate)(1-)|hydrogencarbonate|hydrogencarbonate(1-)|hydrogentrioxocarbonate(1-)|hydrogentrioxocarbonate(IV)|hydroxidodioxidocarbonate(1-) Acid carbonate|BICARBONATE ION|Bicarbonate|HCO3(-)|HCO3-|Hydrogencarbonate|[CO2(OH)](-)|hydrogen carbonate|hydrogen(trioxidocarbonate)(1-)|hydrogencarbonate|hydrogencarbonate(1-)|hydrogentrioxocarbonate(1-)|hydrogentrioxocarbonate(IV)|hydroxidodioxidocarbonate(1-) http://purl.obolibrary.org/obo/CHEBI_17544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17545 biolink:ChemicalEntity (E)-indol-3-ylacetaldehyde oxime An indol-3-ylacetaldehyde oxime in which the oxime moiety has E configuration. beilstein:4989545|cas:2776-06-9|foodb.food:FDB030141|hmdb:HMDB0303989|kegg.compound:C02937|knapsack:C00000110|metacyc.compound:INDOLE-3-ACETALDOXIME|pubmed:27375675|reaxys:4989545 Graph (E)-(indol-3-yl)acetaldehyde oxime|(E)-indol-3-ylacetaldoxime|N-[(1E)-2-(1H-indol-3-yl)ethylidene]hydroxylamine N-[(1E)-2-(1H-indol-3-yl)ethylidene]hydroxylamine (E)-(indol-3-yl)acetaldehyde oxime|(E)-indol-3-ylacetaldoxime|N-[(1E)-2-(1H-indol-3-yl)ethylidene]hydroxylamine http://purl.obolibrary.org/obo/CHEBI_17545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17546 biolink:ChemicalEntity (2Z)-5-isopropyl-2-methylhexa-2,5-dienal A hexadienal that is hexa-2,5-dienal substituted by a an isopropyl group at position 5 and a methy group at position 2 (the 2Z-stereoisomer). cas:112164-19-9|kegg.compound:C04435|lipidmaps:LMPR0102020001|umbbd.compound:c0680 Graph (2Z)-2,6-dimethyl-5-methylidenehept-2-enal|(Z)-2-Methyl-5-isopropylhexa-2,5-dienal|(Z)-2-methyl-5-isopropylhexa-2,5-dienal|cis-2-Methyl-5-isopropylhexa-2,5-dienal (2Z)-2,6-dimethyl-5-methylidenehept-2-enal (2Z)-2,6-dimethyl-5-methylidenehept-2-enal|(Z)-2-Methyl-5-isopropylhexa-2,5-dienal|(Z)-2-methyl-5-isopropylhexa-2,5-dienal|cis-2-Methyl-5-isopropylhexa-2,5-dienal http://purl.obolibrary.org/obo/CHEBI_17546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17548 biolink:ChemicalEntity alginic acid A linear copolymer macromolecule composed of homopolymeric blocks of 1→4-linked β-D-mannuronic acid and α-L-guluronic acid residues, covalently linked together in different sequences or blocks. beilstein:8192143|cas:9005-32-7|kegg.compound:C01768|kegg.drug:D02324|kegg.glycan:G10593|pubmed:25449544|wikipedia.en:Alginic_acid Graph (Alginate)n|(Alginate)n+1|Alginate|Alginic acid|Norgine|alginic acid (Alginate)n|(Alginate)n+1|Alginate|Alginic acid|Norgine|alginic acid http://purl.obolibrary.org/obo/CHEBI_17548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17549 biolink:ChemicalEntity 5-aminolevulinic acid The simplest δ-amino acid in which the hydrogens at the γ position are replaced by an oxo group. It is metabolised to protoporphyrin IX, a photoactive compound which accumulates in the skin. Used (in the form of the hydrochloride salt)in combination with blue light illumination for the treatment of minimally to moderately thick actinic keratosis of the face or scalp. cas:106-60-5|drugbank:DB00855|drugcentral:166|hmdb:HMDB0001149|kegg.compound:C00430|kegg.drug:D07567|knapsack:C00007378|lincs.smallmolecule:LSM-5677|pubmed:11303952|pubmed:15756058|pubmed:15996585|pubmed:18982627|pubmed:19378778|pubmed:22378066|pubmed:22700502|pubmed:23242333|pubmed:23291627|pubmed:23299429|pubmed:23307195|pubmed:23339045|pubmed:23360321|pubmed:7890117|reaxys:1759139|wikipedia.en:Aminolevulinic_acid Graph 5-ALA|5-Amino-4-oxopentanoate|5-Amino-4-oxovaleric acid|5-Aminolevulinate|5-amino-4-oxopentanoic acid|aminolevulinic acid|dALA|delta-ALA|delta-aminolevulinic acid 5-Amino-4-oxopentanoate|5-amino-4-oxopentanoic acid 5-ALA|5-Amino-4-oxopentanoate|5-Amino-4-oxovaleric acid|5-Aminolevulinate|5-amino-4-oxopentanoic acid|aminolevulinic acid|dALA|delta-ALA|delta-aminolevulinic acid http://purl.obolibrary.org/obo/CHEBI_17549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17550 biolink:ChemicalEntity UDP-N-acetyl-D-galactosamine 4-sulfate Graph uridine 5'-[3-(2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-4-O-sulfo-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17551 biolink:ChemicalEntity ecdysone palmitate kegg.compound:C02681 Graph (22R)-2beta,14,22,25-tetrahydroxy-6-oxo-5beta-cholest-7-en-3beta-yl hexadecanoate|Ecdysone palmitate|ecdysone hexadecanoate (22R)-2beta,14,22,25-tetrahydroxy-6-oxo-5beta-cholest-7-en-3beta-yl hexadecanoate (22R)-2beta,14,22,25-tetrahydroxy-6-oxo-5beta-cholest-7-en-3beta-yl hexadecanoate|Ecdysone palmitate|ecdysone hexadecanoate http://purl.obolibrary.org/obo/CHEBI_17551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17552 biolink:ChemicalEntity GDP A purine ribonucleoside 5'-diphosphate resulting from the formal condensation of the hydroxy group at the 5' position of guanosine with pyrophosphoric acid. cas:146-91-8|drugbank:DB04315|hmdb:HMDB0001201|kegg.compound:C00035|kegg.glycan:G10620|pdb-ccd:GDP|pubmed:18439413|pubmed:9271366|wikipedia.en:Guanosine_diphosphate Graph GDP|Guanosine 5'-diphosphate|Guanosine diphosphate|guanosine 5'-(trihydrogen diphosphate) guanosine 5'-(trihydrogen diphosphate) GDP|Guanosine 5'-diphosphate|Guanosine diphosphate|guanosine 5'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17553 biolink:ChemicalEntity O-phosphoethanolamine The ethanolamine mono-ester of phosphoric acid, and a metabolite of phospholipid metabolism. This phosphomonoester shows strong structural similarity to the inhibitory neurotransmitter GABA, and is decreased in post-mortem Alzheimer's disease brain. cas:1071-23-4|drugbank:DB01738|gmelin:663022|kegg.compound:C00346|metacyc.compound:PHOSPHORYL-ETHANOLAMINE|pdb-ccd:OPE|pubmed:1112054|pubmed:7791524|reaxys:1758916 Graph 2-amino-ethanol dihydrogen phosphate|2-amino-ethanol phosphate|2-aminoethyl dihydrogen phosphate|EAP|Ethanolamine phosphate|O-Phosphoethanolamine|O-Phosphorylethanolamine|O-phosphocolamine|OPE|PE|PEA|PETN|Phosphoethanolamine|colamine phosphate|colamine phosphoric acid|colaminphosphoric acid|ethanolamine O-phosphate|ethanolamine acid phosphate|mono(2-aminoethyl) phosphate|monoaminoethyl phosphate|pEtN|phosphoric acid 2-aminoethyl phenyl ester|phosphoryl-ethanolamine 2-aminoethyl dihydrogen phosphate 2-amino-ethanol dihydrogen phosphate|2-amino-ethanol phosphate|2-aminoethyl dihydrogen phosphate|EAP|Ethanolamine phosphate|O-Phosphoethanolamine|O-Phosphorylethanolamine|O-phosphocolamine|OPE|PE|PEA|PETN|Phosphoethanolamine|colamine phosphate|colamine phosphoric acid|colaminphosphoric acid|ethanolamine O-phosphate|ethanolamine acid phosphate|mono(2-aminoethyl) phosphate|monoaminoethyl phosphate|pEtN|phosphoric acid 2-aminoethyl phenyl ester|phosphoryl-ethanolamine http://purl.obolibrary.org/obo/CHEBI_17553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17555 biolink:ChemicalEntity 1-alkyl-2-acetyl-sn-glycerol 3-phosphate kegg.compound:C01264 Graph (2R)-1-alkoxy-3-(phosphonooxy)propan-2-yl acetate|1-Alkyl-2-acetyl-sn-glycero-3-phosphate|1-alkyl-2-acetyl-sn-glycerol 3-phosphates (2R)-1-alkoxy-3-(phosphonooxy)propan-2-yl acetate (2R)-1-alkoxy-3-(phosphonooxy)propan-2-yl acetate|1-Alkyl-2-acetyl-sn-glycero-3-phosphate|1-alkyl-2-acetyl-sn-glycerol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_17555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17556 biolink:ChemicalEntity phaseollidin A member of the class of pterocarpans that is (6aR,11aR)-pterocarpan substituted by hydroxy groups at positions 3 and 9 and a prenyl group at position 10. cas:13401-40-6|cas:37831-70-2|hmdb:HMDB0033669|kegg.compound:C05230|kegg.compound:C10514|knapsack:C00002558|knapsack:C00002559|lipidmaps:LMPK12070011|pubmed:8277323|reaxys:4820124 Graph (-)-Phaseollidin|(6aR,11aR)-10-(3-methylbut-2-en-1-yl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol|Phaseollidin|phaseollidin (6aR,11aR)-10-(3-methylbut-2-en-1-yl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol (-)-Phaseollidin|(6aR,11aR)-10-(3-methylbut-2-en-1-yl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol|Phaseollidin|phaseollidin http://purl.obolibrary.org/obo/CHEBI_17556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175566 biolink:ChemicalEntity desmethylastemizole cas:73736-50-2|chemspider:137238|hmdb:HMDB0061013 Graph 4-[2-[4-[[1-[(4-luorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]phenol 4-[2-[4-[[1-[(4-luorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]phenol 4-[2-[4-[[1-[(4-luorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]ethyl]phenol http://purl.obolibrary.org/obo/CHEBI_175566 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17558 biolink:ChemicalEntity quercitrin A quercetin O-glycoside that is quercetin substituted by a α-L-rhamnosyl moiety at position 3 via a glycosidic linkage. cas:522-12-3|hmdb:HMDB0033751|kegg.compound:C01750|knapsack:C00005374|lipidmaps:LMPK12112171|metacyc.compound:QUERCITRIN|pubmed:10963295|pubmed:11714358|pubmed:11816040|pubmed:12008093|pubmed:15388977|pubmed:15725651|pubmed:16806328|pubmed:17366733|pubmed:19928818|pubmed:21834636|pubmed:22327179|pubmed:22379948|pubmed:23138875|pubmed:23291772|reaxys:68135|wikipedia.en:Quercitrin Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside|3,3',4',5,7-Pentahydroxyflavone-3-L-rhamnoside|3-((6-Deoxy-alpha-L-mannopyranosyl)-oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|Quercetin 3-L-rhamnoside|Quercetin 3-O-alpha-L-rhamnopyranoside|Quercetin 3-O-rhamnoside|Quercimelin|Quercitrin|Quercitronic acid|Quercitroside|luteolin 6-deoxy-alpha-L-mannopyranoside|quercetin 3-O-alpha-L-rhamnopyranoside|quercetin-3-L-rhamnoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside|3,3',4',5,7-Pentahydroxyflavone-3-L-rhamnoside|3-((6-Deoxy-alpha-L-mannopyranosyl)-oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|Quercetin 3-L-rhamnoside|Quercetin 3-O-alpha-L-rhamnopyranoside|Quercetin 3-O-rhamnoside|Quercimelin|Quercitrin|Quercitronic acid|Quercitroside|luteolin 6-deoxy-alpha-L-mannopyranoside|quercetin 3-O-alpha-L-rhamnopyranoside|quercetin-3-L-rhamnoside http://purl.obolibrary.org/obo/CHEBI_17558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17559 biolink:ChemicalEntity 3alpha(S)-strictosidine cas:20824-29-7|kegg.compound:C03470|knapsack:C00029058 Graph 3-alpha(S)-Strictosidine|Strictosidine|methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-ylmethyl]-3,4-dihydro-2H-pyran-5-carboxylate methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-ylmethyl]-3,4-dihydro-2H-pyran-5-carboxylate 3-alpha(S)-Strictosidine|Strictosidine|methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-ylmethyl]-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_17559 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17560 biolink:ChemicalEntity 2,2'-iminodipropanoate gmelin:406411|kegg.compound:C03210 Graph 2,2'-azanediyldipropanoate 2,2'-azanediyldipropanoate 2,2'-azanediyldipropanoate http://purl.obolibrary.org/obo/CHEBI_17560 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175603 biolink:ChemicalEntity 2-Phenylaminoadenosine cas:53296-10-9|chemspider:5293029 Graph (2R,3R,4S,5R)-2-(6-amino-2-anilinopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (2R,3R,4S,5R)-2-(6-amino-2-anilinopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol (2R,3R,4S,5R)-2-(6-amino-2-anilinopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol http://purl.obolibrary.org/obo/CHEBI_175603 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17561 biolink:ChemicalEntity L-cysteine An optically active form of cysteine having L-configuration. cas:52-90-4|drugbank:DB00151|drugcentral:769|ecmdb:ECMDB00574|gmelin:49991|hmdb:HMDB0000574|kegg.compound:C00097|kegg.drug:D00026|knapsack:C00001351|metacyc.compound:CYS|pdb-ccd:CYS|pubmed:11732994|pubmed:13761469|pubmed:22735334|reaxys:1721408|wikipedia.en:Cysteine|ymdb:YMDB00046 Graph (2R)-2-amino-3-mercaptopropanoic acid|(2R)-2-amino-3-sulfanylpropanoic acid|(R)-2-amino-3-mercaptopropanoic acid|C|CYSTEINE|Cys|E 920|E-920|E920|FREE CYSTEINE|L-2-Amino-3-mercaptopropionic acid|L-Cystein|L-Cysteine|L-Zystein|L-cysteine CYSTEINE|L-Cysteine|L-cysteine (2R)-2-amino-3-mercaptopropanoic acid|(2R)-2-amino-3-sulfanylpropanoic acid|(R)-2-amino-3-mercaptopropanoic acid|C|CYSTEINE|Cys|E 920|E-920|E920|FREE CYSTEINE|L-2-Amino-3-mercaptopropionic acid|L-Cystein|L-Cysteine|L-Zystein|L-cysteine http://purl.obolibrary.org/obo/CHEBI_17561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17562 biolink:ChemicalEntity cytidine A pyrimidine nucleoside in which cytosine is attached to ribofuranose via a β-N1-glycosidic bond. cas:65-46-3|drugbank:DB02097|gmelin:84763|hmdb:HMDB0000089|kegg.compound:C00475|kegg.drug:D07769|metacyc.compound:CYTIDINE|pdb-ccd:CTN|pubmed:12591866|pubmed:15621516|pubmed:19194376|reaxys:89173|wikipedia.en:Cytidine Graph 1-beta-D-Ribofuranosylcytosine|1beta-D-ribofuranosylcytosine|4-AMINO-1-BETA-D-RIBOFURANOSYL-2(1H)-PYRIMIDINONE|4-amino-1-beta-D-ribofuranosylpyrimidin-2(1H)-one|4-amino-1beta-D-ribofuranosyl-2(1H)-pyrimidinone|Cyd|Cytidin|Cytidine|Cytosine riboside|Zytidin|cytidine|cytosine-1beta-D-Ribofuranoside Cytidine|cytidine 1-beta-D-Ribofuranosylcytosine|1beta-D-ribofuranosylcytosine|4-AMINO-1-BETA-D-RIBOFURANOSYL-2(1H)-PYRIMIDINONE|4-amino-1-beta-D-ribofuranosylpyrimidin-2(1H)-one|4-amino-1beta-D-ribofuranosyl-2(1H)-pyrimidinone|Cyd|Cytidin|Cytidine|Cytosine riboside|Zytidin|cytidine|cytosine-1beta-D-Ribofuranoside http://purl.obolibrary.org/obo/CHEBI_17562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17563 biolink:ChemicalEntity phthalate(2-) A phthalate that is the dianion obtained by the deprotonation of both the carboxy groups of phthalic acid. cas:3198-29-6|gmelin:3530|kegg.compound:C01606|reaxys:3906509|umbbd.compound:c0181 Graph 1,2-benzenedicarboxylate|benzene-1,2-dicarboxylate|phthalate benzene-1,2-dicarboxylate 1,2-benzenedicarboxylate|benzene-1,2-dicarboxylate|phthalate http://purl.obolibrary.org/obo/CHEBI_17563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17566 biolink:ChemicalEntity indole-3-acetonitrile A nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a 1H-indol-3-yl group. cas:771-51-7|hmdb:HMDB0006524|kegg.compound:C02938|knapsack:C00000107|metacyc.compound:INDOLEYL-CPD|pubmed:11867093|pubmed:20649646|pubmed:21619597|pubmed:2342128|pubmed:24837382|reaxys:125488 Graph (Indol-3-yl)acetonitrile|(Indole-3-yl)acetonitrile|(indol-3-yl)acetonitrile|1H-indol-3-ylacetonitrile|3-(cyanomethyl)indole|3-Indoleacetonitrile|3-indolylacetonitrile|Indol-3-ylacetonitrile|Indole-3-acetonitrile 1H-indol-3-ylacetonitrile (Indol-3-yl)acetonitrile|(Indole-3-yl)acetonitrile|(indol-3-yl)acetonitrile|1H-indol-3-ylacetonitrile|3-(cyanomethyl)indole|3-Indoleacetonitrile|3-indolylacetonitrile|Indol-3-ylacetonitrile|Indole-3-acetonitrile http://purl.obolibrary.org/obo/CHEBI_17566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17567 biolink:ChemicalEntity O-alkylglycerone kegg.compound:C02446 Graph 1-alkyl-glycerones|O-Alkylglycerone|O-alkylglycerone|O-alkylglycerones 1-alkyl-glycerones|O-Alkylglycerone|O-alkylglycerone|O-alkylglycerones http://purl.obolibrary.org/obo/CHEBI_17567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17568 biolink:ChemicalEntity uracil A common and naturally occurring pyrimidine nucleobase in which the pyrimidine ring is substituted with two oxo groups at positions 2 and 4. Found in RNA, it base pairs with adenine and replaces thymine during DNA transcription. cas:66-22-8|drugbank:DB03419|gmelin:2896|hmdb:HMDB0000300|kegg.compound:C00106|kegg.drug:D00027|knapsack:C00001513|metacyc.compound:URACIL|pdb-ccd:URA|pubmed:11279060|pubmed:12855717|pubmed:15274295|pubmed:16834123|pubmed:17439666|pubmed:18533995|pubmed:18815805|pubmed:19175333|pubmed:22020693|pubmed:22074393|pubmed:22120518|pubmed:22171528|pubmed:22237209|pubmed:22299724|pubmed:22356544|pubmed:22447672|pubmed:22483865|pubmed:22567906|pubmed:22685418|pubmed:3654008|reaxys:606623|wikipedia.en:Uracil Graph 2,4(1H,3H)-pyrimidinedione|2,4-Dioxopyrimidine|2,4-Pyrimidinedione|U|URACIL|Ura|Uracil|Urazil|pyrimidine-2,4(1H,3H)-dione|uracil pyrimidine-2,4(1H,3H)-dione 2,4(1H,3H)-pyrimidinedione|2,4-Dioxopyrimidine|2,4-Pyrimidinedione|U|URACIL|Ura|Uracil|Urazil|pyrimidine-2,4(1H,3H)-dione|uracil http://purl.obolibrary.org/obo/CHEBI_17568 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17573 biolink:ChemicalEntity glycyrrhetinate cas:1449-05-4|cas:471-53-4|kegg.compound:C02283 Graph 3beta-hydroxy-11-oxoolean-12-en-30-oate|Glycyrrhetinate|glycyrrhetinate 3beta-hydroxy-11-oxoolean-12-en-30-oate 3beta-hydroxy-11-oxoolean-12-en-30-oate|Glycyrrhetinate|glycyrrhetinate http://purl.obolibrary.org/obo/CHEBI_17573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17574 biolink:ChemicalEntity biochanin A A member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone which is substituted by an additional hydroxy group at position 5 and a methoxy group at position 4'. A phytoestrogen, it has putative benefits in dietary cancer prophylaxis. cas:491-80-5|hmdb:HMDB0002338|kegg.compound:C00814|knapsack:C00002510|lipidmaps:LMPK12050229|metacyc.compound:BIOCHANIN-A|pdb-ccd:QSO|pubmed:11348577|pubmed:11931850|pubmed:15277096|pubmed:18060767|pubmed:20590565|pubmed:23406166|pubmed:23649249|pubmed:23948065|pubmed:24129051|pubmed:24201306|pubmed:28166217|pubmed:8947298|reaxys:278107|wikipedia.en:Biochanin_A Graph 4'-methylgenistein|5,7-dihydroxy-3-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|5,7-dihydroxy-3-p-methoxyphenyl-4H-chromen-4-one|5,7-dihydroxy-4'-methoxyisoflavone|Biochanin A|olmelin|pratensol 5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one 4'-methylgenistein|5,7-dihydroxy-3-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|5,7-dihydroxy-3-p-methoxyphenyl-4H-chromen-4-one|5,7-dihydroxy-4'-methoxyisoflavone|Biochanin A|olmelin|pratensol http://purl.obolibrary.org/obo/CHEBI_17574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17575 biolink:ChemicalEntity S-(5-deoxy-D-ribos-5-yl)-L-homocysteine Graph Ribose-5-S-homocysteine|S-(5-deoxy-D-ribofuranos-5-yl)-L-homocysteine S-(5-deoxy-D-ribofuranos-5-yl)-L-homocysteine Ribose-5-S-homocysteine|S-(5-deoxy-D-ribofuranos-5-yl)-L-homocysteine http://purl.obolibrary.org/obo/CHEBI_17575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17576 biolink:ChemicalEntity (3R)-3-hydroxy-L-aspartic acid beilstein:2046210|kegg.compound:C03961|metacyc.compound:CPD-655|pubmed:19791805 Graph (2S,3R)-2-amino-3-hydroxybutanedioic acid|(2S,3R)-2-amino-3-hydroxysuccinic acid|(3R)-3-hydroxy-L-aspartic acid|L-erythro-beta-hydroxyaspartic acid|erythro-3-Hydroxy-L-aspartate|erythro-3-Hydroxy-L-aspartic acid|erythro-3-Hydroxy-Ls-aspartic acid|erythro-beta-hydroxy-L-aspartic acid (2S,3R)-2-amino-3-hydroxybutanedioic acid|(3R)-3-hydroxy-L-aspartic acid (2S,3R)-2-amino-3-hydroxybutanedioic acid|(2S,3R)-2-amino-3-hydroxysuccinic acid|(3R)-3-hydroxy-L-aspartic acid|L-erythro-beta-hydroxyaspartic acid|erythro-3-Hydroxy-L-aspartate|erythro-3-Hydroxy-L-aspartic acid|erythro-3-Hydroxy-Ls-aspartic acid|erythro-beta-hydroxy-L-aspartic acid http://purl.obolibrary.org/obo/CHEBI_17576 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175763 biolink:ChemicalEntity 2-trans,6-trans-farnesyl diphosphate(3-) An organophosphate oxoanion that is the trianion obtained by removal of the three protons from the diphosphate group of 2-trans,6-trans-farnesyl diphosphate. Graph (2-trans,6-trans)-farnesyl diphosphate(3-)|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl (phosphonatooxy)phosphonate|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate|(2E,6E)-farnesyl diphosphate|(2E,6E)-farnesyl diphosphate(3-)|(E,E)-farnesyl diphosphate(3-)|farnesyl pyrophosphate(3-)|trans,trans-farnesyl diphosphate(3-) (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate (2-trans,6-trans)-farnesyl diphosphate(3-)|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl (phosphonatooxy)phosphonate|(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl diphosphate|(2E,6E)-farnesyl diphosphate|(2E,6E)-farnesyl diphosphate(3-)|(E,E)-farnesyl diphosphate(3-)|farnesyl pyrophosphate(3-)|trans,trans-farnesyl diphosphate(3-) http://purl.obolibrary.org/obo/CHEBI_175763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17578 biolink:ChemicalEntity toluene The simplest member of the class toluenes consisting of a benzene core which bears a single methyl substituent. cas:108-88-3|drugbank:DB01900|gmelin:2456|kegg.compound:C01455|pdb-ccd:MBN|pubmed:11182169|pubmed:11314682|pubmed:11846266|pubmed:11991009|pubmed:12062755|pubmed:12213539|pubmed:12237258|pubmed:12784113|pubmed:12876426|pubmed:14512097|pubmed:14559343|pubmed:14605898|pubmed:15015825|pubmed:15019953|pubmed:15119846|pubmed:15193425|pubmed:15542760|pubmed:15567510|pubmed:15695158|pubmed:15796064|pubmed:16316648|pubmed:16348226|pubmed:16601996|pubmed:17145141|pubmed:17175136|pubmed:17497535|pubmed:17725881|pubmed:18397809|pubmed:18832024|pubmed:19261054|pubmed:19384711|pubmed:19429395|pubmed:19635754|pubmed:19765629|pubmed:19825861|pubmed:19928203|pubmed:19969016|pubmed:20347282|pubmed:20837561|pubmed:21430649|pubmed:21655021|pubmed:21731073|pubmed:21802510|pubmed:21840036|reaxys:635760|umbbd.compound:c0114|wikipedia.en:Toluene Graph TOLUENE|Toluen|Toluene|Toluol|methylbenzene|phenylmethane|toluene TOLUENE|Toluene|toluene TOLUENE|Toluen|Toluene|Toluol|methylbenzene|phenylmethane|toluene http://purl.obolibrary.org/obo/CHEBI_17578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17579 biolink:ChemicalEntity beta-carotene A cyclic carotene obtained by dimerisation of all-trans-retinol. A strongly-coloured red-orange pigment abundant in plants and fruit and the most active and important provitamin A carotenoid. cas:7235-40-7|drugcentral:345|hmdb:HMDB0000561|kegg.compound:C02094|kegg.drug:D03101|knapsack:C00000919|lipidmaps:LMPR01070000|lipidmaps:LMPR01070001|metacyc.compound:CPD1F-129|pdb-ccd:BCR|pubmed:11171227|pubmed:11182771|pubmed:11332447|pubmed:11359610|pubmed:11382814|pubmed:11567548|pubmed:11677037|pubmed:11714348|pubmed:11962062|pubmed:12081834|pubmed:12891827|pubmed:14658721|pubmed:14764912|pubmed:14976384|pubmed:14997360|pubmed:15113067|pubmed:15333155|pubmed:15695449|pubmed:15789045|pubmed:15909543|pubmed:15949680|pubmed:15949683|pubmed:16036331|pubmed:16087476|pubmed:16338959|pubmed:16563447|pubmed:17004738|pubmed:17625873|pubmed:17708644|pubmed:17851775|pubmed:18429004|pubmed:18766464|pubmed:18767554|pubmed:18794175|pubmed:19480350|pubmed:19574250|pubmed:19669835|pubmed:19703237|pubmed:19852884|pubmed:19888275|pubmed:19896667|pubmed:19937581|pubmed:20074992|pubmed:20515074|pubmed:22079732|pubmed:22309480|pubmed:22428124|pubmed:22489215|pubmed:22534340|pubmed:22575730|reaxys:1917416|wikipedia.en:Beta_Carotene Graph 1,1'-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaene-1,18-diyl]bis(2,6,6-trimethylcyclohexene)|BETA-CAROTENE|all-trans-beta-carotene|beta,beta-carotene|beta-Carotene|beta-Karotin beta,beta-carotene 1,1'-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaene-1,18-diyl]bis(2,6,6-trimethylcyclohexene)|BETA-CAROTENE|all-trans-beta-carotene|beta,beta-carotene|beta-Carotene|beta-Karotin http://purl.obolibrary.org/obo/CHEBI_17579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17580 biolink:ChemicalEntity linalool A monoterpenoid that is octa-1,6-diene substituted by methyl groups at positions 3 and 7 and a hydroxy group at position 3. It has been isolated from plants like Ocimum canum. bpdb:2150|cas:78-70-6|gmelin:406448|hmdb:HMDB0036100|kegg.compound:C03985|knapsack:C00003047|lipidmaps:LMPR0102010004|pubmed:18695915|pubmed:24570447|pubmed:24758511|reaxys:1362385|vsdb:2150|wikipedia.en:Linalool Graph 2,6-dimethylocta-2,7-dien-6-ol|3,7-Dimethylocta-1,6-dien-3-ol|3,7-dimethylocta-1,6-dien-3-ol|Linalool|beta-linalool|linalool|linalyl alcohol 3,7-Dimethylocta-1,6-dien-3-ol|3,7-dimethylocta-1,6-dien-3-ol 2,6-dimethylocta-2,7-dien-6-ol|3,7-Dimethylocta-1,6-dien-3-ol|3,7-dimethylocta-1,6-dien-3-ol|Linalool|beta-linalool|linalool|linalyl alcohol http://purl.obolibrary.org/obo/CHEBI_17580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17582 biolink:ChemicalEntity isochorismic acid beilstein:2943868|cas:22642-82-6|kegg.compound:C00885|knapsack:C00000734|knapsack:C00007614 Graph (5S,6S)-5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid|Isochorismic acid (5S,6S)-5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid (5S,6S)-5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid|Isochorismic acid http://purl.obolibrary.org/obo/CHEBI_17582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17583 biolink:ChemicalEntity N-(long-chain-fatty-acyl)-L-glutamate A dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of any N-(long-chain-fatty-acyl)-L-glutamic acid; major species at pH 7.3. Graph an N-(long-chain-fatty-acyl)-L-glutamate an N-(long-chain-fatty-acyl)-L-glutamate http://purl.obolibrary.org/obo/CHEBI_17583 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17585 biolink:ChemicalEntity trans-hexadec-2-enal A hexadecenal containing a double bond at position 2 (the trans-stereoisomer). kegg.compound:C06123|lipidmaps:LMFA06000089|pubmed:20804717|pubmed:22444536|pubmed:25137547|pubmed:26408264|pubmed:28588048|pubmed:29608264|pubmed:34857138 Graph (2E)-hexadec-2-enal|(2E)-hexadecenal|(E)-2-hexadecenal|2-trans-hexadecenal (2E)-hexadec-2-enal (2E)-hexadec-2-enal|(2E)-hexadecenal|(E)-2-hexadecenal|2-trans-hexadecenal http://purl.obolibrary.org/obo/CHEBI_17585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17586 biolink:ChemicalEntity CoA-glutathione An organic disulfide arising from oxidative coupling of the thiol functions of coenzyme A and glutathione. beilstein:4902335|cas:6477-52-7|kegg.compound:C00920 Graph CoA-glutathione|Coassg|Coenzyme A-glutathione mixed disulfide|Glutathione-coa mixed disulfide CoA-glutathione|Coassg|Coenzyme A-glutathione mixed disulfide|Glutathione-coa mixed disulfide http://purl.obolibrary.org/obo/CHEBI_17586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17587 biolink:ChemicalEntity L-gulono-1,4-lactone The furanose form of gulonolactone having L-configuration. cas:1128-23-0|hmdb:HMDB0003466|kegg.compound:C01040|pubmed:16956367|reaxys:83002 Graph (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxydihydrofuran-2(3H)-one|L-Gulonic acid gamma-lactone|L-Gulono-1,4-lactone|L-Gulono-gamma-lactone|L-Gulonolactone|L-gulono-1,4-lactone|gamma-Gulonolactone (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxydihydrofuran-2(3H)-one (3S,4R,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxydihydrofuran-2(3H)-one|L-Gulonic acid gamma-lactone|L-Gulono-1,4-lactone|L-Gulono-gamma-lactone|L-Gulonolactone|L-gulono-1,4-lactone|gamma-Gulonolactone http://purl.obolibrary.org/obo/CHEBI_17587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17588 biolink:ChemicalEntity L-homocysteine A homocysteine that has L configuration. cas:6027-13-0|drugbank:DB04422|hmdb:HMDB0000742|kegg.compound:C00155|knapsack:C00001365|metacyc.compound:HOMO-CYS|pdb-ccd:HCS|pubmed:11686577|pubmed:15131313|pubmed:15365276|pubmed:16702349|pubmed:19383686|reaxys:1721685 Graph (2S)-2-amino-4-sulfanylbutanoic acid|Hcy|L-2-Amino-4-mercaptobutyric acid|L-2-amino-4-mercaptobutyric acid|L-Homocysteine|L-homocysteine (2S)-2-amino-4-sulfanylbutanoic acid (2S)-2-amino-4-sulfanylbutanoic acid|Hcy|L-2-Amino-4-mercaptobutyric acid|L-2-amino-4-mercaptobutyric acid|L-Homocysteine|L-homocysteine http://purl.obolibrary.org/obo/CHEBI_17588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17589 biolink:ChemicalEntity 3-chloro-cis,cis-muconate(2-) beilstein:3606608|umbbd.compound:c0297 Graph (2E,4Z)-3-chlorohexa-2,4-dienedioate|3-chloro-cis,cis-muconate (2E,4Z)-3-chlorohexa-2,4-dienedioate (2E,4Z)-3-chlorohexa-2,4-dienedioate|3-chloro-cis,cis-muconate http://purl.obolibrary.org/obo/CHEBI_17589 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17590 biolink:ChemicalEntity octane A straight chain alkane composed of 8 carbon atoms. cas:111-65-9|drugbank:DB02440|gmelin:82412|hmdb:HMDB0001485|kegg.compound:C01387|lipidmaps:LMFA11000002|metacyc.compound:CPD-148|pdb-ccd:OCT|pubmed:11255151|pubmed:24354334|reaxys:1696875|umbbd.compound:c0044|wikipedia.en:Octane Graph CH3-[CH2]6-CH3|N-OCTANE|Octane|Oktan|n-Octane|n-Oktan|octane Octane|octane CH3-[CH2]6-CH3|N-OCTANE|Octane|Oktan|n-Octane|n-Oktan|octane http://purl.obolibrary.org/obo/CHEBI_17590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175901 biolink:ChemicalEntity gemcitabine A 2'-deoxycytidine having geminal fluoro substituents in the 2'-position. An inhibitor of ribonucleotide reductase, gemcitabine is used in the treatment of various carcinomas, particularly non-small cell lung cancer, pancreatic cancer, bladder cancer and breast cancer. beilstein:5382060|cas:95058-81-4|drugbank:DB00441|drugcentral:1283|kegg.compound:C07650|kegg.drug:D02368|lincs.smallmolecule:LSM-5333|patent:EP1939198|patent:EP2108368|patent:EP2275135|patent:GB2136425|patent:US2009124797|patent:US2010111852|patent:US4808614|pdb-ccd:GEO|pubmed:11034044|pubmed:11061612|pubmed:11088063|pubmed:11122828|pubmed:11132538|pubmed:11142482|pubmed:11221019|pubmed:11356111|pubmed:11374818|pubmed:11489002|pubmed:11504793|pubmed:11510027|pubmed:11585734|pubmed:11595724|pubmed:11807603|pubmed:11859947|pubmed:11901308|pubmed:12057041|pubmed:12057046|pubmed:12057157|pubmed:12115355|pubmed:12142097|pubmed:12520460|pubmed:12571808|pubmed:12722678|pubmed:12722691|pubmed:12743987|pubmed:12761494|pubmed:12798170|pubmed:12917815|pubmed:12954073|pubmed:14606642|pubmed:14653877|pubmed:14720338|pubmed:15131028|pubmed:15160243|pubmed:15221904|pubmed:15282439|pubmed:15297392|pubmed:15542781|pubmed:15637766|pubmed:15744590|pubmed:16001951|pubmed:16041610|pubmed:16080557|pubmed:16143373|pubmed:16149285|pubmed:16317298|pubmed:16500746|pubmed:16555971|pubmed:16584929|pubmed:16807461|pubmed:16807463|pubmed:16894289|pubmed:16905983|pubmed:17101674|pubmed:17296311|pubmed:17296587|pubmed:17347561|pubmed:17429628|pubmed:17460420|pubmed:17602464|pubmed:17639396|pubmed:17887663|pubmed:17939651|pubmed:17941128|pubmed:17987263|pubmed:18035967|pubmed:18050344|pubmed:18086345|pubmed:18166944|pubmed:18186604|pubmed:18257544|pubmed:18348652|pubmed:18773046|pubmed:18789834|pubmed:18819792|pubmed:18981552|pubmed:19034448|pubmed:19177022|pubmed:19399788|pubmed:19839926|pubmed:19879060|pubmed:22763439|pubmed:28594276|pubmed:28608357|pubmed:28912244|reaxys:5382060|wikipedia.en:Gemcitabine Graph 2',2'-Difluorodeoxycytidine|2'-Deoxy-2',2'-difluorocytidine|2'-deoxy-2',2'-difluorocytidine|4-amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one|gemcitabina|gemcitabine|gemcitabinum 2'-Deoxy-2',2'-difluorocytidine|2'-deoxy-2',2'-difluorocytidine 2',2'-Difluorodeoxycytidine|2'-Deoxy-2',2'-difluorocytidine|2'-deoxy-2',2'-difluorocytidine|4-amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one|gemcitabina|gemcitabine|gemcitabinum http://purl.obolibrary.org/obo/CHEBI_175901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17592 biolink:ChemicalEntity N(5)-methyl-L-glutamine An N5-alkylglutamine where the alkyl group is specified as methyl. drugbank:DB03473|kegg.compound:C03153|pdb-ccd:MEQ Graph (2S)-2-amino-5-(methylamino)-5-oxopentanoic acid|N(5)-methyl-L-glutamine|N(delta)-methylglutamine|N-methylglutamine|N5-METHYLGLUTAMINE|N5-Methyl-L-glutamine|gamma-methylglutamine (2S)-2-amino-5-(methylamino)-5-oxopentanoic acid|N(5)-methyl-L-glutamine (2S)-2-amino-5-(methylamino)-5-oxopentanoic acid|N(5)-methyl-L-glutamine|N(delta)-methylglutamine|N-methylglutamine|N5-METHYLGLUTAMINE|N5-Methyl-L-glutamine|gamma-methylglutamine http://purl.obolibrary.org/obo/CHEBI_17592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17593 biolink:ChemicalEntity maltooligosaccharide A glucooligosaccharide derived from glucose monomers linked via α-D-1,4 bonds as in maltose. The term is commonly applied to the series of linear oligosaccharides composed of two, three, four, five and six such units of glucose. Graph (1->4)-alpha-D-glucooligosaccharides|maltooligosaccharides (1->4)-alpha-D-glucooligosaccharides|maltooligosaccharides http://purl.obolibrary.org/obo/CHEBI_17593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:175930 biolink:ChemicalEntity Artemetin cas:479-90-3|chemspider:4478461|hmdb:HMDB0030095|lipidmaps:LMPK12113017 Graph 2-(3,4-dimethoxyphenyl)-5-hydroxy-3,6,7-trimethoxychromen-4-one 2-(3,4-dimethoxyphenyl)-5-hydroxy-3,6,7-trimethoxychromen-4-one 2-(3,4-dimethoxyphenyl)-5-hydroxy-3,6,7-trimethoxychromen-4-one http://purl.obolibrary.org/obo/CHEBI_175930 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17594 biolink:ChemicalEntity hydroquinone A benzenediol comprising benzene core carrying two hydroxy substituents para to each other. cas:123-31-9|drugcentral:3282|gmelin:2742|hmdb:HMDB0002434|kegg.compound:C00530|kegg.compound:C15603|kegg.drug:D00073|knapsack:C00002656|metacyc.compound:HYDROQUINONE|ppdb:1503|pubmed:11170505|pubmed:12213471|pubmed:1395635|pubmed:15618234|pubmed:15894107|pubmed:1899343|pubmed:19148301|pubmed:24407054|pubmed:24858384|pubmed:25586344|reaxys:605970|umbbd.compound:c0091|wikipedia.en:Hydroquinone Graph 1,4-Benzenediol|1,4-Dihydroxybenzene|4-Hydroxyphenol|Benzene-1,4-diol|Eldoquin|Hydroquinone|Quinol|benzene-1,4-diol|hydroquinone|p-Benzenediol|p-Hydroquinone|p-hydroxyphenol Benzene-1,4-diol|benzene-1,4-diol 1,4-Benzenediol|1,4-Dihydroxybenzene|4-Hydroxyphenol|Benzene-1,4-diol|Eldoquin|Hydroquinone|Quinol|benzene-1,4-diol|hydroquinone|p-Benzenediol|p-Hydroquinone|p-hydroxyphenol http://purl.obolibrary.org/obo/CHEBI_17594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17596 biolink:ChemicalEntity inosine A purine nucleoside in which hypoxanthine is attached to ribofuranose via a β-N9-glycosidic bond. cas:58-63-9|drugcentral:3301|ecmdb:ECMDB00195|gmelin:489332|hmdb:HMDB0000195|kegg.compound:C00294|kegg.drug:D00054|knapsack:C00019692|metacyc.compound:INOSINE|pdb-ccd:NOS|pubmed:22770225|reaxys:624889|wikipedia.en:Inosine|ymdb:YMDB00510 Graph (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-3,4-diol|9-(beta-D-ribofuranosyl)-9H-purin-6-ol|9-beta-D-ribofuranosyl-9H-purin-6-ol|9-beta-D-ribofuranosylhypoxanthine|INOSINE|Inosin|Inosine|hypoxanthine D-riboside|hypoxanthosine|i|inosina|inosine|inosinum (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-3,4-diol|9-(beta-D-ribofuranosyl)-9H-purin-6-ol|INOSINE|Inosine|inosine (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-3,4-diol|9-(beta-D-ribofuranosyl)-9H-purin-6-ol|9-beta-D-ribofuranosyl-9H-purin-6-ol|9-beta-D-ribofuranosylhypoxanthine|INOSINE|Inosin|Inosine|hypoxanthine D-riboside|hypoxanthosine|i|inosina|inosine|inosinum http://purl.obolibrary.org/obo/CHEBI_17596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17597 biolink:ChemicalEntity 4-hydroxybenzaldehyde A hydroxybenzaldehyde that is benzaldehyde substituted with a hydroxy group at position C-4. cas:123-08-0|drugbank:DB03560|gmelin:82654|hmdb:HMDB0011718|kegg.compound:C00633|knapsack:C00002657|metacyc.compound:4-HYDROXYBENZALDEHYDE|pdb-ccd:HBA|pubmed:21542597|pubmed:22770225|pubmed:3593236|reaxys:471352|umbbd.compound:c0285|wikipedia.en:4-Hydroxybenzaldehyde Graph 4-Hydroxybenzaldehyde|4-formylphenol|4-hydroxybenzaldehyde|P-HYDROXYBENZALDEHYDE|p-Hydroxybenzaldehyde|p-formylphenol 4-Hydroxybenzaldehyde|4-hydroxybenzaldehyde 4-Hydroxybenzaldehyde|4-formylphenol|4-hydroxybenzaldehyde|P-HYDROXYBENZALDEHYDE|p-Hydroxybenzaldehyde|p-formylphenol http://purl.obolibrary.org/obo/CHEBI_17597 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17598 biolink:ChemicalEntity phorbol 12,13-dibutanoate beilstein:6551234|cas:37558-16-0|kegg.compound:C03634 Graph (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulene-9,9a-diyl dibutanoate|PDBu|Phorbol 12,13-dibutanoate|Phorbol-12,13-dibutyrate|phorbol 12,13-dibutanoate|phorbol 12,13-dibutyrate (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulene-9,9a-diyl dibutanoate (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulene-9,9a-diyl dibutanoate|PDBu|Phorbol 12,13-dibutanoate|Phorbol-12,13-dibutyrate|phorbol 12,13-dibutanoate|phorbol 12,13-dibutyrate http://purl.obolibrary.org/obo/CHEBI_17598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17600 biolink:ChemicalEntity hexadecanal beilstein:1772756|cas:629-80-1|drugbank:DB03381|gmelin:722456|kegg.compound:C00517|knapsack:C00007542|lipidmaps:LMFA06000088 Graph 1-hexadecanal|16-Hexadecanal|Hexadecanal|Palmitaldehyde|hexadecanal|n-hexadecanal Hexadecanal|hexadecanal 1-hexadecanal|16-Hexadecanal|Hexadecanal|Palmitaldehyde|hexadecanal|n-hexadecanal http://purl.obolibrary.org/obo/CHEBI_17600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17601 biolink:ChemicalEntity 6,7-dimethyl-8-(1-D-ribityl)lumazine The pteridine that is lumazine substituted with methyl groups at C-6 and -7 and with a 1-D-ribityl group on N-8. beilstein:47879|cas:5118-16-1|kegg.compound:C04332|pdb-ccd:DLZ|pubmed:23051753 Graph 1-deoxy-1-[6,7-dimethyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl]-D-ribitol|6,7-Dimethyl-8-(1'-D-ribityl)lumazine|6,7-Dimethyl-8-(1-D-ribityl)lumazine|6,7-Dimethyl-8-ribityllumazine|6,7-dimethyl-8-(1-D-ribityl)lumazine|6,7-dimethyl-8-(D-ribityl)lumazine|6,7-dimethyl-8-D-ribityllumazine|DMDRL|RL-6,7-diMe 1-deoxy-1-[6,7-dimethyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl]-D-ribitol 1-deoxy-1-[6,7-dimethyl-2,4-dioxo-3,4-dihydropteridin-8(2H)-yl]-D-ribitol|6,7-Dimethyl-8-(1'-D-ribityl)lumazine|6,7-Dimethyl-8-(1-D-ribityl)lumazine|6,7-Dimethyl-8-ribityllumazine|6,7-dimethyl-8-(1-D-ribityl)lumazine|6,7-dimethyl-8-(D-ribityl)lumazine|6,7-dimethyl-8-D-ribityllumazine|DMDRL|RL-6,7-diMe http://purl.obolibrary.org/obo/CHEBI_17601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17602 biolink:ChemicalEntity 4-aminophenol An amino phenol (one of the three possible isomers) which has the single amino substituent located para to the phenolic -OH group. cas:123-30-8|gmelin:2926|hmdb:HMDB0001169|kegg.compound:C02372|metacyc.compound:CPD-259|pdb-ccd:4NL|pubmed:11304127|pubmed:1395635|pubmed:22770225|pubmed:7179289|reaxys:385836|umbbd.compound:c0090|wikipedia.en:4-Aminophenol Graph 4-AMINOPHENOL|4-Aminobenzenol|4-Aminophenol|4-Hydroxyaniline|4-aminophenol|p-Aminophenol|p-hydroxyaniline 4-AMINOPHENOL|4-Aminophenol|4-aminophenol 4-AMINOPHENOL|4-Aminobenzenol|4-Aminophenol|4-Hydroxyaniline|4-aminophenol|p-Aminophenol|p-hydroxyaniline http://purl.obolibrary.org/obo/CHEBI_17602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17604 biolink:ChemicalEntity N(6)-methyl-L-lysine An L-lysine derivative that is L-lysine in which one of the hydrogens attached to N6 is substituted by a methyl group. cas:1188-07-4|hmdb:HMDB0002038|kegg.compound:C02728|pdb-ccd:MLZ|pubmed:14032673|pubmed:1730244|pubmed:17636967|pubmed:19772323|pubmed:20711534|pubmed:413481|pubmed:426794|pubmed:518920|pubmed:5222990|pubmed:5332039|pubmed:5347964|pubmed:5356590|pubmed:5368259|pubmed:5846984|pubmed:6770375|pubmed:6790681|reaxys:1931417 Graph (2S)-2-amino-6-(methylamino)hexanoic acid|(S)-2-amino-6-methylaminohexanoic acid|Epsilon-N-methyllysine|MeLys|N(6)-Methyllysine|N(6)-methyl-L-lysine|N(epsilon)-methyl-L-lysine|N(zeta)-methyllysine|N-Epsilon-methyllysine|N-methyl-L-lysine|N6-Methyl-L-lysine|epsilon-methyllysine (2S)-2-amino-6-(methylamino)hexanoic acid|N(6)-methyl-L-lysine (2S)-2-amino-6-(methylamino)hexanoic acid|(S)-2-amino-6-methylaminohexanoic acid|Epsilon-N-methyllysine|MeLys|N(6)-Methyllysine|N(6)-methyl-L-lysine|N(epsilon)-methyl-L-lysine|N(zeta)-methyllysine|N-Epsilon-methyllysine|N-methyl-L-lysine|N6-Methyl-L-lysine|epsilon-methyllysine http://purl.obolibrary.org/obo/CHEBI_17604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17605 biolink:ChemicalEntity 2-formylbenzoic acid An aldehydic acid which consists of benzoic acid substituted by a formyl group at position 2. Metabolite of ampicillin phthalidyl ester. cas:119-67-5|kegg.compound:C03057|pubmed:12123834|pubmed:12604212|pubmed:24862007|pubmed:28166217|reaxys:742381|umbbd.compound:c0448 Graph 2-Carboxybenzaldehyde|2-Formylbenzoic acid|2-formylbenzoic acid|Phthalaldehydic acid|o-Formylbenzoic acid|o-formylbenzoic acid 2-formylbenzoic acid 2-Carboxybenzaldehyde|2-Formylbenzoic acid|2-formylbenzoic acid|Phthalaldehydic acid|o-Formylbenzoic acid|o-formylbenzoic acid http://purl.obolibrary.org/obo/CHEBI_17605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17606 biolink:ChemicalEntity diiodine Molecule comprising two covalently bonded iodine atoms with overall zero charge.. beilstein:3587194|cas:7553-56-2|drugcentral:4446|gmelin:1160|kegg.compound:C01382|kegg.drug:D00108|pubmed:15206581|pubmed:19672279|pubmed:20045605|pubmed:24504625 Graph I2|Iodine|Jod|diiodine|molecular iodine Iodine|diiodine I2|Iodine|Jod|diiodine|molecular iodine http://purl.obolibrary.org/obo/CHEBI_17606 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17607 biolink:ChemicalEntity 1,5-dihydroriboflavin beilstein:1232017|kegg.compound:C01007 Graph 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|Reduced riboflavin|reduced riboflavin 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol|Reduced riboflavin|reduced riboflavin http://purl.obolibrary.org/obo/CHEBI_17607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17608 biolink:ChemicalEntity D-aldohexose Any D-aldose having a chain of six carbon atoms in the molecule. Graph D-aldohexoses D-aldohexoses http://purl.obolibrary.org/obo/CHEBI_17608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17609 biolink:ChemicalEntity cortisol 21-acetate beilstein:2066841|cas:50-03-3|drugbank:DB00741|drugcentral:4213|kegg.compound:C02821|kegg.drug:D00165|lipidmaps:LMST02030093 Graph 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate|21-O-acetylcortisol|Cortell|Cortisol 21-acetate|Hydrocortisone acetate|cortisol 21-acetate|cortisol acetate|hydrocortisone 21-acetate 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate|21-O-acetylcortisol|Cortell|Cortisol 21-acetate|Hydrocortisone acetate|cortisol 21-acetate|cortisol acetate|hydrocortisone 21-acetate http://purl.obolibrary.org/obo/CHEBI_17609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17610 biolink:ChemicalEntity 3-nitroacrylic acid An α,β-unsaturated monocarboxylic acid that is acrylic acid in which one of the hydrogens at position 3 is replaced by a nitro group. kegg.compound:C02231 Graph 3-Nitroacrylate|3-nitroprop-2-enoic acid 3-nitroprop-2-enoic acid 3-Nitroacrylate|3-nitroprop-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_17610 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17611 biolink:ChemicalEntity 3-hydroxycyclohexanone kegg.compound:C03228 Graph 3-Hydroxycyclohexanone|3-hydroxycyclohexan-1-one|3-hydroxycyclohexanone 3-hydroxycyclohexan-1-one 3-Hydroxycyclohexanone|3-hydroxycyclohexan-1-one|3-hydroxycyclohexanone http://purl.obolibrary.org/obo/CHEBI_17611 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17612 biolink:ChemicalEntity (3,4-dihydroxyphenyl)acetate A dihydroxy monocarboxylic acid anion that is the conjugate base of (3,4-dihydroxyphenyl)acetic acid, arising from deprotonation of the carboxy group. kegg.compound:C01161|umbbd.compound:c0272 Graph (3,4-dihydroxyphenyl)acetate|3,4-dihydroxyphenylacetate|homoprotocatechuate (3,4-dihydroxyphenyl)acetate (3,4-dihydroxyphenyl)acetate|3,4-dihydroxyphenylacetate|homoprotocatechuate http://purl.obolibrary.org/obo/CHEBI_17612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17613 biolink:ChemicalEntity all-trans-heptaprenyl diphosphate An all-trans-polyprenyl diphosphate composed from seven isoprenyl units. kegg.compound:C04216 Graph (2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl trihydrogen diphosphate|all-trans-Heptaprenyl diphosphate|all-trans-heptaprenyl diphosphate (2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl trihydrogen diphosphate (2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl trihydrogen diphosphate|all-trans-Heptaprenyl diphosphate|all-trans-heptaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_17613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17614 biolink:ChemicalEntity 5-methyltetrahydropteroyltri-L-glutamic acid kegg.compound:C04489 Graph 5-Methyltetrahydropteroyltri-L-glutamate|N-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid N-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid 5-Methyltetrahydropteroyltri-L-glutamate|N-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-gamma-glutamyl-L-gamma-glutamyl-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_17614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17615 biolink:ChemicalEntity 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol A class of galactoglycerolipids that consists of any 1,2-diacyl-sn-glycerol having a β-D-galactosyl residue attached at position 3. drugbank:DB04735|kegg.compound:C03692 Graph 1,2-Diacyl-3-beta-D-galactosyl-sn-glycerol|3-(beta-D-Galactosyl)-1,2-diacyl-sn-glycerol|3-beta-D-Galactosyl-1,2-diacylglycerol|D-Galactosyldiacylglycerol|MGDG|Monogalactosyl-diacylglycerol|Monogalactosyldiglyceride|a 1,2-diacyl-3-O-(beta-D-galactosyl)-sn-glycerol 1,2-Diacyl-3-beta-D-galactosyl-sn-glycerol|3-(beta-D-Galactosyl)-1,2-diacyl-sn-glycerol|3-beta-D-Galactosyl-1,2-diacylglycerol|D-Galactosyldiacylglycerol|MGDG|Monogalactosyl-diacylglycerol|Monogalactosyldiglyceride|a 1,2-diacyl-3-O-(beta-D-galactosyl)-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_17615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17616 biolink:ChemicalEntity all-trans-retinyl palmitate An all-trans-retinyl ester obtained by formal condensation of the carboxy group of palmitic (hexadecanoic acid) with the hydroxy group of all-trans-retinol. It is used in cosmetic products to treat various skin disorders such as acne, skin aging, wrinkles, dark spots, and also protect against psoriasis. cas:79-81-2|chemspider:4444162|drugbank:DBSALT000855|drugcentral:4197|foodb.food:FDB030671|hmdb:HMDB0003648|kegg.compound:C02588|kegg.drug:D00164|lipidmaps:LMPR01090013|metacyc.compound:CHOCOLA_A|pubmed:11236082|pubmed:16149731|pubmed:23290361|pubmed:23651513|pubmed:23945125|pubmed:24657715|pubmed:24998947|pubmed:26224426|pubmed:29025343|pubmed:29363259|pubmed:29412915|pubmed:29571474|pubmed:30031321|pubmed:30316701|pubmed:30551390|pubmed:30972178|pubmed:31369745|pubmed:32353979|pubmed:32846153|pubmed:33202630|pubmed:33290311|pubmed:33621371|pubmed:33658762|pubmed:8157860|pubmed:8359391|pubmed:9125314|pubmed:9380354|reaxys:1917366|wikipedia.en:Retinyl_palmitate Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl hexadecanoate|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8,tetraenyl hexadecanoic acid ester|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate|Afaxin|Alphalin|Aquasol A|Arovit|Chocola A|O(15)-hexadecanoylretinol|Optovit-A|all-trans-retinol palmitate|all-trans-retinyl hexadecanoate|all-trans-retinyl palmitate|retinol hexadecanoate|retinol palmitate|retinyl hexadecanoate|retinyl palmitate|trans-retinol palmitate|trans-retinyl palmitate|vitamin A palmitate (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl hexadecanoate|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8,tetraenyl hexadecanoic acid ester|(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate|Afaxin|Alphalin|Aquasol A|Arovit|Chocola A|O(15)-hexadecanoylretinol|Optovit-A|all-trans-retinol palmitate|all-trans-retinyl hexadecanoate|all-trans-retinyl palmitate|retinol hexadecanoate|retinol palmitate|retinyl hexadecanoate|retinyl palmitate|trans-retinol palmitate|trans-retinyl palmitate|vitamin A palmitate http://purl.obolibrary.org/obo/CHEBI_17616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17617 biolink:ChemicalEntity L-fuculose A a deoxyketohexose comprising L-tagatose with the hydroxy group at position 6 replaced by hydrogen. kegg.compound:C01721|knapsack:C00019650 Graph 6-deoxy-L-lyxo-hex-2-ulose|6-deoxy-L-tagatose|L-Fuculose|L-fuculose 6-deoxy-L-tagatose 6-deoxy-L-lyxo-hex-2-ulose|6-deoxy-L-tagatose|L-Fuculose|L-fuculose http://purl.obolibrary.org/obo/CHEBI_17617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17618 biolink:ChemicalEntity bis-D-fructose 2',1:2,1'-dianhydride beilstein:29826|cas:3568-49-8|kegg.compound:C04333 Graph Bis-D-fructose 2',1:2,1'-dianhydride|Di-D-fructose 1,2'-2,1' dianhydride|Di-D-fructose 1,2'; 2,1' dianhydride|Difructose anhydride I|bis-D-fructose 2',1:2,1'-dianhydride Bis-D-fructose 2',1:2,1'-dianhydride|Di-D-fructose 1,2'-2,1' dianhydride|Di-D-fructose 1,2'; 2,1' dianhydride|Difructose anhydride I|bis-D-fructose 2',1:2,1'-dianhydride http://purl.obolibrary.org/obo/CHEBI_17618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17619 biolink:ChemicalEntity 4-(3-methylbut-2-enyl)-L-tryptophan kegg.compound:C04290 Graph 4-(3-Methylbut-2-enyl)-L-tryptophan|4-(3-methylbut-2-en-1-yl)-L-tryptophan|4-(3-methylbut-2-enyl)-L-tryptophan 4-(3-methylbut-2-en-1-yl)-L-tryptophan 4-(3-Methylbut-2-enyl)-L-tryptophan|4-(3-methylbut-2-en-1-yl)-L-tryptophan|4-(3-methylbut-2-enyl)-L-tryptophan http://purl.obolibrary.org/obo/CHEBI_17619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17620 biolink:ChemicalEntity trans-ferulic acid A ferulic acid consisting of trans-cinnamic acid bearing methoxy and hydroxy substituents at positions 3 and 4 respectively on the phenyl ring. cas:537-98-4|hmdb:HMDB0000954|kegg.compound:C01494|knapsack:C00002743|metacyc.compound:FERULIC-ACID|pdb-ccd:FER|pubmed:11041377|pubmed:11982438|pubmed:12529986|pubmed:15162367|pubmed:15309442|pubmed:16011737|pubmed:16185284|pubmed:18582080|pubmed:18651237|pubmed:18707110|pubmed:18795822|pubmed:19594750|pubmed:8821508|reaxys:1570363|wikipedia.en:Ferulic_Acid Graph (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid|(E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid|(E)-4'-hydroxy-3'-methoxycinnamic acid|(E)-4-Hydroxy-3-methoxycinnamic acid|(E)-Ferulic acid|3-(4-Hydroxy-3-methoxyphenyl)propenoic acid|3-methoxy-4-hydroxy-trans-cinnamic acid|4-Hydroxy-3-methoxycinnamic acid|4-hydroxy-3-methoxycinnamic acid|Ferulic acid|trans-4-Hydroxy-3-methoxycinnamic acid|trans-Ferulic acid (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid|(E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid|(E)-4'-hydroxy-3'-methoxycinnamic acid|(E)-4-Hydroxy-3-methoxycinnamic acid|(E)-Ferulic acid|3-(4-Hydroxy-3-methoxyphenyl)propenoic acid|3-methoxy-4-hydroxy-trans-cinnamic acid|4-Hydroxy-3-methoxycinnamic acid|4-hydroxy-3-methoxycinnamic acid|Ferulic acid|trans-4-Hydroxy-3-methoxycinnamic acid|trans-Ferulic acid http://purl.obolibrary.org/obo/CHEBI_17620 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17621 biolink:ChemicalEntity FMN A flavin mononucleotide that is riboflavin (vitamin B2) in which the primary hydroxy group has been converted to its dihydrogen phosphate ester. cas:146-17-8|drugbank:DB03247|drugcentral:2374|gmelin:477717|hmdb:HMDB0001520|kegg.compound:C00061|knapsack:C00019686|patent:US2535385|patent:US2610179|patent:US2740775|patent:US3118876|pdb-ccd:FMN|pubmed:13973054|pubmed:23500531|pubmed:23570607|pubmed:24643482|pubmed:25108762|reaxys:68086|wikipedia.en:Flavin_mononucleotide Graph 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol|FLAVIN MONONUCLEOTIDE|FMN|Flavin mononucleotide|Riboflavin-5-phosphate|riboflavin 5'-(dihydrogen phosphate)|riboflavin 5'-monophosphate|riboflavin 5'-phosphate|riboflavin monophosphate|riboflavine dihydrogen phosphate 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-5-O-phosphono-D-ribitol|FLAVIN MONONUCLEOTIDE|FMN|Flavin mononucleotide|Riboflavin-5-phosphate|riboflavin 5'-(dihydrogen phosphate)|riboflavin 5'-monophosphate|riboflavin 5'-phosphate|riboflavin monophosphate|riboflavine dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_17621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17622 biolink:ChemicalEntity dUMP A pyrimidine 2'-deoxyribonucleoside 5'-monophosphate having uracil as the nucleobase. cas:964-26-1|drugbank:DB03800|hmdb:HMDB0001409|kegg.compound:C00365|knapsack:C00019282|metacyc.compound:DUMP|pdb-ccd:DU|pdb-ccd:UMP|pubmed:22770225|pubmed:24147825|reaxys:42143|wikipedia.en:Deoxyuridine_monophosphate Graph 2'-Deoxyuridine 5'-phosphate|2'-deoxy-5'-uridylic acid|2'-deoxyuridine 5'-monophosphate|Deoxyuridine 5'-phosphate|Deoxyuridine monophosphate|Deoxyuridylic acid|dUMP|deoxyuridylate 2'-deoxy-5'-uridylic acid 2'-Deoxyuridine 5'-phosphate|2'-deoxy-5'-uridylic acid|2'-deoxyuridine 5'-monophosphate|Deoxyuridine 5'-phosphate|Deoxyuridine monophosphate|Deoxyuridylic acid|dUMP|deoxyuridylate http://purl.obolibrary.org/obo/CHEBI_17622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17623 biolink:ChemicalEntity cyclomaltodextrin A cyclic oligosaccharide comprising a ring of D-glucose units linked by α-(1→4) glycosidic bonds. kegg.compound:C00973|kegg.glycan:G10546 Graph cyclomaltodextrin cyclomaltodextrin http://purl.obolibrary.org/obo/CHEBI_17623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176233 biolink:ChemicalEntity Tocophersolan chemspider:64498|hmdb:HMDB0034354|kegg.drug:D06174 Graph 1-O-(2-hydroxyethyl) 4-O-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] butanedioate 1-O-(2-hydroxyethyl) 4-O-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] butanedioate 1-O-(2-hydroxyethyl) 4-O-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] butanedioate http://purl.obolibrary.org/obo/CHEBI_176233 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17624 biolink:ChemicalEntity dolichyl beta-D-mannosyl phosphate Graph Dol-P-Man|Dolichyl beta-D-mannosyl phosphate|dolichol phosphate mannose|dolichol-P-mannose|dolichylphosphate beta-D-mannose Dol-P-Man|Dolichyl beta-D-mannosyl phosphate|dolichol phosphate mannose|dolichol-P-mannose|dolichylphosphate beta-D-mannose http://purl.obolibrary.org/obo/CHEBI_17624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17625 biolink:ChemicalEntity dUTP A deoxyuridine phosphate having a triphosphate group at the 5'-position. cas:102814-08-4|chemspider:58580|drugbank:DB02333|foodb.food:FDB030842|hmdb:HMDB0001191|kegg.compound:C00460|knapsack:C00019636|patent:US6017702|pdb-ccd:DUT|pubmed:10927039|pubmed:11250785|pubmed:11739702|pubmed:11994533|pubmed:14746617|pubmed:15541077|pubmed:16286544|pubmed:19212411|pubmed:20861355|pubmed:231363|pubmed:27689337|pubmed:28400210|pubmed:30332749|pubmed:8221659 Graph 2'-deoxy-UTP|2'-deoxyuridine 5'-(tetrahydrogen triphosphate)|2'-deoxyuridine 5'-triphosphate|2'-deoxyuridine triphosphate|2'-deoxyuridine-5'-triphosphorate|dUTP|deoxy-UTP|deoxyuridine triphosphate|deoxyuridine-5'-triphosphate 2'-deoxyuridine 5'-(tetrahydrogen triphosphate) 2'-deoxy-UTP|2'-deoxyuridine 5'-(tetrahydrogen triphosphate)|2'-deoxyuridine 5'-triphosphate|2'-deoxyuridine triphosphate|2'-deoxyuridine-5'-triphosphorate|dUTP|deoxy-UTP|deoxyuridine triphosphate|deoxyuridine-5'-triphosphate http://purl.obolibrary.org/obo/CHEBI_17625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176255 biolink:ChemicalEntity Ginsenoside Rh4 chemspider:10229021 Graph (2R,3R,4S,5S,6R)-2-[[(3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (2R,3R,4S,5S,6R)-2-[[(3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (2R,3R,4S,5S,6R)-2-[[(3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol http://purl.obolibrary.org/obo/CHEBI_176255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176257 biolink:ChemicalEntity Neferine cas:2292-16-2|chemspider:140375 Graph 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol http://purl.obolibrary.org/obo/CHEBI_176257 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17627 biolink:ChemicalEntity ferroheme b Heme b in which the iron has oxidation state +2. beilstein:953574|cas:14875-96-8|gmelin:95291|kegg.compound:C00032|pdb-ccd:HEM|pdb:3KS0|pubmed:20546754|ymdb:YMDB00041 Graph (protoporphyrinato)iron(II)|Fe(II) heme b|Fe(II)-heme b|Fe(ppIX)|Haem|Heme|Protoheme|[3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron(II)|[Fe(ppIX)]|ferroprotoheme|ferroprotoporphyrin IX|ferrous protoheme|ferrous protoheme IX|iron(II) protoporphyrin IX|protoferroheme (protoporphyrinato)iron(II)|Heme (protoporphyrinato)iron(II)|Fe(II) heme b|Fe(II)-heme b|Fe(ppIX)|Haem|Heme|Protoheme|[3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron(II)|[Fe(ppIX)]|ferroprotoheme|ferroprotoporphyrin IX|ferrous protoheme|ferrous protoheme IX|iron(II) protoporphyrin IX|protoferroheme http://purl.obolibrary.org/obo/CHEBI_17627 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17628 biolink:ChemicalEntity 2-aminoacetaldehyde An amino aldehyde that is acetaldehyde in which one of the hydrogens of the methyl group has been replaced by an amino group. cas:6542-88-7|kegg.compound:C06735 Graph Aminoacetaldehyde|aminoacetaldehyde Aminoacetaldehyde|aminoacetaldehyde Aminoacetaldehyde|aminoacetaldehyde http://purl.obolibrary.org/obo/CHEBI_17628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17630 biolink:ChemicalEntity kanamycin A beilstein:61647|cas:59-01-8|drugbank:DB01172|drugcentral:1519|gmelin:2044856|kegg.compound:C01822|lincs.smallmolecule:LSM-5261|pdb-ccd:KAN|pubmed:22907688|pubmed:24336356|pubmed:24566637|vsdb:1921|wikipedia.en:Kanamycin Graph (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside|4,6-diamino-2-hydroxy-1,3-cyclohexane 3,6'diamino-3,6'-dideoxydi-alpha-D-glucoside|4,6-diamino-2-hydroxy-1,3-cyclohexylene 3,6'-diamino-3,6'-dideoxydi-D-glucopyranoside|KANAMYCIN A|Kanamycin A|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->6)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1->4))-2-deoxy-D-streptamine (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside (1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranoside|4,6-diamino-2-hydroxy-1,3-cyclohexane 3,6'diamino-3,6'-dideoxydi-alpha-D-glucoside|4,6-diamino-2-hydroxy-1,3-cyclohexylene 3,6'-diamino-3,6'-dideoxydi-D-glucopyranoside|KANAMYCIN A|Kanamycin A|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->6)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1->4))-2-deoxy-D-streptamine http://purl.obolibrary.org/obo/CHEBI_17630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17631 biolink:ChemicalEntity alpha-D-Manp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-D-Manp A linear tetrasaccharide composed of four D-mannose units, joined by α-linkages. glygen:G44688AW|glytoucan:G44688AW|kegg.compound:C04861|kegg.glycan:G00172|pubmed:18047546|pubmed:8898075|reaxys:7845374 Graph (Man)4|1,3-alpha-D-Mannosyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose|Manalpha1->3Manalpha1->2Manalpha1->2Man|alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-D-Man|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-D-mannopyranose|alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->2)-D-mannose alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-D-mannopyranose (Man)4|1,3-alpha-D-Mannosyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose|Manalpha1->3Manalpha1->2Manalpha1->2Man|alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-D-Man|alpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-D-mannopyranose|alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->2)-D-mannose http://purl.obolibrary.org/obo/CHEBI_17631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17632 biolink:ChemicalEntity nitrate A nitrogen oxoanion formed by loss of a proton from nitric acid. Principal species present at pH 7.3. beilstein:3587575|cas:14797-55-8|gmelin:1574|metacyc.compound:NITRATE|pdb-ccd:NO3|wikipedia.en:Nitrate Graph NITRATE ION|NO3|NO3(-)|[NO3](-)|nitrate|nitrate(1-)|trioxidonitrate(1-)|trioxonitrate(1-)|trioxonitrate(V) nitrate|trioxidonitrate(1-)|trioxonitrate(1-)|trioxonitrate(V) NITRATE ION|NO3|NO3(-)|[NO3](-)|nitrate|nitrate(1-)|trioxidonitrate(1-)|trioxonitrate(1-)|trioxonitrate(V) http://purl.obolibrary.org/obo/CHEBI_17632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17633 biolink:ChemicalEntity guanosine 3',5'-bis(diphosphate) A guanosine bisphosphate having diphosphate groups at both the 3' and 5'-positions. drugbank:DB04022|kegg.compound:C01228|pdb-ccd:G4P Graph GUANOSINE-5',3'-TETRAPHOSPHATE|Guanosine 3',5'-bis(diphosphate)|Guanosine 3'-diphosphate 5'-diphosphate|Guanosine 5'-diphosphate,3'-diphosphate|guanosine 3',5'-bis(trihydrogen diphosphate) guanosine 3',5'-bis(trihydrogen diphosphate) GUANOSINE-5',3'-TETRAPHOSPHATE|Guanosine 3',5'-bis(diphosphate)|Guanosine 3'-diphosphate 5'-diphosphate|Guanosine 5'-diphosphate,3'-diphosphate|guanosine 3',5'-bis(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176334 biolink:ChemicalEntity GSK2879552 A member of the class of piperidines that is piperidine substituted by (4-carboxyphenyl)methyl and {[(1R,2S)-2-phenylcyclopropyl]amino}methyl groups at positions 1 and 4, respectively. It is a potent and irreversible inhibitor of lysine specific demethylase 1 (LSD1, also known as KDM1A). It was under clinical investigation for the treatment of acute myeloid leukaemia and small cell lung carcinoma. cas:1401966-69-5|chemspider:35308350|patent:WO2012135113|pubmed:26175415|pubmed:26710088|pubmed:27308632|pubmed:28722477|pubmed:29972300|pubmed:30472603|pubmed:30514804|pubmed:30713023|pubmed:31054890|pubmed:31249575|pubmed:31260835|pubmed:31801559|pubmed:32551003|pubmed:32850370|pubmed:32931269|pubmed:33285227|pubmed:33708617|pubmed:33833800|pubmed:34031383 Graph 4-{[4-({[(1R,2S)-2-phenylcyclopropyl]amino}methyl)piperidin-1-yl]methyl}benzoic acid|GSK 2879552|GSK-2879552 4-{[4-({[(1R,2S)-2-phenylcyclopropyl]amino}methyl)piperidin-1-yl]methyl}benzoic acid 4-{[4-({[(1R,2S)-2-phenylcyclopropyl]amino}methyl)piperidin-1-yl]methyl}benzoic acid|GSK 2879552|GSK-2879552 http://purl.obolibrary.org/obo/CHEBI_176334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176335 biolink:ChemicalEntity SP2509 3-(4-morpholinylsulfonyl)-benzoic acid (2E)-2-[1-(5-chloro-2-hydroxyphenyl)ethylidene]hydrazide cas:1423715-09-6|pubmed:34031383 Graph http://purl.obolibrary.org/obo/CHEBI_176335 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176338 biolink:ChemicalEntity 2-N,3-O-bis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl 1-phosphate(2-) metacyc.compound:Lipid-X Graph 2-N-[(3R)-3-hydroxyacyl]-3-O-[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl 1-phosphate|2-deoxy-3-O-[(3R)-3-hydroxyacyl]-2-{[(3R)-3-hydroxyacyl]amino}-1-O-phosphonato-alpha-D-glucopyranose|a lipid X 2-deoxy-3-O-[(3R)-3-hydroxyacyl]-2-{[(3R)-3-hydroxyacyl]amino}-1-O-phosphonato-alpha-D-glucopyranose 2-N-[(3R)-3-hydroxyacyl]-3-O-[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl 1-phosphate|2-deoxy-3-O-[(3R)-3-hydroxyacyl]-2-{[(3R)-3-hydroxyacyl]amino}-1-O-phosphonato-alpha-D-glucopyranose|a lipid X http://purl.obolibrary.org/obo/CHEBI_176338 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17634 biolink:ChemicalEntity D-glucose A glucose with D-configuration. cas:50-99-7 Graph D(+)-glucose|D-(+)-glucose|D-gluco-hexose|D-glucose|Traubenzucker|dextrose|grape sugar D-gluco-hexose|D-glucose D(+)-glucose|D-(+)-glucose|D-gluco-hexose|D-glucose|Traubenzucker|dextrose|grape sugar http://purl.obolibrary.org/obo/CHEBI_17634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176343 biolink:ChemicalEntity 2,3,2',3'-tetrakis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate(2-) metacyc.compound:Lipid-A-Disaccharide Graph a lipid A disaccharide a lipid A disaccharide http://purl.obolibrary.org/obo/CHEBI_176343 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176344 biolink:ChemicalEntity Hydroxycitric acid cas:6205-14-7|chemspider:110439|hmdb:HMDB0031159 Graph 1,2-dihydroxypropane-1,2,3-tricarboxylic acid 1,2-dihydroxypropane-1,2,3-tricarboxylic acid 1,2-dihydroxypropane-1,2,3-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_176344 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17636 biolink:ChemicalEntity sphingomyelin d18:1 Any sphingomyelin having sphingosine as the sphingoid component. kegg.compound:C00550|lipidmaps:LMSP03010000|pubmed:3196084 Graph N-acyl-4-sphingenyl-1-O-phosphorylcholines|Sphingomyelin|a sphingomyelin|ceramide phosphocholine|sphingomyelins N-acyl-4-sphingenyl-1-O-phosphorylcholines|Sphingomyelin|a sphingomyelin|ceramide phosphocholine|sphingomyelins http://purl.obolibrary.org/obo/CHEBI_17636 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17637 biolink:ChemicalEntity 6-methylsalicylic acid A monohydroxybenzoic acid that is salicylic acid in which the hydrogen ortho to the carboxylic acid group is substituted by a methyl group. cas:567-61-3|cas:612-20-4|kegg.compound:C02657|knapsack:C00000486|knapsack:C00002658|lipidmaps:LMPK13010002|metacyc.compound:CPD-637|pubmed:1225916|pubmed:16345795|pubmed:20534347|pubmed:24699147|pubmed:5973021|reaxys:2208693 Graph 2,6-Cresotic acid|2-Hydroxy-6-methylbenzoic acid|2-Hydroxymethylbenzoic acid|2-hydroxy-6-methylbenzoic acid|6-Hydroxy-o-toluic acid|6-Methyl-2-hydroxybenzenecarboxylate|6-Methylsalicylic acid|Methylsalicylic acid 2-hydroxy-6-methylbenzoic acid 2,6-Cresotic acid|2-Hydroxy-6-methylbenzoic acid|2-Hydroxymethylbenzoic acid|2-hydroxy-6-methylbenzoic acid|6-Hydroxy-o-toluic acid|6-Methyl-2-hydroxybenzenecarboxylate|6-Methylsalicylic acid|Methylsalicylic acid http://purl.obolibrary.org/obo/CHEBI_17637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17639 biolink:ChemicalEntity 3-oxo-5beta-cholanic acid beilstein:3218542|cas:1553-56-6|kegg.compound:C03070|lipidmaps:LMST04010127 Graph 3-Oxo-5beta-cholanate|3-ketolithocholic acid|3-oxo-5beta-cholan-24-oic acid|3-oxocholan-24-oic acid 3-oxo-5beta-cholan-24-oic acid 3-Oxo-5beta-cholanate|3-ketolithocholic acid|3-oxo-5beta-cholan-24-oic acid|3-oxocholan-24-oic acid http://purl.obolibrary.org/obo/CHEBI_17639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17640 biolink:ChemicalEntity 3-(indol-3-yl)pyruvate A indol-3-yl carboxylic acid anion that is the conjugate base of 3-(indol-3-yl)pyruvic acid reaxys:4455545 Graph 3-(1H-indol-3-yl)-2-oxopropanoate|indole-3-pyruvate 3-(1H-indol-3-yl)-2-oxopropanoate 3-(1H-indol-3-yl)-2-oxopropanoate|indole-3-pyruvate http://purl.obolibrary.org/obo/CHEBI_17640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17642 biolink:ChemicalEntity pentachlorophenol A chlorophenol that is phenol substituted by 5 chloro groups. cas:87-86-5|gmelin:102794|hmdb:HMDB0041974|kegg.compound:C02575|knapsack:C00007496|lincs.smallmolecule:LSM-37108|metacyc.compound:PENTACHLOROPHENOL|pdb-ccd:PCI|ppdb:513|pubmed:17497895|pubmed:23636589|pubmed:24123209|reaxys:1285380|umbbd.compound:c0326|wikipedia.en:Pentachlorophenol Graph 2,3,4,5,6-pentachlorophenol|PCP|PENTACHLOROPHENOL|Pentachlorophenol|pentachlorophenol PENTACHLOROPHENOL|Pentachlorophenol|pentachlorophenol 2,3,4,5,6-pentachlorophenol|PCP|PENTACHLOROPHENOL|Pentachlorophenol|pentachlorophenol http://purl.obolibrary.org/obo/CHEBI_17642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176425 biolink:ChemicalEntity a lipid IVA(4-) Tetraanion of a lipid IVA with unspecified (3R)-3-hydroxyacyl chains. metacyc.compound:Lipid-IVA Graph a lipid IVA a lipid IVA http://purl.obolibrary.org/obo/CHEBI_176425 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176429 biolink:ChemicalEntity a (Kdo)2-lipid IVA(6-) (Kdo)2-lipid IVA deprotonated at both phosphono groups and at the uronic acid carboxy group and with unspecified (3R)-3-hydroxyacyl chains. metacyc.compound:Kdo-2-4-Kdo-2-6-Lipid-IVA Graph an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA http://purl.obolibrary.org/obo/CHEBI_176429 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17643 biolink:ChemicalEntity 9-riburonosylhypoxanthine kegg.compound:C11631 Graph 9-(beta-D-ribofuranosyluronic acid)-1,9-dihydro-6H-purin-6-one|9-(beta-D-ribofuranuronosyl)-1,9-dihydro-6H-purin-6-one|9-Riburonosylhypoxanthine 9-(beta-D-ribofuranosyluronic acid)-1,9-dihydro-6H-purin-6-one 9-(beta-D-ribofuranosyluronic acid)-1,9-dihydro-6H-purin-6-one|9-(beta-D-ribofuranuronosyl)-1,9-dihydro-6H-purin-6-one|9-Riburonosylhypoxanthine http://purl.obolibrary.org/obo/CHEBI_17643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176431 biolink:ChemicalEntity an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A(6-) A lipid A oxoanion obtained via deprotonation of the carboxy and phosphate OH groups of an α-Kdo-(2→4)-α-Kdo-(2→6)-lipid A with unspecified (3R)-3-hydroxyacyl chains. metacyc.compound:Kdo-2-4-Kdo-2-6-acyl2-Lipid-IVA Graph an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A http://purl.obolibrary.org/obo/CHEBI_176431 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17645 biolink:ChemicalEntity 4-acetamidobutanoic acid An N-acyl-γ-aminobutyric acid resulting from the monoacetylation of the nitrogen of GABA. cas:3025-96-5|hmdb:HMDB0003681|kegg.compound:C02946|pubmed:22770225|reaxys:1762288 Graph 4-(acetylamino)butanoic acid|4-Acetamidobutyric acid|4-acetamidobutanoic acid|N-Acetyl-4-aminobutanoic acid|N-Acetyl-4-aminobutyric acid|N4-Acetylaminobutanoic acid 4-(acetylamino)butanoic acid|4-acetamidobutanoic acid 4-(acetylamino)butanoic acid|4-Acetamidobutyric acid|4-acetamidobutanoic acid|N-Acetyl-4-aminobutanoic acid|N-Acetyl-4-aminobutyric acid|N4-Acetylaminobutanoic acid http://purl.obolibrary.org/obo/CHEBI_17645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17647 biolink:ChemicalEntity 2-dehydro-3-deoxy-L-arabinonic acid kegg.compound:C00684 Graph 2-Dehydro-3-deoxy-L-arabinonate|2-Dehydro-3-deoxy-L-pentonate|2-dehydro-3-deoxy-L-arabinonic acid|2-dehydro-3-deoxy-L-pentonic acid|3-deoxy-L-pent-2-ulosonic acid 3-deoxy-L-pent-2-ulosonic acid 2-Dehydro-3-deoxy-L-arabinonate|2-Dehydro-3-deoxy-L-pentonate|2-dehydro-3-deoxy-L-arabinonic acid|2-dehydro-3-deoxy-L-pentonic acid|3-deoxy-L-pent-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_17647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17649 biolink:ChemicalEntity hydroxymalonate(2-) drugbank:DB03680|gmelin:325483|pdb-ccd:TTN|pubmed:38354877 Graph TARTRONATE|hydroxymalonate|hydroxypropanedioate hydroxypropanedioate TARTRONATE|hydroxymalonate|hydroxypropanedioate http://purl.obolibrary.org/obo/CHEBI_17649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176495 biolink:ChemicalEntity actin polymerisation inducer Any substance that induces the polymerisation of the protein actin. pubmed:33066873 Graph actin polymerisation enhancer|actin polymerisation enhancers|actin polymerisation inducers|inducer of actin polymerization|inducers of actin polymerization actin polymerisation enhancer|actin polymerisation enhancers|actin polymerisation inducers|inducer of actin polymerization|inducers of actin polymerization http://purl.obolibrary.org/obo/CHEBI_176495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176497 biolink:ChemicalEntity geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan. pubmed:23372317|pubmed:28580190|pubmed:30885572|pubmed:33144142|pubmed:33973253|pubmed:34606237|wikipedia.en:Geroprotector Graph anti-aging agent|anti-aging agents|anti-aging drug|anti-aging drugs|geroprotective agent|geroprotective agents|geroprotectors anti-aging agent|anti-aging agents|anti-aging drug|anti-aging drugs|geroprotective agent|geroprotective agents|geroprotectors http://purl.obolibrary.org/obo/CHEBI_176497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17650 biolink:ChemicalEntity cortisol "A 17α-hydroxy-C21-steroid that is pregn-4-ene substituted by oxo groups at positions 3 and 20 and hydroxy groups at positions 11, 17 and 21. Cortisol is a corticosteroid hormone or glucocorticoid produced by zona fasciculata of the adrenal cortex, which is a part of the adrenal gland. It is usually referred to as the ""stress hormone"" as it is involved in response to stress and anxiety, controlled by corticotropin-releasing hormone (CRH). It increases blood pressure and blood sugar, and reduces immune responses." beilstein:1354819|cas:50-23-7|drugbank:DB00741|drugcentral:1388|kegg.compound:C00735|kegg.drug:D00088|lincs.smallmolecule:LSM-5980|lipidmaps:LMST02030001|patent:US2602769|pdb-ccd:HCY|pubmed:10438974|pubmed:2268561|wikipedia.en:Hydrocortisone Graph (11beta)-11,17,21-trihydroxypregn-4-ene-3,20-dione|11beta,17,21-trihydroxypregn-4-ene-3,20-dione|11beta,17alpha,21-Trihydroxy-4-pregnene-3,20-dione|11beta,17alpha,21-trihydroxy-4-pregnene-3,20-dione|11beta-hydrocortisone|17-hydroxycorticosterone|4-pregnen-11beta,17alpha,21-triol-3,20-dione|Cortisol|Hydrocortisone|Kendall's compound F|Reichstein's substance M|cortisol|hidrocortisona|hydrocortisone|hydrocortisonum 11beta,17,21-trihydroxypregn-4-ene-3,20-dione (11beta)-11,17,21-trihydroxypregn-4-ene-3,20-dione|11beta,17,21-trihydroxypregn-4-ene-3,20-dione|11beta,17alpha,21-Trihydroxy-4-pregnene-3,20-dione|11beta,17alpha,21-trihydroxy-4-pregnene-3,20-dione|11beta-hydrocortisone|17-hydroxycorticosterone|4-pregnen-11beta,17alpha,21-triol-3,20-dione|Cortisol|Hydrocortisone|Kendall's compound F|Reichstein's substance M|cortisol|hidrocortisona|hydrocortisone|hydrocortisonum http://purl.obolibrary.org/obo/CHEBI_17650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176500 biolink:ChemicalEntity BAY11-7085 A sulfone that is benzene substituted by [(E)-2-cyanoethenyl]sulfonyl and tert-butyl groups at position 1 and 4, respectively. It is an irreversible inhibitor of IκB-α phosphorylation in cells (IC50 = 10 μM) and prevents the activation of NF-κB. cas:196309-76-9|chemspider:4510087|lincs.smallmolecule:LSM-43815|pubmed:14560113|pubmed:15004016|pubmed:16129475|pubmed:16699956|pubmed:16766531|pubmed:16896168|pubmed:17889719|pubmed:22326395|pubmed:23290051|pubmed:25581261|pubmed:26993765|pubmed:28394395|pubmed:29274359|pubmed:30533198|pubmed:30978702|pubmed:32055188|pubmed:32123585|pubmed:34025434 Graph (2E)-3-(4-tert-butylbenzene-1-sulfonyl)prop-2-enenitrile|(2E)-3-[(4-tert-butylphenyl)sulfonyl]prop-2-enenitrile|(2E)-3-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-2-propenenitrile|(E)-3-(4-t-butylphenylsulfonyl)-2-propenenitrile|(E)-3-(4-tert-butylphenylsulfonyl)-2-propenenitrile|BAY-117085|Bay 11-7083|Bay 11-7085|Bay-11-7085 (2E)-3-[(4-tert-butylphenyl)sulfonyl]prop-2-enenitrile (2E)-3-(4-tert-butylbenzene-1-sulfonyl)prop-2-enenitrile|(2E)-3-[(4-tert-butylphenyl)sulfonyl]prop-2-enenitrile|(2E)-3-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-2-propenenitrile|(E)-3-(4-t-butylphenylsulfonyl)-2-propenenitrile|(E)-3-(4-tert-butylphenylsulfonyl)-2-propenenitrile|BAY-117085|Bay 11-7083|Bay 11-7085|Bay-11-7085 http://purl.obolibrary.org/obo/CHEBI_176500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176509 biolink:ChemicalEntity D-buthionine-(S,R)-sulfoximine A 2-amino-4-(S-butylsulfonimidoyl)butanoic acid which has R-configuration. cas:113158-69-3 Graph (2R)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid|(2R)-2-amino-4-(butylsulfonimidoyl)butanoic acid|(R)-2-amino-4-(S-butylsulfonimidoyl)butyric acid|(R)-buthionine sulfoximine|D-BSO|D-buthionine sulfoximine (2R)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid (2R)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid|(2R)-2-amino-4-(butylsulfonimidoyl)butanoic acid|(R)-2-amino-4-(S-butylsulfonimidoyl)butyric acid|(R)-buthionine sulfoximine|D-BSO|D-buthionine sulfoximine http://purl.obolibrary.org/obo/CHEBI_176509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176510 biolink:ChemicalEntity 2-amino-4-(S-butylsulfonimidoyl)butanoic acid A non-proteinogenic α-amino acid that is homocysteine in which the thiol group carries an oxo, imino and butyl groups. Graph 2-amino-4-(S-butylsulfonimidoyl)butanoic acid|2-amino-4-(S-butylsulfonimidoyl)butyric acid 2-amino-4-(S-butylsulfonimidoyl)butanoic acid 2-amino-4-(S-butylsulfonimidoyl)butanoic acid|2-amino-4-(S-butylsulfonimidoyl)butyric acid http://purl.obolibrary.org/obo/CHEBI_176510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176514 biolink:ChemicalEntity 3,3'-diiodo-L-thyronine zwitterion Graph 3,3'-diiodo-L-thyronine 3,3'-diiodo-L-thyronine http://purl.obolibrary.org/obo/CHEBI_176514 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17652 biolink:ChemicalEntity 3-hydroxy-L-glutamate(2-) A doubly-charged L-α-amino acid anion resulting from deprotonation of both carboxy groups of 3-hydroxy-L-glutamic acid. kegg.compound:C03066 Graph (2S)-2-amino-3-hydroxypentanedioate|3-hydroxy-L-glutamate 3-hydroxy-L-glutamate (2S)-2-amino-3-hydroxypentanedioate|3-hydroxy-L-glutamate http://purl.obolibrary.org/obo/CHEBI_17652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176527 biolink:ChemicalEntity (2S)-3-sulfopropanediol(1-) A 3-sulfopropanediol(1−) that has S-configuration. metacyc.compound:CPD-12693|pubmed:32571930 Graph (2S)-2,3-dihydroxypropane-1-sulfonate|(2S)-3-sulfopropanediol|(2S)-3-sulfopropanediol anion|(S)-2,3-dihydroxypropane-1-sulfonate (2S)-2,3-dihydroxypropane-1-sulfonate (2S)-2,3-dihydroxypropane-1-sulfonate|(2S)-3-sulfopropanediol|(2S)-3-sulfopropanediol anion|(S)-2,3-dihydroxypropane-1-sulfonate http://purl.obolibrary.org/obo/CHEBI_176527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17654 biolink:ChemicalEntity electron acceptor A substance to which an electron may be transferred. kegg.compound:C02177 Graph Elektronenakzeptor|Oxidized donor|electron acceptor electron acceptor Elektronenakzeptor|Oxidized donor|electron acceptor http://purl.obolibrary.org/obo/CHEBI_17654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176541 biolink:ChemicalEntity omega-methyl-very-long-chain fatty acid anion A very long-chain fatty acid anion obtained by deprotonation of the carboxy group of any ω-methyl-very-long-chain fatty acid; major species at pH 7.3. Graph an omega-methyl-very-long-chain fatty acid an omega-methyl-very-long-chain fatty acid http://purl.obolibrary.org/obo/CHEBI_176541 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176542 biolink:ChemicalEntity omega-hydroxy-very-long-chain fatty acid anion An ω-hydroxy fatty acid anion obtained by deprotonation of the carboxy group of any ω-hydroxy-very-long-chain fatty acid; major species at pH 7.3. Graph an omega-hydroxy-very-long-chain fatty acid|omega-hydroxy very-long-chain fatty acid anion|omega-hydroxy very-long-chain fatty acid anions|omega-hydroxy-very-long-chain fatty acid anions|omega-hydroxy-very-long-chain fatty acid(1-) an omega-hydroxy-very-long-chain fatty acid|omega-hydroxy very-long-chain fatty acid anion|omega-hydroxy very-long-chain fatty acid anions|omega-hydroxy-very-long-chain fatty acid anions|omega-hydroxy-very-long-chain fatty acid(1-) http://purl.obolibrary.org/obo/CHEBI_176542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17655 biolink:ChemicalEntity 4-hydroxy-2-oxopentanoic acid cas:3318-73-8|kegg.compound:C03589|umbbd.compound:c0101 Graph 4-Hydroxy-2-oxopentanoate|4-Hydroxy-2-oxovalerate|4-hydroxy-2-oxopentanoic acid 4-Hydroxy-2-oxopentanoate|4-hydroxy-2-oxopentanoic acid 4-Hydroxy-2-oxopentanoate|4-Hydroxy-2-oxovalerate|4-hydroxy-2-oxopentanoic acid http://purl.obolibrary.org/obo/CHEBI_17655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17656 biolink:ChemicalEntity (R)-mandelic acid The (R)-enantiomer of mandelic acid. cas:611-71-2|gmelin:69018|kegg.compound:C01983|metacyc.compound:CPD-121|pdb-ccd:RMN|pubmed:11196078|reaxys:2691094 Graph (-)-(R)-mandelic acid|(-)-alpha-hydroxyphenylacetic acid|(-)-mandelic acid|(2R)-2-hydroxy-2-phenylacetic acid|(2R)-hydroxy(phenyl)acetic acid|(R)-2-Hydroxy-2-phenylacetic acid|(R)-MANDELIC ACID|(R)-Mandelic acid|(R)-Mandelsaeure|(R)-alpha-hydroxybenzeneacetic acid|(R)-alpha-hydroxyphenylacetic acid|D(-)-mandelic acid|D-2-phenylglycolic acid|D-mandelic acid (2R)-hydroxy(phenyl)acetic acid (-)-(R)-mandelic acid|(-)-alpha-hydroxyphenylacetic acid|(-)-mandelic acid|(2R)-2-hydroxy-2-phenylacetic acid|(2R)-hydroxy(phenyl)acetic acid|(R)-2-Hydroxy-2-phenylacetic acid|(R)-MANDELIC ACID|(R)-Mandelic acid|(R)-Mandelsaeure|(R)-alpha-hydroxybenzeneacetic acid|(R)-alpha-hydroxyphenylacetic acid|D(-)-mandelic acid|D-2-phenylglycolic acid|D-mandelic acid http://purl.obolibrary.org/obo/CHEBI_17656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176578 biolink:ChemicalEntity cobalt-59 atom A stable isotope of cobalt with relative atomic mass 58.93319, 100 atom percent natural abundance and nuclear spin 7/2. pubmed:10617436|pubmed:10940985|pubmed:11421673|pubmed:11528329|pubmed:12943912|pubmed:19150229|pubmed:19421527|pubmed:25069794|pubmed:25169133|pubmed:26066447|pubmed:26641288|pubmed:27355901|pubmed:30137661|pubmed:31367328|pubmed:32478347 Graph ((59)Co)cobalt|(59)27Co|(59)Co|Co-59|cobalt, isotope of mass 59|cobalt-(59)Co|cobalt-59 ((59)Co)cobalt ((59)Co)cobalt|(59)27Co|(59)Co|Co-59|cobalt, isotope of mass 59|cobalt-(59)Co|cobalt-59 http://purl.obolibrary.org/obo/CHEBI_176578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17658 biolink:ChemicalEntity tylosin A macrolide antibiotic that is tylonolide having mono- and diglycosyl moieties attached to two of its hydroxy groups. It is found naturally as a fermentation product of Streptomyces fradiae. cas:1401-69-0|hmdb:HMDB0034108|kegg.compound:C01457|kegg.drug:D02490|lipidmaps:LMPK04000004|metacyc.compound:TYLOSIN|patent:US2004082524|pdb-ccd:TYK|pubmed:18836909|pubmed:23013044|pubmed:23352520|pubmed:23397987|pubmed:23398744|pubmed:23928021|pubmed:23985521|pubmed:24063615|pubmed:24113548|pubmed:24201036|pubmed:24270892|pubmed:24393633|pubmed:7867337|reaxys:4651020|wikipedia.en:Tylosin Graph Tylan|Tylocine|Tylosin|Tylosin A|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2,3-di-O-methyl-beta-D-allopyranoside|tilosina|tylosin|tylosine|tylosinum [(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2,3-di-O-methyl-beta-D-allopyranoside Tylan|Tylocine|Tylosin|Tylosin A|[(2R,3R,4E,6E,9R,11R,12S,13S,14R)-12-[3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyloxy]-2-ethyl-14-hydroxy-5,9,13-trimethyl-8,16-dioxo-11-(2-oxoethyl)oxacyclohexadeca-4,6-dien-3-yl]methyl 6-deoxy-2,3-di-O-methyl-beta-D-allopyranoside|tilosina|tylosin|tylosine|tylosinum http://purl.obolibrary.org/obo/CHEBI_17658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17659 biolink:ChemicalEntity UDP beilstein:64707|cas:58-98-0|drugbank:DB03435|kegg.compound:C00015|kegg.glycan:G10619|knapsack:C00007313|wikipedia.en:Uridine_Diphosphate Graph UDP|Uridine 5'-diphosphate|Uridine diphosphate|uridine 5'-(trihydrogen diphosphate) uridine 5'-(trihydrogen diphosphate) UDP|Uridine 5'-diphosphate|Uridine diphosphate|uridine 5'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176593 biolink:ChemicalEntity 2-oxohexadecanoate A 2-oxo monocarboxylic acid anion that is the conjugate base of 2-oxohexadecanoic acid arising from the deprotonation of the carboxy group; major species at pH 7.3. Graph 2-ketopalmitate|2-oxohexadecanoate|2-oxopalmitate 2-oxohexadecanoate 2-ketopalmitate|2-oxohexadecanoate|2-oxopalmitate http://purl.obolibrary.org/obo/CHEBI_176593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17660 biolink:ChemicalEntity N(6)-dimethylallyladenine A 6-isopentenylaminopurine in which has the isopentenyl double bond is located between the 2 and 3 positions of the isopentenyl group. bpdb:1627|cas:2365-40-4|drugbank:DB08768|kegg.compound:C04083|knapsack:C00000094|pdb-ccd:ZIP|reaxys:526804 Graph (3-methyl-but-2-enyl)-(7(9)H-purin-6-yl)-amine|6-(3-methyl-2-buten-1-ylamino)purine|6-(gamma,gamma-Dimethylallylamino)purine|N(6)-(Delta2-isopentenyl)adenine|N(6)-dimethylallyladenine|N-(3-methylbut-2-en-1-yl)-7H-purin-6-amine|N-(3-methylbut-2-en-1-yl)-9H-purin-6-amine|N6-(3-Methylbut-2-enyl)adenine|N6-(3-methylbut-2-enyl)adenine|N6-(delta2-Isopentenyl)-adenine|N6-(delta2-isopentenyl)adenine|N6-Dimethylallyladenine|N6-isopentenyladenine|iP|isopentenyl adenine|isopentenyladenine N-(3-methylbut-2-en-1-yl)-7H-purin-6-amine|N-(3-methylbut-2-en-1-yl)-9H-purin-6-amine (3-methyl-but-2-enyl)-(7(9)H-purin-6-yl)-amine|6-(3-methyl-2-buten-1-ylamino)purine|6-(gamma,gamma-Dimethylallylamino)purine|N(6)-(Delta2-isopentenyl)adenine|N(6)-dimethylallyladenine|N-(3-methylbut-2-en-1-yl)-7H-purin-6-amine|N-(3-methylbut-2-en-1-yl)-9H-purin-6-amine|N6-(3-Methylbut-2-enyl)adenine|N6-(3-methylbut-2-enyl)adenine|N6-(delta2-Isopentenyl)-adenine|N6-(delta2-isopentenyl)adenine|N6-Dimethylallyladenine|N6-isopentenyladenine|iP|isopentenyl adenine|isopentenyladenine http://purl.obolibrary.org/obo/CHEBI_17660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17661 biolink:ChemicalEntity GDP-6-deoxy-alpha-D-mannose kegg.compound:C03117|pdb-ccd:GDR Graph GDP-6-deoxy-D-mannose|GDP-D-rhamnose|guanosine 5'-[3-(6-deoxy-alpha-D-mannopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(6-deoxy-alpha-D-mannopyranosyl) dihydrogen diphosphate] GDP-6-deoxy-D-mannose|GDP-D-rhamnose|guanosine 5'-[3-(6-deoxy-alpha-D-mannopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_17661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17663 biolink:ChemicalEntity (R)-3-[(R)-3-hydroxybutanoyloxy]butanoic acid A carboxylic ester arising from the formal condensation of the alcoholic hydroxy group of one molecule of (3R)-3-hydroxybutanoic acid with the the carboxylic acid group of another. It is a sex pheromone in the European spider Linyphia triangularis. kegg.compound:C04546|pubmed:17810206|reaxys:6387163 Graph (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoic acid (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoic acid (3R)-3-{[(3R)-3-hydroxybutanoyl]oxy}butanoic acid http://purl.obolibrary.org/obo/CHEBI_17663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17664 biolink:ChemicalEntity alkylaminium A primary ammonium ion obtained by protonation of the amino goup of any alkylamine; major species at pH 7.3. metacyc.compound:Alkylamines|pubmed:9989229 Graph alkylamine cation|alkylaminium cation|alkylaminium(1+)|an alkylamine alkylamine cation|alkylaminium cation|alkylaminium(1+)|an alkylamine http://purl.obolibrary.org/obo/CHEBI_17664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17665 biolink:ChemicalEntity alpha-D-glucose 6-phosphate A D-glucopyranose 6-phosphate where α-D-glucose is the sugar component. beilstein:1914852|drugbank:DB02007|kegg.compound:C00668|pdb-ccd:G6P Graph 6-O-phosphono-alpha-D-glucopyranose|ALPHA-D-GLUCOSE-6-PHOSPHATE|alpha-D-Glucose 6-phosphate|alpha-D-glucopyranose 6-(dihydrogen phosphate) alpha-D-glucopyranose 6-(dihydrogen phosphate) 6-O-phosphono-alpha-D-glucopyranose|ALPHA-D-GLUCOSE-6-PHOSPHATE|alpha-D-Glucose 6-phosphate|alpha-D-glucopyranose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17665 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17666 biolink:ChemicalEntity L-ribulose 5-phosphate beilstein:6862306|cas:2922-69-2|cas:4151-19-3|kegg.compound:C01101|knapsack:C00019543|pdb-ccd:HMS Graph 5-O-phosphono-L-erythro-pent-2-ulose|5-O-phosphono-L-ribulose|L-Ribulose 5-phosphate|L-erythro-pent-2-ulose 5-(dihydrogen phosphate)|L-ribulose 5-(dihydrogen phosphate) L-Ribulose 5-phosphate|L-erythro-pent-2-ulose 5-(dihydrogen phosphate)|L-ribulose 5-(dihydrogen phosphate) 5-O-phosphono-L-erythro-pent-2-ulose|5-O-phosphono-L-ribulose|L-Ribulose 5-phosphate|L-erythro-pent-2-ulose 5-(dihydrogen phosphate)|L-ribulose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17667 biolink:ChemicalEntity 3-hydroxy-3-methyl-2-oxobutanoic acid kegg.compound:C04181|lipidmaps:LMFA01020277 Graph 2-oxo-3-hydroxyisovaleric acid|3-Hydroxy-3-methyl-2-oxobutanoate|3-Hydroxy-3-methyl-2-oxobutanoic acid|3-hydroxy-3-methyl-2-oxobutanoic acid 3-Hydroxy-3-methyl-2-oxobutanoic acid|3-hydroxy-3-methyl-2-oxobutanoic acid 2-oxo-3-hydroxyisovaleric acid|3-Hydroxy-3-methyl-2-oxobutanoate|3-Hydroxy-3-methyl-2-oxobutanoic acid|3-hydroxy-3-methyl-2-oxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_17667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17668 biolink:ChemicalEntity ribonucleoside diphosphat kegg.compound:C03723 Graph Ribonucleoside diphosphate|ribonucleoside diphosphates Ribonucleoside diphosphate|ribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_17668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17670 biolink:ChemicalEntity 1,2-diacyl-3-O-(alpha-D-glucosyl)-sn-glycerol A class of glucoglycerolipids that consists of any 1,2-diacyl-sn-glycerol having an α-D-glucosyl residue attached at position 3. kegg.compound:C06364 Graph 1,2-Diacyl-3-O-(alpha-D-glucopyranosyl)-sn-glycerol|1,2-diacyl-3-(alpha-D-glucopyranosyl)-sn-glycerol|a 1,2-diacyl-3-O-(alpha-D-glucopyranosyl)-sn-glycerol 1,2-diacyl-3-(alpha-D-glucopyranosyl)-sn-glycerol 1,2-Diacyl-3-O-(alpha-D-glucopyranosyl)-sn-glycerol|1,2-diacyl-3-(alpha-D-glucopyranosyl)-sn-glycerol|a 1,2-diacyl-3-O-(alpha-D-glucopyranosyl)-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_17670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17671 biolink:ChemicalEntity 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde kegg.compound:C04797 Graph (2E,4Z,7S)-7-amino-5-formyl-2-hydroxyocta-2,4-dienedioic acid|5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (2E,4Z,7S)-7-amino-5-formyl-2-hydroxyocta-2,4-dienedioic acid (2E,4Z,7S)-7-amino-5-formyl-2-hydroxyocta-2,4-dienedioic acid|5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde http://purl.obolibrary.org/obo/CHEBI_17671 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17672 biolink:ChemicalEntity carbamoyl phosphate cas:590-55-6|kegg.compound:C00169|knapsack:C00007513|pdb-ccd:CP Graph Carbamoyl phosphate|Carbamyl phosphate|PHOSPHORIC ACID MONO(FORMAMIDE)ESTER|aminocarbonyl dihydrogen phosphate|carbamic phosphoric monoanhydride|carbamoyl dihydrogen phosphate|monocarbamoyl phosphate Carbamoyl phosphate|carbamoyl dihydrogen phosphate Carbamoyl phosphate|Carbamyl phosphate|PHOSPHORIC ACID MONO(FORMAMIDE)ESTER|aminocarbonyl dihydrogen phosphate|carbamic phosphoric monoanhydride|carbamoyl dihydrogen phosphate|monocarbamoyl phosphate http://purl.obolibrary.org/obo/CHEBI_17672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17675 biolink:ChemicalEntity Watasenia luciferin kegg.compound:C02894 Graph 4-{8-benzyl-3-oxo-2-[4-(sulfooxy)benzyl]-3,7-dihydroimidazo[1,2-a]pyrazin-6-yl}phenyl hydrogen sulfate|8-(phenylmethyl)-6-(4-sulfooxyphenyl)-2-[(4-sulfooxyphenyl)methyl]imidazo[1,2-a]-pyrazin-3(7H)-one|Watasenia luciferin|watasemiluciferin 4-{8-benzyl-3-oxo-2-[4-(sulfooxy)benzyl]-3,7-dihydroimidazo[1,2-a]pyrazin-6-yl}phenyl hydrogen sulfate 4-{8-benzyl-3-oxo-2-[4-(sulfooxy)benzyl]-3,7-dihydroimidazo[1,2-a]pyrazin-6-yl}phenyl hydrogen sulfate|8-(phenylmethyl)-6-(4-sulfooxyphenyl)-2-[(4-sulfooxyphenyl)methyl]imidazo[1,2-a]-pyrazin-3(7H)-one|Watasenia luciferin|watasemiluciferin http://purl.obolibrary.org/obo/CHEBI_17675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17676 biolink:ChemicalEntity 2-(beta-D-glucopyranosyluronic acid)-D-glucuronic acid kegg.compound:C04354|kegg.glycan:G00301 Graph (1->2)-beta-D-Glucuronosyl-D-glucuronate|(beta-D-glucopyranosyloxyuronic acid)-(1->2)-beta-D-glucopyranuronic acid|1,2-beta-D-Glucuronosyl-D-glucuronate|1,2-beta-D-glucuronosyl-D-glucuronate|2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranuronic acid (beta-D-glucopyranosyloxyuronic acid)-(1->2)-beta-D-glucopyranuronic acid|2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranuronic acid (1->2)-beta-D-Glucuronosyl-D-glucuronate|(beta-D-glucopyranosyloxyuronic acid)-(1->2)-beta-D-glucopyranuronic acid|1,2-beta-D-Glucuronosyl-D-glucuronate|1,2-beta-D-glucuronosyl-D-glucuronate|2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranuronic acid http://purl.obolibrary.org/obo/CHEBI_17676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17677 biolink:ChemicalEntity CTP beilstein:71190|cas:65-47-4|drugbank:DB02431|gmelin:723598|kegg.compound:C00063|knapsack:C00019639|pdb-ccd:CTP Graph 5'-CTP|CTP|CYTIDINE-5'-TRIPHOSPHATE|Cytidine 5'-triphosphate|Cytidine triphosphate|H4ctp|cytidine 5'-(tetrahydrogen triphosphate) cytidine 5'-(tetrahydrogen triphosphate) 5'-CTP|CTP|CYTIDINE-5'-TRIPHOSPHATE|Cytidine 5'-triphosphate|Cytidine triphosphate|H4ctp|cytidine 5'-(tetrahydrogen triphosphate) http://purl.obolibrary.org/obo/CHEBI_17677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17678 biolink:ChemicalEntity 2'-hydroxyformononetin A member of the class of 4'-methoxyisoflavones that is formononetin with a hydroxy group at the 2'position. agr:IND93034681|cas:1890-99-9|hmdb:HMDB0031720|kegg.compound:C02920|knapsack:C00000257|lipidmaps:LMPK12050081|metacyc.compound:2-HYDROXYFORMONONETIN|pubmed:1912490|pubmed:1915347|pubmed:2306102|pubmed:9525107|pubmed:9790908|reaxys:1292487 Graph 2'-Hydroformononetin|2'-Hydroxyformononetin|7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-chromen-4-one|Xenognosin B 7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-chromen-4-one 2'-Hydroformononetin|2'-Hydroxyformononetin|7-hydroxy-3-(2-hydroxy-4-methoxyphenyl)-4H-chromen-4-one|Xenognosin B http://purl.obolibrary.org/obo/CHEBI_17678 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176780 biolink:ChemicalEntity dihydroactinidiolide cas:15356-74-8|chemspider:25323|hmdb:HMDB0035240 Graph 4,4,7a-trimethyl-6,7-dihydro-5H-1-benzouran-2-one|Actinidiolide, dihydro- 4,4,7a-trimethyl-6,7-dihydro-5H-1-benzouran-2-one 4,4,7a-trimethyl-6,7-dihydro-5H-1-benzouran-2-one|Actinidiolide, dihydro- http://purl.obolibrary.org/obo/CHEBI_176780 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176783 biolink:ChemicalEntity vitamin C Any member of a group of vitamers that belong to the chemical structural class called butenolides that exhibit biological activity against vitamin C deficiency in animals. The vitamers include L-ascorbic acid and its salt, ionized and oxidized forms. pmc:PMC8088531|pubmed:21885436|pubmed:33916257|pubmed:34064549|wikipedia.en:Vitamin_C Graph Vitamin C|vitamin C vitamer|vitamin C vitamers|vitamina C|vitamine C|vitaminum C Vitamin C|vitamin C vitamer|vitamin C vitamers|vitamina C|vitamine C|vitaminum C http://purl.obolibrary.org/obo/CHEBI_176783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176784 biolink:ChemicalEntity setiptiline(1+) A tertiary ammonium ion that is the conjugate acid of setiptiline obtained by protonation of the tertiary amino group. Major microspecies at pH 7.3. Graph 2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridin-2-ium|setiptiline cation 2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridin-2-ium 2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridin-2-ium|setiptiline cation http://purl.obolibrary.org/obo/CHEBI_176784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176787 biolink:ChemicalEntity dizocilpine(1+) A secondary ammonium ion that is the conjugate acid of dizocilpine obtained by protonation of the secondary amino group. Major microspecies at pH 7.3. Graph (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulen-12-ium|dizocilpine cation (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulen-12-ium (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulen-12-ium|dizocilpine cation http://purl.obolibrary.org/obo/CHEBI_176787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176788 biolink:ChemicalEntity dizocilpine maleate A maleate salt obtained by reaction of dizocilpine with one equivalent of maleic acid. cas:77086-22-7|cba:528717|kegg.drug:D03878|pubmed:10188935|pubmed:11360666|pubmed:12130706|pubmed:12373737|pubmed:12457939|pubmed:12782248|pubmed:1442099|pubmed:1456051|pubmed:16958587|pubmed:16959422|pubmed:18421852|pubmed:22954112|pubmed:7539897|pubmed:7719723|pubmed:7813038|pubmed:7867763|pubmed:7870315|pubmed:7969899|pubmed:8743739|pubmed:9027866|pubmed:9037536|pubmed:9135101|pubmed:9384406|pubmed:9483502|pubmed:9730774 Graph (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulene (2Z)-but-2-enedioate|MK 801|MK-801 (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulene (2Z)-but-2-enedioate (5S,10R)-5-methyl-10,11-dihydro-5H-5,10-epiminodibenzo[a,d][7]annulene (2Z)-but-2-enedioate|MK 801|MK-801 http://purl.obolibrary.org/obo/CHEBI_176788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17679 biolink:ChemicalEntity 5-hydroxybenzimidazolylcob(I)amide Cobamide in which 5-hydroxy-1H-benzimidazole is attached by a glycosyl link from its N-1 to the C-1 of the ribose moiety. kegg.compound:C04054 Graph 5-Hydroxybenzimidazolylcob(I)amide|5-hydroxybenzimidazolylcobamide 5-Hydroxybenzimidazolylcob(I)amide|5-hydroxybenzimidazolylcobamide http://purl.obolibrary.org/obo/CHEBI_17679 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17680 biolink:ChemicalEntity D-glucose 1,6-bisphosphate cas:10139-18-1|pubmed:2534526|pubmed:6271121 Graph 2,6-di-O-phosphono-D-glucose|D-Glucose 1,6-biphosphate|D-Glucose 1,6-bisphosphate|D-glucose 1,6-bis(dihydrogen phosphate) 2,6-di-O-phosphono-D-glucose|D-glucose 1,6-bis(dihydrogen phosphate) 2,6-di-O-phosphono-D-glucose|D-Glucose 1,6-biphosphate|D-Glucose 1,6-bisphosphate|D-glucose 1,6-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176803 biolink:ChemicalEntity presqualene monophosphate(2-) A double charged organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of presqualene monophosphate. Major species at pH 7.3. pubmed:16464866|pubmed:23568778 Graph presqualene monophosphate dianion|presqualene phosphate|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methyl phosphate {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methyl phosphate presqualene monophosphate dianion|presqualene phosphate|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methyl phosphate http://purl.obolibrary.org/obo/CHEBI_176803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176809 biolink:ChemicalEntity cis-alpha-bergamotene An α-bergamotene that has cis-configuration. It can either be the (1R,5R,6R)-isomer or the (1S,5S,6S)-isomer. agr:IND20451409|agr:IND20482665|agr:IND22016624|agr:IND605429373|agr:IND606363892|cas:18252-46-5|chemspider:10379953|knapsack:C00029970|pubmed:11251117|pubmed:11345708|pubmed:11504033|pubmed:15133153|pubmed:15245414|pubmed:16367970|pubmed:16461381|pubmed:17561925|pubmed:17850230|pubmed:22224298|pubmed:22474938 Graph alpha-cis-bergamotene|cis-alpha-bergamotene|rel-(1R,5R,6R)-2,6-dimethyl-6-(4-methylpent-3-en-1-yl)bicyclo[3.1.1]hept-2-ene rel-(1R,5R,6R)-2,6-dimethyl-6-(4-methylpent-3-en-1-yl)bicyclo[3.1.1]hept-2-ene alpha-cis-bergamotene|cis-alpha-bergamotene|rel-(1R,5R,6R)-2,6-dimethyl-6-(4-methylpent-3-en-1-yl)bicyclo[3.1.1]hept-2-ene http://purl.obolibrary.org/obo/CHEBI_176809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17681 biolink:ChemicalEntity pyridine-2,6-diol cas:626-06-2|kegg.compound:C03056|umbbd.compound:c0473 Graph 2,6-Dihydroxypyridine|2,6-dihydroxypyridine|pyridine-2,6-diol pyridine-2,6-diol 2,6-Dihydroxypyridine|2,6-dihydroxypyridine|pyridine-2,6-diol http://purl.obolibrary.org/obo/CHEBI_17681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17682 biolink:ChemicalEntity benzoin A ketone that consists of acetophenone bearing hydroxy and phenyl substituents at the α-position. The parent of the class of benzoins. cas:119-53-9|drugcentral:4663|hmdb:HMDB0032039|kegg.compound:C01408|pubmed:15828829|pubmed:16107154|pubmed:17399985|reaxys:391839|wikipedia.en:Benzoin Graph 2-Hydroxy-1,2-diphenylethanone|2-Hydroxy-2-phenylacetophenone|2-hydroxy-1,2-diphenylethanone|Benzoin|Benzoylphenylcarbinol|Hydroxy-2-phenyl acetophenone|PhCH(OH)COPh|PhCOCH(OH)Ph|Phenyl-alpha-hydroxybenzyl ketone|Phenylbenzoyl carbinol|alpha-Hydroxy-alpha-phenylacetophenone|alpha-Hydroxybenzyl phenyl ketone|alpha-hydroxy-alpha-phenylacetophenone|benzoin|phenyl-alpha-hydroxybenzyl ketone 2-Hydroxy-1,2-diphenylethanone|2-hydroxy-1,2-diphenylethanone 2-Hydroxy-1,2-diphenylethanone|2-Hydroxy-2-phenylacetophenone|2-hydroxy-1,2-diphenylethanone|Benzoin|Benzoylphenylcarbinol|Hydroxy-2-phenyl acetophenone|PhCH(OH)COPh|PhCOCH(OH)Ph|Phenyl-alpha-hydroxybenzyl ketone|Phenylbenzoyl carbinol|alpha-Hydroxy-alpha-phenylacetophenone|alpha-Hydroxybenzyl phenyl ketone|alpha-hydroxy-alpha-phenylacetophenone|benzoin|phenyl-alpha-hydroxybenzyl ketone http://purl.obolibrary.org/obo/CHEBI_17682 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176838 biolink:ChemicalEntity vitamin B2 Any member of a group of vitamers that belong to the chemical structural class called flavins that exhibit biological activity against vitamin B2 deficiency. Symptoms associated with vitamin B2 deficiency include glossitis, seborrhea, angular stomaitis, cheilosis and photophobia. The vitamers include riboflavin and its phosphate derivatives (and includes their salt, ionised and hydrate forms). Graph vitamin B-2|vitamin B2|vitamins B2|vitamins B2 vitamer|vitamins B2 vitamers vitamin B-2|vitamin B2|vitamins B2|vitamins B2 vitamer|vitamins B2 vitamers http://purl.obolibrary.org/obo/CHEBI_176838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176839 biolink:ChemicalEntity vitamin B3 "Any member of a group of vitamers that belong to the chemical structural class called pyridines that exhibit biological activity against vitamin B3 deficiency. Vitamin B3 deficiency causes a condition known as pellagra whose symptoms include depression, dermatitis and diarrhea. The vitamers include nicotinic acid and nicotinamide (and their ionized and salt forms)." Graph vitamin B-3|vitamin B3|vitamin B3 vitamer|vitamin B3 vitamers|vitamins B3 vitamin B-3|vitamin B3|vitamin B3 vitamer|vitamin B3 vitamers|vitamins B3 http://purl.obolibrary.org/obo/CHEBI_176839 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17684 biolink:ChemicalEntity N-formyl-L-glutamate(2-) A doubly-charged N-acyl-L-α-amino acid anion resulting from deprotonation of both carboxy groups of N-formyl-L-glutamic acid. pubmed:16475788|pubmed:240684|pubmed:3308850|pubmed:4146796|pubmed:6414521 Graph (2S)-2-(formylamino)pentanedioate|(2S)-2-formamidopentanedioate|N-formyl-L-glutamate (2S)-2-formamidopentanedioate|N-formyl-L-glutamate (2S)-2-(formylamino)pentanedioate|(2S)-2-formamidopentanedioate|N-formyl-L-glutamate http://purl.obolibrary.org/obo/CHEBI_17684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176840 biolink:ChemicalEntity vitamin B5 Any member of a group of vitamers that belong to the chemical structural class called pantothenic acids that exhibit biological activity against vitamin B5 deficiency. Deficiency of vitamin B5 is rare due to its widespread distribution in whole grain cereals, legumes and meat. Symptoms associated with vitamin B5 deficiency are difficult to asses since they are subtle and resemble those of other B vitamin deficiencies. The vitamers include (R)-pantothenic acid and its ionized and salt forms. Graph vitamin B-5|vitamin B5|vitamin B5 vitamer|vitamin B5 vitamers|vitamins B5 vitamin B-5|vitamin B5|vitamin B5 vitamer|vitamin B5 vitamers|vitamins B5 http://purl.obolibrary.org/obo/CHEBI_176840 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176841 biolink:ChemicalEntity vitamin B7 Any member of a group of vitamers that belong to the chemical structural class called biotins that exhibit biological activity against vitamin B7 deficiency. Vitamin B7 deficiency is very rare in individuals who take a normal balanced diet. Foods rich in biotin are egg yolk, liver, cereals, vegetables (spinach, mushrooms) and rice. Symptoms associated with vitamin B7 deficiency include thinning hair, scaly skin rashes around eyes, nose and mouth, and brittle nails. The vitamers include biotin and its ionized and salt forms. Graph vitamin B-7|vitamin B7|vitamin B7 vitamer|vitamin B7 vitamers|vitamins B7 vitamin B-7|vitamin B7|vitamin B7 vitamer|vitamin B7 vitamers|vitamins B7 http://purl.obolibrary.org/obo/CHEBI_176841 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176842 biolink:ChemicalEntity vitamin B9 Any B-vitamin that exhibits biological activity against vitamin B9 deficiency. Vitamin B9 refers to the many forms of folic acid and its derivatives, including tetrahydrofolic acid (the active form), methyltetrahydrofolate (the primary form found in blood), methenyltetrahydrofolate, folinic acid amongst others. They are present in abundance in green leafy vegetables, citrus fruits, and animal products. Lack of vitamin B9 leads to anemia, a condition in which the body cannot produce sufficient number of red blood cells. Symptoms of vitamin B9 deficiency include fatigue, muscle weakness, and pale skin. Graph folate vitamer|folate vitamers|vitamin B-9|vitamin B9|vitamin B9 vitamer|vitamin B9 vitamers|vitamins B9 folate vitamer|folate vitamers|vitamin B-9|vitamin B9|vitamin B9 vitamer|vitamin B9 vitamers|vitamins B9 http://purl.obolibrary.org/obo/CHEBI_176842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176843 biolink:ChemicalEntity vitamin B12 Any member of a group of cobalamin vitamers that exhibit biological activity against vitamin B12 deficiency. Vitamin B12 deficiency is associated with low red blood cell count and anemia. The vitamers are found in foods such as cereals, meat, fish, and poultry. The vitamers include adenosylcobalamin, hydroxocobalamin, cyanocobalamin, aquacobalamin, nitritocobalamin and methylcobabalamin (also includes their ionized, salt and phosphate derivatives). Graph vitamin B-12|vitamin B12|vitamin B12 vitamer|vitamin B12 vitamers|vitamins B12 vitamin B-12|vitamin B12|vitamin B12 vitamer|vitamin B12 vitamers|vitamins B12 http://purl.obolibrary.org/obo/CHEBI_176843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17685 biolink:ChemicalEntity 3-hydroxyquinine beilstein:94386|cas:78549-61-8|kegg.compound:C07344 Graph (8alpha,9R)-6'-methoxycinchonan-3,9-diol|3-Hydroxyquinine (8alpha,9R)-6'-methoxycinchonan-3,9-diol (8alpha,9R)-6'-methoxycinchonan-3,9-diol|3-Hydroxyquinine http://purl.obolibrary.org/obo/CHEBI_17685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176869 biolink:ChemicalEntity aloenin cas:38412-46-3|chemspider:142526 Graph 6-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-methoxypyran-2-one 6-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-methoxypyran-2-one 6-[4-hydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-methoxypyran-2-one http://purl.obolibrary.org/obo/CHEBI_176869 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17687 biolink:ChemicalEntity glycocholic acid A bile acid glycine conjugate having cholic acid as the bile acid component. cas:475-31-0|drugbank:DB02691|hmdb:HMDB0000138|kegg.compound:C01921|knapsack:C00030410|lincs.smallmolecule:LSM-3222|lipidmaps:LMST05030001|metacyc.compound:GLYCOCHOLIC_ACID|pdb-ccd:GCH|pubmed:22770225|reaxys:2955826|wikipedia.en:Glycocholic_acid Graph 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oylglycine|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oylglycine|GLYCOCHOLIC ACID|Glycocholic acid|N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)glycine|N-[(3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycine|N-choloylglycine N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)glycine 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oylglycine|3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oylglycine|GLYCOCHOLIC ACID|Glycocholic acid|N-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholan-24-oyl)glycine|N-[(3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl]glycine|N-choloylglycine http://purl.obolibrary.org/obo/CHEBI_17687 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17688 biolink:ChemicalEntity (S)-nicotine A 3-(1-methylpyrrolidin-2-yl)pyridine in which the chiral centre has S-configuration. The naturally occurring and most active enantiomer of nicotine, isolated from Nicotiana tabacum. beilstein:3604351|bpdb:485|cas:54-11-5|drugbank:DB00184|drugcentral:1920|hmdb:HMDB0001934|kegg.compound:C00745|kegg.drug:D03365|knapsack:C00002057|lincs.smallmolecule:LSM-2093|metacyc.compound:NICOTINE|pdb-ccd:NCT|pubmed:11209966|pubmed:11322615|pubmed:11406005|pubmed:11719700|pubmed:11768184|pubmed:11821649|pubmed:11851194|pubmed:12575980|pubmed:12692774|pubmed:12769614|pubmed:12850578|pubmed:12971663|pubmed:13590907|pubmed:14674846|pubmed:14761239|pubmed:14975706|pubmed:15019421|pubmed:15027713|pubmed:15251917|pubmed:15276225|pubmed:15380834|pubmed:15502843|pubmed:15527885|pubmed:15707677|pubmed:15734728|pubmed:15826609|pubmed:15894687|pubmed:15902919|pubmed:15960296|pubmed:15963341|pubmed:16059663|pubmed:16212709|pubmed:16333621|pubmed:16370520|pubmed:16496293|pubmed:17023324|pubmed:17206646|pubmed:17292347|pubmed:17350101|pubmed:17498763|pubmed:17504235|pubmed:17525204|pubmed:17560039|pubmed:17683794|pubmed:18380035|pubmed:18383130|pubmed:18490768|pubmed:18683238|pubmed:18685152|pubmed:18805442|pubmed:18922921|pubmed:19100291|pubmed:19100331|pubmed:19287496|pubmed:19389046|pubmed:19448649|pubmed:19465085|pubmed:19850423|pubmed:19954906|pubmed:21521420|pubmed:21636612|pubmed:21822688|pubmed:21945235|pubmed:21947355|pubmed:22030716|pubmed:22129149|pubmed:22218403|pubmed:22265518|pubmed:22331007|pubmed:22377934|pubmed:22459798|pubmed:22529223|pubmed:22530136|pubmed:27951416|pubmed:28187919|pubmed:28391535|pubmed:28574230|pubmed:28641297|pubmed:28678400|pubmed:28683421|pubmed:28686840|pubmed:28698187|pubmed:28700952|pubmed:28704277|pubmed:28710519|pubmed:28711472|pubmed:28714396|pubmed:28718768|pubmed:28718828|pubmed:28726253|pubmed:28735272|reaxys:82109|wikipedia.en:Nicotine Graph (-)-3-(1-Methyl-2-pyrrolidyl)pyridine|(-)-3-(N-Methylpyrrolidino)pyridine|(-)-nicotine|(R)-3-(1-Methyl-2-pyrrolidinyl)pyridine|(S)-(-)-nicotine|(S)-3-(1-methylpyrrolidin-2-yl)pyridine|(S)-3-(N-methylpyrrolidin-2-yl)pyridine|(S)-Nicotine|(S)-nicotine|1-Methyl-2-(3-pyridyl)pyrrolidine|3-(1-Methyl-2-pyrollidinyl)pyridine|3-(1-Methylpyrrolidin-2-yl)pyridine|3-(2-(N-methylpyrrolidinyl))pyridine|3-(N-methylpyrollidino)pyridine|3-[(2S)-1-methylpyrrolidin-2-yl]pyridine|L(-)-nicotine|L-3-(1-Methyl-2-pyrrolidyl)pyridine|L-Nicotine|Nicotine 3-[(2S)-1-methylpyrrolidin-2-yl]pyridine (-)-3-(1-Methyl-2-pyrrolidyl)pyridine|(-)-3-(N-Methylpyrrolidino)pyridine|(-)-nicotine|(R)-3-(1-Methyl-2-pyrrolidinyl)pyridine|(S)-(-)-nicotine|(S)-3-(1-methylpyrrolidin-2-yl)pyridine|(S)-3-(N-methylpyrrolidin-2-yl)pyridine|(S)-Nicotine|(S)-nicotine|1-Methyl-2-(3-pyridyl)pyrrolidine|3-(1-Methyl-2-pyrollidinyl)pyridine|3-(1-Methylpyrrolidin-2-yl)pyridine|3-(2-(N-methylpyrrolidinyl))pyridine|3-(N-methylpyrollidino)pyridine|3-[(2S)-1-methylpyrrolidin-2-yl]pyridine|L(-)-nicotine|L-3-(1-Methyl-2-pyrrolidyl)pyridine|L-Nicotine|Nicotine http://purl.obolibrary.org/obo/CHEBI_17688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17689 biolink:ChemicalEntity sphingosine-1-phosphocholine A phosphosphingolipid consisting of sphingosine having a phosphocholine moiety attached to its primary hydroxyl group. beilstein:7342520|lipidmaps:LMSP01060001|pubmed:14741383 Graph (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate|sphing-4-enine-1-phosphocholine|sphingosylphosphocholine betaine|sphingosylphosphorylcholine (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate|sphing-4-enine-1-phosphocholine|sphingosylphosphocholine betaine|sphingosylphosphorylcholine http://purl.obolibrary.org/obo/CHEBI_17689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176894 biolink:ChemicalEntity vitamin B6 phosphate anion Graph vitamin B-6 phosphate anion|vitamin B-6 phosphate anions|vitamin B6 phosphate anions vitamin B-6 phosphate anion|vitamin B-6 phosphate anions|vitamin B6 phosphate anions http://purl.obolibrary.org/obo/CHEBI_176894 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176905 biolink:ChemicalEntity 2'-deoxyuridine 3'-monophosphate(2-) A 2'-deoxyribonucleoside 3'-monophosphate(2−) obtained by deprotonation of the phosphate OH groups of 2'-deoxyuridine 3'-monophosphate (3'-dUMP); major species at pH 7.3. metacyc.compound:CPD-15393 Graph 2'-deoxy-3'-O-phosphonatouridine|2'-deoxy-3'-UMP(2-)|2'-deoxy-3'-uridylate|2'-deoxyuridine 3'-monophosphate dianion|3'-dUMP dianion|3'-dUMP(2-) 2'-deoxy-3'-O-phosphonatouridine 2'-deoxy-3'-O-phosphonatouridine|2'-deoxy-3'-UMP(2-)|2'-deoxy-3'-uridylate|2'-deoxyuridine 3'-monophosphate dianion|3'-dUMP dianion|3'-dUMP(2-) http://purl.obolibrary.org/obo/CHEBI_176905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17691 biolink:ChemicalEntity N-feruloylglycine kegg.compound:C02564 Graph N-Feruloylglycine|N-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]glycine|{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}acetic acid N-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]glycine|{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}acetic acid N-Feruloylglycine|N-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]glycine|{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}acetic acid http://purl.obolibrary.org/obo/CHEBI_17691 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176910 biolink:ChemicalEntity fatty acyl-L-carnitine Any O-acylcarnitine in which the carnitine component has L-configuration and the acyl group is a fatty acid. Graph O-fatty acyl-L-carnitine|a fatty acyl-L-carnitine O-fatty acyl-L-carnitine|a fatty acyl-L-carnitine http://purl.obolibrary.org/obo/CHEBI_176910 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176911 biolink:ChemicalEntity fatty acylcarnitine Any O-acylcarnitine in which the acyl group is a fatty acid and the carnitine component has configuration undefined. Graph http://purl.obolibrary.org/obo/CHEBI_176911 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17692 biolink:ChemicalEntity cis-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid cas:130073-64-2|kegg.compound:C04783|umbbd.compound:c0182 Graph Phthalate-4,5-cis-dihydrodiol|cis-4,5-Dihydroxycyclohexa-1(6),2-diene-1,2-dicarboxylate|rel-(4R,5S)-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid rel-(4R,5S)-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid Phthalate-4,5-cis-dihydrodiol|cis-4,5-Dihydroxycyclohexa-1(6),2-diene-1,2-dicarboxylate|rel-(4R,5S)-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17693 biolink:ChemicalEntity 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid kegg.compound:C04447 Graph 3-Carboxy-4-methoxy-N-methyl-2-pyridone|3-carboxy-4-methoxy-N-methyl-2-pyridone|4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid 3-Carboxy-4-methoxy-N-methyl-2-pyridone|3-carboxy-4-methoxy-N-methyl-2-pyridone|4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_17693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17694 biolink:ChemicalEntity dihydrolipoamide beilstein:1763332|cas:3884-47-7|gmelin:675797|kegg.compound:C00579 Graph 6,8-dimercaptooctanamide|6,8-disulfanyloctanamide|Dihydrolipoamide|Dihydrothioctamide|dihydrolipoamide 6,8-disulfanyloctanamide 6,8-dimercaptooctanamide|6,8-disulfanyloctanamide|Dihydrolipoamide|Dihydrothioctamide|dihydrolipoamide http://purl.obolibrary.org/obo/CHEBI_17694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17695 biolink:ChemicalEntity casbene A diterpene comprising bicyclo[12.1.0]pentadeca-2,6,10-triene having three methyl substituents located at the 3-, 7- and 11-positions as well as gem-dimethyl groups at the 15-position. kegg.compound:C01414|knapsack:C00000864|lipidmaps:LMPR0104290001|pubmed:16660566|pubmed:16662367|pubmed:16664817|reaxys:5269179 Graph (2E,6E,10E)-3,7,11,15,15-pentamethylbicyclo[12.1.0]pentadeca-2,6,10-triene|Casbene|casbene (2E,6E,10E)-3,7,11,15,15-pentamethylbicyclo[12.1.0]pentadeca-2,6,10-triene (2E,6E,10E)-3,7,11,15,15-pentamethylbicyclo[12.1.0]pentadeca-2,6,10-triene|Casbene|casbene http://purl.obolibrary.org/obo/CHEBI_17695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176954 biolink:ChemicalEntity 6-O-Methyldeacetylisoipecoside kegg.compound:C21566 Graph methyl (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate methyl (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate methyl (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_176954 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17696 biolink:ChemicalEntity isocyanuric acid The keto tautomer of cyanuric acid. cas:108-80-5|gmelin:101413|metacyc.compound:CYANURIC-ACID|patent:CN101830859|pubmed:15909931|reaxys:126982 Graph 1,3,5-triazinane-2,4,6-trione|1,3,5-triazine-2,4,6(1H,3H,5H)-trione|Isocyanursaeure|Isozyanursaeure|isocyanuric acid|s-triazine-2,4,6-trione 1,3,5-triazinane-2,4,6-trione 1,3,5-triazinane-2,4,6-trione|1,3,5-triazine-2,4,6(1H,3H,5H)-trione|Isocyanursaeure|Isozyanursaeure|isocyanuric acid|s-triazine-2,4,6-trione http://purl.obolibrary.org/obo/CHEBI_17696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176960 biolink:ChemicalEntity salicylic acyl beta-D-glucuronide (1-) hmdb:HMDB0010314|pubmed:3705620 Graph http://purl.obolibrary.org/obo/CHEBI_176960 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:176962 biolink:ChemicalEntity presqualene alcohol cas:31908-49-3|pubmed:16084728|pubmed:4399596|pubmed:5550251|pubmed:5550252 Graph presqualene alcohol|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methanol {(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methanol presqualene alcohol|{(1S,2S,3S)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methanol http://purl.obolibrary.org/obo/CHEBI_176962 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17697 biolink:ChemicalEntity N-acetylserotonin An N-acylserotonin resulting from the formal condensation of the primary amino group of serotonin with the carboxy group of acetic acid. cas:1210-83-9|drugbank:DB04275|hmdb:HMDB0001238|kegg.compound:C00978|lincs.smallmolecule:LSM-20977|metacyc.compound:N-ACETYL-SEROTONIN|pdb-ccd:ASE|pubmed:22585341|pubmed:22770225|pubmed:23994834|pubmed:24553937|pubmed:25386956|pubmed:25787187|pubmed:26079042|pubmed:26378484|pubmed:27562847|reaxys:479159|wikipedia.en:N-acetyl-serotonin Graph N-(2-(5-Hydroxy-1H-indol-3-yl)ethyl)acetamide|N-Acetyl-5-hydroxytryptamine|N-Acetylserotonin|N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide|N-acetylserotonin N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide N-(2-(5-Hydroxy-1H-indol-3-yl)ethyl)acetamide|N-Acetyl-5-hydroxytryptamine|N-Acetylserotonin|N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide|N-acetylserotonin http://purl.obolibrary.org/obo/CHEBI_17697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:176976 biolink:ChemicalEntity 1-salicylate O-glucuronide(1-) pubmed:3705620 Graph http://purl.obolibrary.org/obo/CHEBI_176976 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17698 biolink:ChemicalEntity chloramphenicol An organochlorine compound that is dichloro-substituted acetamide containing a nitrobenzene ring, an amide bond and two alcohol functions. beilstein:2225532|cas:56-75-7|chemspider:5744|drugbank:DB00446|drugcentral:589|hmdb:HMDB0014589|kegg.compound:C00918|kegg.drug:D00104|lincs.smallmolecule:LSM-5256|metacyc.compound:CHLORAMPHENICOL|patent:GB795131|patent:GB796901|patent:US2483871|patent:US2483884|patent:US2483892|patent:US2839577|pdb-ccd:CLM|pesticides:chloramphenicol|pubmed:11468347|pubmed:12217690|pubmed:16659995|pubmed:16897441|pubmed:17217404|pubmed:17692887|pubmed:17963326|pubmed:18559535|pubmed:18657290|pubmed:18794387|pubmed:23142491|pubmed:23317719|pubmed:23395526|pubmed:23494278|pubmed:23512826|pubmed:23698443|pubmed:657786|pubmed:6653106|pubmed:7040026|vsdb:1835|wikipedia.en:Chloramphenicol Graph (-)-chloramphenicol|2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide|Amphicol|CHLORAMPHENICOL|Chloramex|Chloramphenicol|Chlorocid|Chlorocol|Chloromycetin|D-(-)-2,2-dichloro-N-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenylethyl)acetamide|D-(-)-threo-1-p-nitrophenyl-2-dichloroacetylamino-1,3-propanediol|Econochlor|Fenicol|Globenicol|Halomycetin|Oleomycetin|Sificetina|chloramphenicol|chloramphenicolum|chlornitromycin|cloramfenicol|laevomycetinum|levomicetina|levomycetin 2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide (-)-chloramphenicol|2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide|Amphicol|CHLORAMPHENICOL|Chloramex|Chloramphenicol|Chlorocid|Chlorocol|Chloromycetin|D-(-)-2,2-dichloro-N-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenylethyl)acetamide|D-(-)-threo-1-p-nitrophenyl-2-dichloroacetylamino-1,3-propanediol|Econochlor|Fenicol|Globenicol|Halomycetin|Oleomycetin|Sificetina|chloramphenicol|chloramphenicolum|chlornitromycin|cloramfenicol|laevomycetinum|levomicetina|levomycetin http://purl.obolibrary.org/obo/CHEBI_17698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17699 biolink:ChemicalEntity 16-hydroxytabersonine kegg.compound:C11643|knapsack:C00024480 Graph 16-Hydroxytabersonine|methyl 16-hydroxy-2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate methyl 16-hydroxy-2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate 16-Hydroxytabersonine|methyl 16-hydroxy-2,3,6,7-tetradehydro-5alpha,12beta,19alpha-aspidospermidine-3-carboxylate http://purl.obolibrary.org/obo/CHEBI_17699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17700 biolink:ChemicalEntity undecan-2-one A dialkyl ketone with methyl and nonyl as the two alkyl groups. cas:112-12-9|drugbank:DB08688|hmdb:HMDB0033713|kegg.compound:C01875|knapsack:C00030758|lipidmaps:LMFA12000002|metacyc.compound:2-UNDECANONE|pdb-ccd:UOC|ppdb:1397|pubmed:17453350|pubmed:20931852|pubmed:21366058|pubmed:21738794|pubmed:23292923|reaxys:1749573|wikipedia.en:2-Undecanone Graph 2-Hendecanone|2-Undecanone|2-hendecanone|2-undecanone|Methyl nonyl ketone|Undecan-2-one|rue ketone|undecan-2-one undecan-2-one 2-Hendecanone|2-Undecanone|2-hendecanone|2-undecanone|Methyl nonyl ketone|Undecan-2-one|rue ketone|undecan-2-one http://purl.obolibrary.org/obo/CHEBI_17700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17701 biolink:ChemicalEntity benzenediol cas:12385-08-9|kegg.compound:C01785 Graph Benzenediol|benzenediol|dihydroxybenzene Benzenediol|benzenediol Benzenediol|benzenediol|dihydroxybenzene http://purl.obolibrary.org/obo/CHEBI_17701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17702 biolink:ChemicalEntity D-apiitol beilstein:4242143|cas:10592-17-3|kegg.compound:C01569 Graph (3S)-2-(hydroxymethyl)butane-1,2,3,4-tetrol|(S)-2-(hydroxymethyl)-1,2,3,4-butanetetrol|2-(hydroxymethyl)erythritol|3-(Hydroxymethyl)erythritol|D-Apiitol|D-apiitol (3S)-2-(hydroxymethyl)butane-1,2,3,4-tetrol (3S)-2-(hydroxymethyl)butane-1,2,3,4-tetrol|(S)-2-(hydroxymethyl)-1,2,3,4-butanetetrol|2-(hydroxymethyl)erythritol|3-(Hydroxymethyl)erythritol|D-Apiitol|D-apiitol http://purl.obolibrary.org/obo/CHEBI_17702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177023 biolink:ChemicalEntity somatostatin receptor agonist An agonist that binds to and activates somatostatin receptors. wikipedia.en:Somatostatin_receptor Graph SRIF agonist|SRIF agonists|SS-R agonist|SS-R agonists|SSR agonist|SSR agonists|SSTR agonist|SSTR agonists|somatostatin receptor agonists SRIF agonist|SRIF agonists|SS-R agonist|SS-R agonists|SSR agonist|SSR agonists|SSTR agonist|SSTR agonists|somatostatin receptor agonists http://purl.obolibrary.org/obo/CHEBI_177023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17703 biolink:ChemicalEntity 26-hydroxycholesterol An oxysterol that is cholesterol substituted at position 26 by a hydroxy group. beilstein:4708620|cas:13095-61-9|kegg.compound:C15610|lipidmaps:LMST01010057|pubmed:11504730|pubmed:14614521|pubmed:17872378|pubmed:17873880|pubmed:18503570|pubmed:19014385|pubmed:19761868|pubmed:34569656|pubmed:35379924|pubmed:35453148|pubmed:37380087|pubmed:38036881|pubmed:38414393|pubmed:38538623|pubmed:38574442|pubmed:38650656|pubmed:38732535 Graph 26-Hydroxycholesterol|26-hydroxycholesterol|27-Hydroxycholesterol|Cholest-5-ene-3beta,26-diol|Cholest-5-ene-3beta,27-diol|cholest-5-ene-3beta,26-diol cholest-5-ene-3beta,26-diol 26-Hydroxycholesterol|26-hydroxycholesterol|27-Hydroxycholesterol|Cholest-5-ene-3beta,26-diol|Cholest-5-ene-3beta,27-diol|cholest-5-ene-3beta,26-diol http://purl.obolibrary.org/obo/CHEBI_17703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17704 biolink:ChemicalEntity aspulvinone E A 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one in which the double bond adopts a Z-configuration. It is a marine metabolite isolated from the fungus Aspergillus terreus and exhibits antiviral activity. cas:49637-60-7|kegg.compound:C02006|pubmed:23411074 Graph (5Z)-4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2(5H)-one|(5Z)-4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one|Aspulvinone E (5Z)-4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one (5Z)-4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2(5H)-one|(5Z)-4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one|Aspulvinone E http://purl.obolibrary.org/obo/CHEBI_17704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17705 biolink:ChemicalEntity N(2)-succinyl-L-arginine An N-acyl-L-arginine resulting from the formal condensation of the α-amino group of L-arginine with one of the carboxy groups of succinic acid kegg.compound:C03296|metacyc.compound:CPD-421|pdb-ccd:SUG|reaxys:6977334 Graph (2S)-2-(3-Carboxypropanoylamino)-5-(diaminomethylideneamino)pentanoic acid|(2S)-5-carbamimidamido-2-[(3-carboxypropanoyl)amino]pentanoic acid|N(2)-(3-carboxypropanoyl)-L-arginine|N(alpha)-succinyl-L-arginine|N2-Succinyl-L-arginine|succinyl-arginine|succinylarginine (2S)-5-carbamimidamido-2-[(3-carboxypropanoyl)amino]pentanoic acid|N(2)-(3-carboxypropanoyl)-L-arginine (2S)-2-(3-Carboxypropanoylamino)-5-(diaminomethylideneamino)pentanoic acid|(2S)-5-carbamimidamido-2-[(3-carboxypropanoyl)amino]pentanoic acid|N(2)-(3-carboxypropanoyl)-L-arginine|N(alpha)-succinyl-L-arginine|N2-Succinyl-L-arginine|succinyl-arginine|succinylarginine http://purl.obolibrary.org/obo/CHEBI_17705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17706 biolink:ChemicalEntity Renilla luciferyl sulfate kegg.compound:C02555 Graph 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl hydrogen sulfate|Luciferyl sulfate 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl hydrogen sulfate 2,8-dibenzyl-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl hydrogen sulfate|Luciferyl sulfate http://purl.obolibrary.org/obo/CHEBI_17706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17707 biolink:ChemicalEntity glucuronoxylan D-glucuronate kegg.compound:C03866 Graph Glucuronoxylan|Glucuronoxylan D-glucuronate|glucuronoxylan D-glucuronate Glucuronoxylan|Glucuronoxylan D-glucuronate|glucuronoxylan D-glucuronate http://purl.obolibrary.org/obo/CHEBI_17707 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:17708 biolink:ChemicalEntity 1,6-dihydroxycyclohexa-2,4-dienecarboxylate cas:60463-06-1|kegg.compound:C04634 Graph 1,2-Dihydroxycyclohexa-3,5-diene-1-carboxylate|1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate|1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate|1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate 1,2-Dihydroxycyclohexa-3,5-diene-1-carboxylate|1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate|1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate http://purl.obolibrary.org/obo/CHEBI_17708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17709 biolink:ChemicalEntity 5'-adenylyl sulfate An adenosine 5'-phosphate having a sulfo group attached to one the phosphate OH groups. cas:485-84-7|drugbank:DB03708|kegg.compound:C00224|knapsack:C00007445|pdb-ccd:ADX Graph 5'-Adenylyl sulfate|5'-adenylyl hydrogen sulfate|ADENOSINE-5'-PHOSPHOSULFATE|APS|Adenosine 5'-phosphosulfate|Adenylylsulfate|adenosine phosphosulfate 5'-adenylyl hydrogen sulfate 5'-Adenylyl sulfate|5'-adenylyl hydrogen sulfate|ADENOSINE-5'-PHOSPHOSULFATE|APS|Adenosine 5'-phosphosulfate|Adenylylsulfate|adenosine phosphosulfate http://purl.obolibrary.org/obo/CHEBI_17709 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17710 biolink:ChemicalEntity (R)-mevalonic acid The (R)-enantiomer of mevalonic acid. cas:17817-88-8|drugbank:DB03518|kegg.compound:C00418|knapsack:C00001195|lipidmaps:LMFA01050352|reaxys:1722593|wikipedia.en:Mevalonic_acid Graph (-)-mevalonic acid|(3R)-3,5-dihydroxy-3-methylpentanoic acid|(3R)-3,5-dihydroxy-3-methylvaleric acid|(3R)-mevalonic acid|(R)-(-)-mevalonic acid|(R)-3,5-dihydroxy-3-methylpentanoic acid|(R)-3,5-dihydroxy-3-methylvaleric acid|D-mevalonic acid|R-MVA|R-mevalonic acid (3R)-3,5-dihydroxy-3-methylpentanoic acid (-)-mevalonic acid|(3R)-3,5-dihydroxy-3-methylpentanoic acid|(3R)-3,5-dihydroxy-3-methylvaleric acid|(3R)-mevalonic acid|(R)-(-)-mevalonic acid|(R)-3,5-dihydroxy-3-methylpentanoic acid|(R)-3,5-dihydroxy-3-methylvaleric acid|D-mevalonic acid|R-MVA|R-mevalonic acid http://purl.obolibrary.org/obo/CHEBI_17710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177104 biolink:ChemicalEntity (4E,8E,10E-d18:3)sphingosine chemspider:24823212|lipidmaps:LMSP01080013 Graph (2S,3R,4E,8E,10E)-2-aminooctadeca-4,8,10-triene-1,3-diol (2S,3R,4E,8E,10E)-2-aminooctadeca-4,8,10-triene-1,3-diol (2S,3R,4E,8E,10E)-2-aminooctadeca-4,8,10-triene-1,3-diol http://purl.obolibrary.org/obo/CHEBI_177104 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17711 biolink:ChemicalEntity nocardicin A cas:39391-39-4|kegg.compound:C01941|knapsack:C00018088 Graph Nocardicin A|O-{4-[(1Z)-2-{(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-ylamino}-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine O-{4-[(1Z)-2-{(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-ylamino}-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine Nocardicin A|O-{4-[(1Z)-2-{(3S)-1-[(R)-carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-ylamino}-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine http://purl.obolibrary.org/obo/CHEBI_17711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17712 biolink:ChemicalEntity 9H-xanthine An oxopurine in which the purine ring is substituted by oxo groups at positions 2 and 6 and N-9 is protonated. bpdb:2153|cas:69-89-6|gmelin:913730|hmdb:HMDB0000292|kegg.compound:C00385|pdb-ccd:XAN|pubmed:22770225|reaxys:609330 Graph 2,6-dihydroxypurine|2,6-dioxo-1,2,3,6-tetrahydropurine|3,9-dihydro-1H-purine-2,6-dione|9H-purine-2,6-(1H,3H)-dione|XANTHINE|Xan|Xanthine|purine-2(3H),6(1H)-dione|xanthine 3,9-dihydro-1H-purine-2,6-dione 2,6-dihydroxypurine|2,6-dioxo-1,2,3,6-tetrahydropurine|3,9-dihydro-1H-purine-2,6-dione|9H-purine-2,6-(1H,3H)-dione|XANTHINE|Xan|Xanthine|purine-2(3H),6(1H)-dione|xanthine http://purl.obolibrary.org/obo/CHEBI_17712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17713 biolink:ChemicalEntity 2'-deoxyadenosine 5'-monophosphate A purine 2'-deoxyribonucleoside 5'-monophosphate having adenine as the nucleobase. cas:653-63-4|hmdb:HMDB0000905|kegg.compound:C00360|metacyc.compound:DAMP|pdb-ccd:A3A|pubmed:8645724|reaxys:56028|wikipedia.en:Deoxyadenosine_monophosphate Graph 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE|2'-Deoxyadenosine 5'-monophosphate|2'-Deoxyadenosine 5'-phosphate|2'-dAMP|2'-deoxy-5'-adenosine monophosphate|2'-deoxy-5'-adenylic acid|2'-deoxy-AMP|2'-deoxyadenosine 5'-(dihydrogen phosphate)|2'-deoxyadenosine 5'-monophosphate|2'-deoxyadenosine monophosphate|2'-deoxyadenylic acid|Deoxyadenosine monophosphate|Deoxyadenylic acid|dAMP|deoxy-5'-adenylic acid|deoxy-AMP|deoxyadenosine 5'-monophosphate|deoxyadenosine 5'-phosphate 2'-deoxy-5'-adenylic acid 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE|2'-Deoxyadenosine 5'-monophosphate|2'-Deoxyadenosine 5'-phosphate|2'-dAMP|2'-deoxy-5'-adenosine monophosphate|2'-deoxy-5'-adenylic acid|2'-deoxy-AMP|2'-deoxyadenosine 5'-(dihydrogen phosphate)|2'-deoxyadenosine 5'-monophosphate|2'-deoxyadenosine monophosphate|2'-deoxyadenylic acid|Deoxyadenosine monophosphate|Deoxyadenylic acid|dAMP|deoxy-5'-adenylic acid|deoxy-AMP|deoxyadenosine 5'-monophosphate|deoxyadenosine 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_17713 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17715 biolink:ChemicalEntity quinoline-2,8-diol cas:15450-76-7|kegg.compound:C06342 Graph 2,8-Quinolinediol|2,8-dihydroxyquinoline|8-Hydroxycarbostyril|8-Hydroxycarbostyryl|Quinolin-2,8-diol|quinoline-2,8-diol quinoline-2,8-diol 2,8-Quinolinediol|2,8-dihydroxyquinoline|8-Hydroxycarbostyril|8-Hydroxycarbostyryl|Quinolin-2,8-diol|quinoline-2,8-diol http://purl.obolibrary.org/obo/CHEBI_17715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17716 biolink:ChemicalEntity lactose A glycosylglucose disaccharide, found most notably in milk, that consists of D-galactose and D-glucose fragments bonded through a β-1→4 glycosidic linkage. The glucose fragment can be in either the α- or β-pyranose form, whereas the galactose fragment can only have the β-pyranose form. cas:63-42-3|glygen:G74621DY|glytoucan:G74621DY|gmelin:882872|kegg.compound:C00243|kegg.drug:D00046|kegg.glycan:G10504|knapsack:C00001136|pubmed:1292745|pubmed:17329833|pubmed:18300214|pubmed:19053747|pubmed:19846069|pubmed:19913595|pubmed:20094999|pubmed:20503067|pubmed:20699559|pubmed:20873837|pubmed:20961532|pubmed:21403918|pubmed:2432147|pubmed:2456994|pubmed:28690131|pubmed:28807538|pubmed:6194884|pubmed:7574700|reaxys:1292745 Graph (+)-lactose|(Gal)1 (Glc)1|1-beta-D-Galactopyranosyl-4-D-glucopyranose|4-(beta-D-galactosido)-D-glucose|4-O-beta-D-galactopyranosyl-D-glucose|D-lactose|Galbeta1-4Glc|Lac|Laktobiose|Laktose|Milchzucker|Milk sugar|beta-D-Gal-(1->4)-D-Glc|beta-D-Galp-(1->4)-D-Glcp|beta-D-galactopyranosyl-(1->4)-D-glucopyranose|beta-Gal1,4-Glc|lactobiose|lactose|milk sugar beta-D-galactopyranosyl-(1->4)-D-glucopyranose (+)-lactose|(Gal)1 (Glc)1|1-beta-D-Galactopyranosyl-4-D-glucopyranose|4-(beta-D-galactosido)-D-glucose|4-O-beta-D-galactopyranosyl-D-glucose|D-lactose|Galbeta1-4Glc|Lac|Laktobiose|Laktose|Milchzucker|Milk sugar|beta-D-Gal-(1->4)-D-Glc|beta-D-Galp-(1->4)-D-Glcp|beta-D-galactopyranosyl-(1->4)-D-glucopyranose|beta-Gal1,4-Glc|lactobiose|lactose|milk sugar http://purl.obolibrary.org/obo/CHEBI_17716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17717 biolink:ChemicalEntity sulfoacetaldehyde cas:32797-12-9|kegg.compound:C00593|knapsack:C00000763 Graph 2-Sulfoacetaldehyde|2-oxoethanesulfonic acid|Sulfoacetaldehyde 2-oxoethanesulfonic acid 2-Sulfoacetaldehyde|2-oxoethanesulfonic acid|Sulfoacetaldehyde http://purl.obolibrary.org/obo/CHEBI_17717 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17719 biolink:ChemicalEntity beta-D-glucose 6-phosphate A D-glucopyranose 6-phosphate in which the anomeric centre has β-configuration. beilstein:1914853|drugbank:DB04122|hmdb:HMDB0003498|kegg.compound:C01172|metacyc.compound:GLC-6-P|pdb-ccd:BG6|pubmed:19443021|pubmed:31537530|reaxys:1914853 Graph 6-H2PO3Glcbeta|6-O-phosphono-beta-D-glucopyranose|BETA-D-GLUCOSE-6-PHOSPHATE|beta-D-Glucose 6-phosphate|beta-D-Glucose 6-phosphic acid|beta-D-glucopyranose 6-(dihydrogen phosphate)|beta-D-glucose 6-(dihydrogen phosphate) beta-D-glucopyranose 6-(dihydrogen phosphate) 6-H2PO3Glcbeta|6-O-phosphono-beta-D-glucopyranose|BETA-D-GLUCOSE-6-PHOSPHATE|beta-D-Glucose 6-phosphate|beta-D-Glucose 6-phosphic acid|beta-D-glucopyranose 6-(dihydrogen phosphate)|beta-D-glucose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17720 biolink:ChemicalEntity 2,3-bisphospho-D-glyceric acid The D-enantiomer of 2,3-bisphosphoglyceric acid. cas:138-81-8|hmdb:HMDB0001294|kegg.compound:C01159|metacyc.compound:23-DIPHOSPHOGLYCERATE|pdb-ccd:DG2|pubmed:1257232|pubmed:15882454|pubmed:2111310|pubmed:3702645|pubmed:625775|pubmed:685194|pubmed:7308813|pubmed:7376803|pubmed:8735521|pubmed:9708696|reaxys:1729440 Graph (2R)-2,3-bis(phosphonooxy)propanoic acid|2,3-BPG|2,3-Bisphospho-D-glycerate|2,3-Bisphosphoglyceric acid|2,3-Disphospho-D-glycerate|2,3-bisphospho-D-glycerate|2,3-diphosphoglyceric acid|2,3-disphospho-D-glycerate|D-Greenwald ester|DPG|Glyceric acid bis(dihydrogen phosphate)|Glyceric acid diphosphate (2R)-2,3-bis(phosphonooxy)propanoic acid (2R)-2,3-bis(phosphonooxy)propanoic acid|2,3-BPG|2,3-Bisphospho-D-glycerate|2,3-Bisphosphoglyceric acid|2,3-Disphospho-D-glycerate|2,3-bisphospho-D-glycerate|2,3-diphosphoglyceric acid|2,3-disphospho-D-glycerate|D-Greenwald ester|DPG|Glyceric acid bis(dihydrogen phosphate)|Glyceric acid diphosphate http://purl.obolibrary.org/obo/CHEBI_17720 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17721 biolink:ChemicalEntity (S,S,S)-nicotianamine The (S,S,S)-stereoisomer of nicotianamine. cas:34441-14-0|kegg.compound:C05324|knapsack:C00016287|metacyc.compound:CPD-463|pubmed:16245165|pubmed:18823453|reaxys:8163098|wikipedia.en:Nicotianamine Graph (2S)-1-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]azetidine-2-carboxylic acid|Nicotianamine (2S)-1-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]azetidine-2-carboxylic acid (2S)-1-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]azetidine-2-carboxylic acid|Nicotianamine http://purl.obolibrary.org/obo/CHEBI_17721 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17724 biolink:ChemicalEntity N,N-dimethylglycine An N-methylglycine that is glycine carrying two N-methyl substituents. cas:1118-68-9|drugbank:DB02083|gmelin:82215|hmdb:HMDB0000092|kegg.compound:C01026|metacyc.compound:DIMETHYL-GLYCINE|pdb-ccd:DMG|pubmed:17190852|pubmed:21228267|pubmed:22418088|pubmed:22510294|reaxys:1700261 Graph (dimethylamino)acetic acid|2-(Dimethylamino)acetic acid|Dimethylglycine|N,N-DIMETHYLGLYCINE|N,N-Dimethylaminoacetic acid|N,N-Dimethylglycine|N,N-dimethylglycine|N-Methylsarcosine N,N-DIMETHYLGLYCINE|N,N-Dimethylglycine|N,N-dimethylglycine (dimethylamino)acetic acid|2-(Dimethylamino)acetic acid|Dimethylglycine|N,N-DIMETHYLGLYCINE|N,N-Dimethylaminoacetic acid|N,N-Dimethylglycine|N,N-dimethylglycine|N-Methylsarcosine http://purl.obolibrary.org/obo/CHEBI_17724 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177257 biolink:ChemicalEntity Isoleucyl-Threonine chemspider:16568328|hmdb:HMDB0028917 Graph 2-[(2-amino-3-methylpentanoyl)amino]-3-hydroxybutanoic acid 2-[(2-amino-3-methylpentanoyl)amino]-3-hydroxybutanoic acid 2-[(2-amino-3-methylpentanoyl)amino]-3-hydroxybutanoic acid http://purl.obolibrary.org/obo/CHEBI_177257 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17726 biolink:ChemicalEntity [Glu(-Cys)]n-Gly kegg.compound:C02471 Graph (gamma-Glutamylcysteine)n-glycine|Poly(gamma-glutamylcysteine)glycine|[Glu(-Cys)]n-Gly|poly(gamma-glutamylcysteine)glycine (gamma-Glutamylcysteine)n-glycine|Poly(gamma-glutamylcysteine)glycine|[Glu(-Cys)]n-Gly|poly(gamma-glutamylcysteine)glycine http://purl.obolibrary.org/obo/CHEBI_17726 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:17727 biolink:ChemicalEntity phorbol 13-butanoate kegg.compound:C03019 Graph (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b,9-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl butyrate|Phorbol 13-butanoate|phorbol 13-butanoate (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b,9-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl butyrate (1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-4a,7b,9-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl butyrate|Phorbol 13-butanoate|phorbol 13-butanoate http://purl.obolibrary.org/obo/CHEBI_17727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17728 biolink:ChemicalEntity S-methyl-L-methionine A sulfonium compound that is the conjugate acid of S-methyl-L-methioninate. drugcentral:3354|kegg.compound:C03172 Graph L-Methionine methylsulfonium|S-Methyl-L-methionine|S-methyl-L-methionine|[(3S)-3-amino-3-carboxypropyl](dimethyl)sulfonium S-Methyl-L-methionine|S-methyl-L-methionine|[(3S)-3-amino-3-carboxypropyl](dimethyl)sulfonium L-Methionine methylsulfonium|S-Methyl-L-methionine|S-methyl-L-methionine|[(3S)-3-amino-3-carboxypropyl](dimethyl)sulfonium http://purl.obolibrary.org/obo/CHEBI_17728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177286 biolink:ChemicalEntity O-fatty acyl-L-serine residue pubmed:18443287 Graph O-fatty acyl-L-serine residue O-fatty acyl-L-serine residue http://purl.obolibrary.org/obo/CHEBI_177286 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17729 biolink:ChemicalEntity (S)-norcoclaurine cas:22672-77-1|kegg.compound:C06160 Graph (1S)-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|(S)-Norcoclaurine|6,7-Dihydroxy-(1S)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline (1S)-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (1S)-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|(S)-Norcoclaurine|6,7-Dihydroxy-(1S)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline http://purl.obolibrary.org/obo/CHEBI_17729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17730 biolink:ChemicalEntity quercetin 3-sulfate A quercetin sulfate with a sulfo group at position 3. cas:60889-05-6|kegg.compound:C00616|knapsack:C00004956|lipidmaps:LMPK12112304|metacyc.compound:CPD-1822|pubmed:7411385|reaxys:6669649|wikipedia.en:Quercetin_3-O-sulfate Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl hydrogen sulfate|4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-3-(sulfooxy)|Quercetin 3-sulfate|quercetin 3-(hydrogen sulfate)|quercetin 3-O-sulfate|quercetin 3-monosulphate 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl hydrogen sulfate 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl hydrogen sulfate|4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-3-(sulfooxy)|Quercetin 3-sulfate|quercetin 3-(hydrogen sulfate)|quercetin 3-O-sulfate|quercetin 3-monosulphate http://purl.obolibrary.org/obo/CHEBI_17730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17732 biolink:ChemicalEntity Ala-tRNA(Ala) kegg.compound:C00886 Graph Ala-tRNA(Ala)|L-Alanyl-tRNA|L-Alanyl-tRNA(Ala) Ala-tRNA(Ala)|L-Alanyl-tRNA|L-Alanyl-tRNA(Ala) http://purl.obolibrary.org/obo/CHEBI_17732 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17733 biolink:ChemicalEntity aldehydo-D-galactose 6-phosphate The ring-opened aldehydo-form of D-galactose 6-phosphate. cas:6665-00-5|kegg.compound:C01113|pubmed:17439666|reaxys:1728865 Graph 6-O-phosphono-D-galactose|D-galactose, 6-(dihydrogen phosphate)|aldehydo-D-galactose 6-(dihydrogen phosphate)|galactose-6-phosphate aldehydo-D-galactose 6-(dihydrogen phosphate) 6-O-phosphono-D-galactose|D-galactose, 6-(dihydrogen phosphate)|aldehydo-D-galactose 6-(dihydrogen phosphate)|galactose-6-phosphate http://purl.obolibrary.org/obo/CHEBI_17733 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177332 biolink:ChemicalEntity carbotetracyclic compound A carbopolyclic compound comprising of four carbocyclic rings. Graph carbotetracyclic compounds carbotetracyclic compounds http://purl.obolibrary.org/obo/CHEBI_177332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177333 biolink:ChemicalEntity organic tetracyclic compound Graph organic tetracyclic compounds organic tetracyclic compounds http://purl.obolibrary.org/obo/CHEBI_177333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177334 biolink:ChemicalEntity 3',2'-cGAMP(2-) An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of 3',2'-cGAMP; major species at pH 7.3. pubmed:34261127|pubmed:34261128 Graph 3',2'-cGAMP|cG[3'-5']pA[2'-5']p 3',2'-cGAMP|cG[3'-5']pA[2'-5']p http://purl.obolibrary.org/obo/CHEBI_177334 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17734 biolink:ChemicalEntity alpha-cyclopiazonic acid beilstein:6874884|cas:83136-88-3|kegg.compound:C03032 Graph (6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione|alpha-Cyclopiazonate|alpha-Cyclopiazonic acid (6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione (6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione|alpha-Cyclopiazonate|alpha-Cyclopiazonic acid http://purl.obolibrary.org/obo/CHEBI_17734 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17735 biolink:ChemicalEntity N,N-dimethylaniline N-oxide A member of the class of dimethylanilines that is N,N-dimethylaniline in which the tertiary amino group has been oxidised to give the corresponding N-oxide. cas:874-52-2|foodb.food:FDB022640|hmdb:HMDB0001466|kegg.compound:C01183|metacyc.compound:NN-DIMETHYLANILINE-N-OXIDE|pubmed:13201|pubmed:2750202|pubmed:4260498|pubmed:6030897|pubmed:6719937 Graph N,N-Dimethylaniline N-oxide|N,N-dimethylaniline N-oxide|dimethyl(phenyl)amine oxide|dimethylaniline N-oxide N,N-Dimethylaniline N-oxide|N,N-dimethylaniline N-oxide N,N-Dimethylaniline N-oxide|N,N-dimethylaniline N-oxide|dimethyl(phenyl)amine oxide|dimethylaniline N-oxide http://purl.obolibrary.org/obo/CHEBI_17735 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17736 biolink:ChemicalEntity S-(4-bromophenyl)-L-cysteine beilstein:3204780|kegg.compound:C03900 Graph (2R)-2-amino-3-[(4-bromophenyl)sulfanyl]propanoic acid|S-(4-Bromophenyl)-L-cysteine|S-(4-bromophenyl)-L-cysteine (2R)-2-amino-3-[(4-bromophenyl)sulfanyl]propanoic acid|S-(4-Bromophenyl)-L-cysteine|S-(4-bromophenyl)-L-cysteine (2R)-2-amino-3-[(4-bromophenyl)sulfanyl]propanoic acid|S-(4-Bromophenyl)-L-cysteine|S-(4-bromophenyl)-L-cysteine http://purl.obolibrary.org/obo/CHEBI_17736 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17737 biolink:ChemicalEntity desmosterol A cholestanoid that is cholesta-5,24-diene substituted by a β-hydroxy group at position 3. It is an intermediate metabolite obtained during the synthesis of cholesterol. cas:313-04-2|hmdb:HMDB0002719|kegg.compound:C01802|knapsack:C00023743|lipidmaps:LMST01010016|metacyc.compound:DESMOSTEROL-CPD|pubmed:19115107|pubmed:23042211|pubmed:24095826|pubmed:24378747|pubmed:5432584|reaxys:2338693|wikipedia.en:Desmosterol Graph 24-Dehydrocholesterol|3beta-cholesta-5,24-dien-3-ol|Cholesta-5,24-dien-3beta-ol|Desmosterol|cholesta-5,24-dien-3beta-ol|desmosterol Cholesta-5,24-dien-3beta-ol|cholesta-5,24-dien-3beta-ol 24-Dehydrocholesterol|3beta-cholesta-5,24-dien-3-ol|Cholesta-5,24-dien-3beta-ol|Desmosterol|cholesta-5,24-dien-3beta-ol|desmosterol http://purl.obolibrary.org/obo/CHEBI_17737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177372 biolink:ChemicalEntity naxagolide An organic heterotricyclic compound that is (4aR,10bR)-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazine substituted by propyl and hydroxy groups at positions 4 and 9, respectively. It is a potent dopamine D2-receptor agonist and its hydrochloride salt was under clinical development by Merck & Co as a potential antiparkinsonian agent (now discontinued). cas:88058-88-2|chemspider:51863|pubmed:10956195|pubmed:11105937|pubmed:15646539|pubmed:15943487|pubmed:1681090|pubmed:1840645|pubmed:19635669|pubmed:2140595|pubmed:24325578|pubmed:2904649|pubmed:3758188|pubmed:6433000|pubmed:8078498|pubmed:8301582 Graph (+)-4-propyl-9-hydroxynaphthoxazine|(+)-PHNO|(4aR,10bR)-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-9-ol|(4aR-trans)-3,4,4a,5,6,10b-hexahydro-4-propyl-2H-naphth[1,2-b]-1,4-oxazin-9-ol|PHNO|dopazinol|naxagolida|naxagolide|naxagolidum|nazagolide (4aR,10bR)-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-9-ol (+)-4-propyl-9-hydroxynaphthoxazine|(+)-PHNO|(4aR,10bR)-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-9-ol|(4aR-trans)-3,4,4a,5,6,10b-hexahydro-4-propyl-2H-naphth[1,2-b]-1,4-oxazin-9-ol|PHNO|dopazinol|naxagolida|naxagolide|naxagolidum|nazagolide http://purl.obolibrary.org/obo/CHEBI_177372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17738 biolink:ChemicalEntity N-methyl-2-oxoglutaramate Graph 5-(methylamino)-2,5-dioxopentanoate|N-methyl-2-oxoglutaramate 5-(methylamino)-2,5-dioxopentanoate 5-(methylamino)-2,5-dioxopentanoate|N-methyl-2-oxoglutaramate http://purl.obolibrary.org/obo/CHEBI_17738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177380 biolink:ChemicalEntity naxagolide(1+) A tertiary ammonium ion that is the conjugate acid of naxagolide arising from the protonation of the tertiary amino group. Major microspecies at pH 7.3. Graph (4aR,10bR)-9-hydroxy-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-4-ium|naxagolide cation (4aR,10bR)-9-hydroxy-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-4-ium (4aR,10bR)-9-hydroxy-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-4-ium|naxagolide cation http://purl.obolibrary.org/obo/CHEBI_177380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1774 biolink:ChemicalEntity (E)-4-(trimethylammonio)but-2-enoic acid A 4-(trimethylammonio)but-2-enoic acid with a (E)-configuration at the double bond. kegg.compound:C04114|reaxys:1764693 Graph (2E)-3-carboxy-N,N,N-trimethylprop-2-en-1-aminium|4-(Trimethylammonio)but-2-enoate (2E)-3-carboxy-N,N,N-trimethylprop-2-en-1-aminium (2E)-3-carboxy-N,N,N-trimethylprop-2-en-1-aminium|4-(Trimethylammonio)but-2-enoate http://purl.obolibrary.org/obo/CHEBI_1774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17740 biolink:ChemicalEntity 3-oxoalanine A non-proteinogenic α-amino acid that is serine in which the alcoholic hydroxy group has been formally oxidised to the corresponding formyl group. beilstein:4366399 Graph 2-amino-3-oxopropanoic acid|3-oxoalanine|C(alpha)-formylglycine|C-formylglycine|FGly|alpha-formylglycine 2-amino-3-oxopropanoic acid|3-oxoalanine 2-amino-3-oxopropanoic acid|3-oxoalanine|C(alpha)-formylglycine|C-formylglycine|FGly|alpha-formylglycine http://purl.obolibrary.org/obo/CHEBI_17740 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177406 biolink:ChemicalEntity Bardoxolone methyl cas:218600-53-4|chemspider:355161|drugbank:DB05983|kegg.drug:D09585|lincs.smallmolecule:LSM-45471 Graph methyl (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate methyl (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate methyl (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylate http://purl.obolibrary.org/obo/CHEBI_177406 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17741 biolink:ChemicalEntity N,N-dimethylformamide A member of the class of formamides that is formamide in which the amino hydrogens are replaced by methyl groups. cas:68-12-2|drugbank:DB01844|hmdb:HMDB0001888|kegg.compound:C03134|metacyc.compound:CPD-581|pdb-ccd:DMF|pubmed:18666198|pubmed:19608215|pubmed:23313473|pubmed:3824392|reaxys:605365|wikipedia.en:Dimethylformamide Graph DMF|Dimethylformamide|N,N-Dimethylformamide|N,N-Dimethylmethanamide|N,N-dimethylformamide|N-Formyldimethylamine N,N-Dimethylformamide|N,N-dimethylformamide DMF|Dimethylformamide|N,N-Dimethylformamide|N,N-Dimethylmethanamide|N,N-dimethylformamide|N-Formyldimethylamine http://purl.obolibrary.org/obo/CHEBI_17741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177416 biolink:ChemicalEntity Pexacerfont cas:459856-18-9|chemspider:8060040|drugbank:DB12572|kegg.drug:D10022 Graph N-[(2R)-butan-2-yl]-8-(6-methoxy-2-methylpyridin-3-yl)-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine N-[(2R)-butan-2-yl]-8-(6-methoxy-2-methylpyridin-3-yl)-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine N-[(2R)-butan-2-yl]-8-(6-methoxy-2-methylpyridin-3-yl)-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine http://purl.obolibrary.org/obo/CHEBI_177416 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17742 biolink:ChemicalEntity 4-hydroxy-2-oxoglutarate(2-) An oxo dicarboxylate obtained by deprotonation of both carboxy groups of 4-hydroxy-2-oxoglutaric acid. kegg.compound:C01127|metacyc.compound:4-HYDROXY-2-KETO-GLUTARATE Graph 2-hydroxy-4-oxoglutarate|2-hydroxy-4-oxopentanedioate|2-keto-4-hydroxyglutarate|2-oxo-4-hydroxyglutarate|4-hydroxy-2-ketoglutarate|4-hydroxy-2-oxoglutarate 2-hydroxy-4-oxopentanedioate 2-hydroxy-4-oxoglutarate|2-hydroxy-4-oxopentanedioate|2-keto-4-hydroxyglutarate|2-oxo-4-hydroxyglutarate|4-hydroxy-2-ketoglutarate|4-hydroxy-2-oxoglutarate http://purl.obolibrary.org/obo/CHEBI_17742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17745 biolink:ChemicalEntity coniferol A phenylpropanoid that is one of the main monolignols, produced by the reduction of the carboxy functional group in cinnamic acid and the addition of a hydroxy and a methoxy substituent to the aromatic ring. cas:458-35-5|foodb.food:FDB015496|hmdb:HMDB0012915|kegg.compound:C00590|knapsack:C00000614|metacyc.compound:CONIFERYL-ALCOHOL|pdb-ccd:N7I|pubmed:11430982|pubmed:11684179|pubmed:12676987|pubmed:20336005|pubmed:21319787|pubmed:22851762|pubmed:22920542|pubmed:23131896|pubmed:23159486|pubmed:23188459|pubmed:23448127|pubmed:23624856|pubmed:23633600|pubmed:23876147|pubmed:31629237|pubmed:6660881|reaxys:2048963|wikipedia.en:Coniferyl_alcohol Graph (E)-coniferol|4-(3-Hydroxy-1-propenyl)-2-methoxyphenol|4-(3-hydroxy-1-propenyl)-2-methoxyphenol|4-[(1E)-3-hydroxy-1-propenyl]-2-methoxyphenol|4-[(1E)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenol|Coniferol|Coniferyl alcohol|trans-coniferol|trans-coniferyl alcohol 4-[(1E)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenol (E)-coniferol|4-(3-Hydroxy-1-propenyl)-2-methoxyphenol|4-(3-hydroxy-1-propenyl)-2-methoxyphenol|4-[(1E)-3-hydroxy-1-propenyl]-2-methoxyphenol|4-[(1E)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenol|Coniferol|Coniferyl alcohol|trans-coniferol|trans-coniferyl alcohol http://purl.obolibrary.org/obo/CHEBI_17745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177453 biolink:ChemicalEntity Elagolix cas:834153-87-6|chemspider:9425680|drugbank:DB11979|drugcentral:5293|kegg.drug:D09335|pdb-ccd:F5O Graph 4-[[(1R)-2-[5-(2-luoro-3-methoxyphenyl)-3-[[2-luoro-6-(triluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid 4-[[(1R)-2-[5-(2-luoro-3-methoxyphenyl)-3-[[2-luoro-6-(triluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid 4-[[(1R)-2-[5-(2-luoro-3-methoxyphenyl)-3-[[2-luoro-6-(triluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid http://purl.obolibrary.org/obo/CHEBI_177453 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17746 biolink:ChemicalEntity D-xylonate Graph (2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|D-xylonate (2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|D-xylonate (2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|D-xylonate http://purl.obolibrary.org/obo/CHEBI_17746 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17747 biolink:ChemicalEntity bis(2-ethylhexyl) phthalate A phthalate ester that is the bis(2-ethylhexyl) ester of benzene-1,2-dicarboxylic acid. cas:117-81-7|kegg.compound:C03690|metacyc.compound:BIS2-ETHYLHEXYLPHTHALATE|pubmed:12963402|pubmed:16874505|pubmed:17286146|pubmed:19211671|pubmed:19840837|pubmed:28199414|pubmed:28763719|reaxys:1890696|wikipedia.en:Bis(2-ethylhexyl)_phthalate Graph 1,2-Benzenedicarboxylic acid bis(2-ethylhexyl) ester|2-Ethylhexyl phthalate|Bis(2-ethylhexyl) o-phthalate|Bis(2-ethylhexyl)phthalate|Bis(ethylhexyl) phthalate|DEHP|Di(2-ethylhexyl) o-phthalate|Di(2-ethylhexyl)orthophthalate|Di(2-ethylhexyl)phthalate|Di(ethylhexyl) phthalate|Di-sec-octyl phthalate|Diethylhexyl phthalate|Dioctyl phthalate|Octyl phthalate|Phthalic acid bis(2-ethylhexyl) ester|Phthalic acid di(2-ethylhexyl) ester|bis(2-ethylhexyl) benzene-1,2-dicarboxylate|bis(2-ethylhexyl)phthalate|di-iso-Octyl phthalate bis(2-ethylhexyl) benzene-1,2-dicarboxylate 1,2-Benzenedicarboxylic acid bis(2-ethylhexyl) ester|2-Ethylhexyl phthalate|Bis(2-ethylhexyl) o-phthalate|Bis(2-ethylhexyl)phthalate|Bis(ethylhexyl) phthalate|DEHP|Di(2-ethylhexyl) o-phthalate|Di(2-ethylhexyl)orthophthalate|Di(2-ethylhexyl)phthalate|Di(ethylhexyl) phthalate|Di-sec-octyl phthalate|Diethylhexyl phthalate|Dioctyl phthalate|Octyl phthalate|Phthalic acid bis(2-ethylhexyl) ester|Phthalic acid di(2-ethylhexyl) ester|bis(2-ethylhexyl) benzene-1,2-dicarboxylate|bis(2-ethylhexyl)phthalate|di-iso-Octyl phthalate http://purl.obolibrary.org/obo/CHEBI_17747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17748 biolink:ChemicalEntity thymidine A pyrimidine 2'-deoxyribonucleoside having thymine as the nucleobase. cas:50-89-5|drugbank:DB04485|gmelin:282610|hmdb:HMDB0000273|kegg.compound:C00214|knapsack:C00019698|metacyc.compound:THYMIDINE|pdb-ccd:THM|pubmed:22770225|pubmed:2559771|reaxys:89285|wikipedia.en:Thymidine Graph 1-(2-deoxy-beta-D-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione|2'-deoxy-5-methyluridine|2'-deoxythymidine|2'-thymidine|5-methyl-2'-deoxyuridine|Deoxythymidine|T|THYMIDINE|Thymidine|dThd|thymidine|thymine 2'-deoxyriboside THYMIDINE|Thymidine|thymidine 1-(2-deoxy-beta-D-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione|2'-deoxy-5-methyluridine|2'-deoxythymidine|2'-thymidine|5-methyl-2'-deoxyuridine|Deoxythymidine|T|THYMIDINE|Thymidine|dThd|thymidine|thymine 2'-deoxyriboside http://purl.obolibrary.org/obo/CHEBI_17748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17750 biolink:ChemicalEntity glycine betaine The amino acid betaine derived from glycine. cas:107-43-7|drugcentral:347|gmelin:26434|hmdb:HMDB0000043|kegg.compound:C00719|kegg.drug:D07523|knapsack:C00007291|metacyc.compound:BETAINE|pdb-ccd:BET|pubmed:16197300|pubmed:18326594|pubmed:20346934|pubmed:20446114|pubmed:20642826|pubmed:22770225|reaxys:3537113|wikipedia.en:Trimethylglycine|ymdb:YMDB01516 Graph (trimethylammonio)acetate|(trimethylammoniumyl)acetate|1-carboxy-N,N,N-trimethylmethanaminium inner salt|2-N,N,N-trimethylammonio acetate|Bet|Betaine|Glycine betaine|N,N,N-Trimethylglycine|N,N,N-trimethylammonioacetate|Trimethylaminoacetate|Trimethylammonioacetate|abromine|acidol|glycine betaine|trimethylglycine|trimethylglycocoll (trimethylammonio)acetate (trimethylammonio)acetate|(trimethylammoniumyl)acetate|1-carboxy-N,N,N-trimethylmethanaminium inner salt|2-N,N,N-trimethylammonio acetate|Bet|Betaine|Glycine betaine|N,N,N-Trimethylglycine|N,N,N-trimethylammonioacetate|Trimethylaminoacetate|Trimethylammonioacetate|abromine|acidol|glycine betaine|trimethylglycine|trimethylglycocoll http://purl.obolibrary.org/obo/CHEBI_17750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177504 biolink:ChemicalEntity Butylphthalide cas:6066-49-5|chemspider:55293|drugbank:DB12749|drugcentral:5257|hmdb:HMDB0032064|kegg.compound:C17854 Graph 3-butyl-3H-2-benzouran-1-one 3-butyl-3H-2-benzouran-1-one 3-butyl-3H-2-benzouran-1-one http://purl.obolibrary.org/obo/CHEBI_177504 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17751 biolink:ChemicalEntity dihydrostreptomycin 3'alpha,6-bisphosphate kegg.compound:C01280 Graph (1R,2S,3S,4R,5S,6S)-2,4-dicarbamimidamido-3,6-dihydroxy-5-(phosphonooxy)cyclohexyl 5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-[(phosphonooxy)methyl]-alpha-L-lyxofuranoside|Dihydrostreptomycin 3'alpha,6-bisphosphate (1R,2S,3S,4R,5S,6S)-2,4-dicarbamimidamido-3,6-dihydroxy-5-(phosphonooxy)cyclohexyl 5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-[(phosphonooxy)methyl]-alpha-L-lyxofuranoside (1R,2S,3S,4R,5S,6S)-2,4-dicarbamimidamido-3,6-dihydroxy-5-(phosphonooxy)cyclohexyl 5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-[(phosphonooxy)methyl]-alpha-L-lyxofuranoside|Dihydrostreptomycin 3'alpha,6-bisphosphate http://purl.obolibrary.org/obo/CHEBI_17751 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177517 biolink:ChemicalEntity Bifeprunox cas:350992-10-8|chemspider:181044|drugbank:DB04888|kegg.drug:D06566 Graph 7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3H-1,3-benzoxazol-2-one 7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3H-1,3-benzoxazol-2-one 7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3H-1,3-benzoxazol-2-one http://purl.obolibrary.org/obo/CHEBI_177517 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17752 biolink:ChemicalEntity N(6)-acetyl-L-lysine An N6-acyl-L-lysine where the N6-acyl group is specified as acetyl. cas:692-04-6|gmelin:747339|hmdb:HMDB0000206|kegg.compound:C02727|metacyc.compound:CPD-567|pdb-ccd:ALY|pubmed:1285645|pubmed:6790164|pubmed:9169194|reaxys:1725438|wikipedia.en:Acetyllysine Graph (2S)-6-(acetylamino)-2-aminohexanoic acid|N(6)-ACETYLLYSINE|N(6)-Acetyl-L-lysine|N(6)-acetyl-L-lysine|N(epsilon)-acetyl-L-lysine|N(zeta)-acetyl-L-lysine|N(zeta)-acetyllysine|N-Epsilon-acetyllysine|N-epsilon-Acetyl-L-lysine|N6-Acetyl-L-lysine N(6)-acetyl-L-lysine (2S)-6-(acetylamino)-2-aminohexanoic acid|N(6)-ACETYLLYSINE|N(6)-Acetyl-L-lysine|N(6)-acetyl-L-lysine|N(epsilon)-acetyl-L-lysine|N(zeta)-acetyl-L-lysine|N(zeta)-acetyllysine|N-Epsilon-acetyllysine|N-epsilon-Acetyl-L-lysine|N6-Acetyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_17752 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177536 biolink:ChemicalEntity Galeterone cas:851983-85-2|chemspider:9363493|drugbank:DB12415|kegg.drug:D10125|pdb-ccd:TOK Graph (3S,8R,9S,10R,13S,14S)-17-(benzimidazol-1-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8R,9S,10R,13S,14S)-17-(benzimidazol-1-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,8R,9S,10R,13S,14S)-17-(benzimidazol-1-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol http://purl.obolibrary.org/obo/CHEBI_177536 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17754 biolink:ChemicalEntity glycerol A triol with a structure of propane substituted at positions 1, 2 and 3 by hydroxy groups. cas:56-81-5|chemspider:733|drugbank:DB04077|drugcentral:1316|ecmdb:ECMDB00131|foodb.food:FDB000756|gmelin:26279|hmdb:HMDB0000131|kegg.compound:C00116|kegg.drug:D00028|knapsack:C00001163|lincs.smallmolecule:LSM-37180|metacyc.compound:GLYCEROL|pdb-ccd:GOL|pdb:2AJS|pdb:2D03|ppdb:1317|pubmed:11302662|pubmed:11958517|pubmed:11994365|pubmed:12672239|pubmed:12687625|pubmed:12689633|pubmed:12713573|pubmed:14559393|pubmed:14563847|pubmed:15026783|pubmed:15342117|pubmed:15786693|pubmed:15983192|pubmed:16244855|pubmed:16258193|pubmed:16319039|pubmed:16349488|pubmed:16475911|pubmed:16651733|pubmed:16664750|pubmed:16901854|pubmed:17336832|pubmed:17439666|pubmed:17979222|pubmed:19184438|pubmed:19231894|pubmed:19460032|pubmed:19548674|pubmed:19795216|pubmed:19956799|pubmed:22705534|pubmed:23562176|pubmed:23747440|pubmed:24643482|pubmed:24835191|pubmed:25108762|pubmed:558160|pubmed:6299616|pubmed:7031247|pubmed:7392035|reaxys:635685|umbbd.compound:c0066|wikipedia.en:Glycerol|ymdb:YMDB00283 Graph 1,2,3-Propanetriol|1,2,3-Trihydroxypropane|GLYCEROL|Glycerin|Glyceritol|Glycerol|Glyzerin|Gro|Oelsuess|Propanetriol|Trihydroxypropane|glycerine|glycerol|glycerolum|glycyl alcohol|propane-1,2,3-triol propane-1,2,3-triol 1,2,3-Propanetriol|1,2,3-Trihydroxypropane|GLYCEROL|Glycerin|Glyceritol|Glycerol|Glyzerin|Gro|Oelsuess|Propanetriol|Trihydroxypropane|glycerine|glycerol|glycerolum|glycyl alcohol|propane-1,2,3-triol http://purl.obolibrary.org/obo/CHEBI_17754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177543 biolink:ChemicalEntity terrein cas:582-46-7|chemspider:4941440 Graph (4S,5R)-4,5-dihydroxy-3-[(E)-prop-1-enyl]cyclopent-2-en-1-one (4S,5R)-4,5-dihydroxy-3-[(E)-prop-1-enyl]cyclopent-2-en-1-one (4S,5R)-4,5-dihydroxy-3-[(E)-prop-1-enyl]cyclopent-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_177543 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177549 biolink:ChemicalEntity palinavir cas:154612-39-2|chemspider:65793|kegg.drug:D03840 Graph N-[(2S)-1-[[(2S,3R)-4-[(2S,4R)-2-(tert-butylcarbamoyl)-4-(pyridin-4-ylmethoxy)piperidin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]quinoline-2-carboxamide N-[(2S)-1-[[(2S,3R)-4-[(2S,4R)-2-(tert-butylcarbamoyl)-4-(pyridin-4-ylmethoxy)piperidin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]quinoline-2-carboxamide N-[(2S)-1-[[(2S,3R)-4-[(2S,4R)-2-(tert-butylcarbamoyl)-4-(pyridin-4-ylmethoxy)piperidin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]quinoline-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_177549 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17755 biolink:ChemicalEntity cystathionine A modified amino acid generated by enzymic means from homocysteine and serine. cas:535-34-2|kegg.compound:C00542|pubmed:12907234|pubmed:15033753|pubmed:22212096|pubmed:22264337|reaxys:2416815 Graph 2-amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoic acid|Cystathionine|DL-Cystathionine|S-(2-amino-2-carboxyethyl)homocysteine|cystathione 2-amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoic acid|S-(2-amino-2-carboxyethyl)homocysteine 2-amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoic acid|Cystathionine|DL-Cystathionine|S-(2-amino-2-carboxyethyl)homocysteine|cystathione http://purl.obolibrary.org/obo/CHEBI_17755 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17756 biolink:ChemicalEntity (S)-mandelate cas:17199-29-0|gmelin:328160|kegg.compound:C01984|umbbd.compound:c0154 Graph (2S)-hydroxy(phenyl)acetate|(S)-mandelate (2S)-hydroxy(phenyl)acetate (2S)-hydroxy(phenyl)acetate|(S)-mandelate http://purl.obolibrary.org/obo/CHEBI_17756 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177562 biolink:ChemicalEntity Selamectin cas:165108-07-6|chemspider:16738655|drugbank:DB11459|kegg.drug:D05813 Graph (1R,4S,5'S,6R,6'S,8R,10E,12S,13S,14E,16E,20R,21Z,24S)-6'-cyclohexyl-24-hydroxy-21-hydroxyimino-12-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'S,8R,10E,12S,13S,14E,16E,20R,21Z,24S)-6'-cyclohexyl-24-hydroxy-21-hydroxyimino-12-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'S,8R,10E,12S,13S,14E,16E,20R,21Z,24S)-6'-cyclohexyl-24-hydroxy-21-hydroxyimino-12-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_177562 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177564 biolink:ChemicalEntity irdabisant cas:1005402-19-6|chemspider:25991416|drugbank:DB12900|kegg.drug:D10128 Graph 3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-1H-pyridazin-6-one 3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-1H-pyridazin-6-one 3-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-1H-pyridazin-6-one http://purl.obolibrary.org/obo/CHEBI_177564 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17757 biolink:ChemicalEntity plastoquinone A polyprenylbenzoquinone that is 2,3-dimethylbenzoquinone with a polyprenyl side chain at position 5. There are several naturally-occurring plastoquinones with side chains of different length (containing between 6 and 9 isoprene units). cas:112055-76-2|kegg.compound:C02061 Graph 2,3-dimethylpolyprenylbenzoquinones|Plastoquinone|a plastoquinone 2,3-dimethylpolyprenylbenzoquinones|Plastoquinone|a plastoquinone http://purl.obolibrary.org/obo/CHEBI_17757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177582 biolink:ChemicalEntity Jujuboside A chemspider:24534050|kegg.compound:C17831 Graph (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol http://purl.obolibrary.org/obo/CHEBI_177582 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17759 biolink:ChemicalEntity cholesta-5,7-dien-3beta-ol beilstein:2224615|cas:434-16-2|gmelin:893079|kegg.compound:C01164|knapsack:C00023747|lipidmaps:LMST01010069 Graph (3beta)-cholesta-5,7-dien-3-ol|5,7-cholestadien-3-beta-ol|5,7-cholestadien-3beta-ol|7-Dehydrocholesterol|7-dehydrocholesterol|Cholesta-5,7-dien-3beta-ol|Provitamin D3|cholesta-5,7-dien-3beta-ol Cholesta-5,7-dien-3beta-ol|cholesta-5,7-dien-3beta-ol (3beta)-cholesta-5,7-dien-3-ol|5,7-cholestadien-3-beta-ol|5,7-cholestadien-3beta-ol|7-Dehydrocholesterol|7-dehydrocholesterol|Cholesta-5,7-dien-3beta-ol|Provitamin D3|cholesta-5,7-dien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_17759 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17760 biolink:ChemicalEntity methyl sulfate An alkyl sulfate that is the monomethyl ester of sulfuric acid. cas:75-93-4|kegg.compound:C02704|metacyc.compound:CPD-545|pubmed:23566920|reaxys:1701229|wikipedia.en:Methyl_bisulfate Graph Methyl sulfate|Monomethyl sulfate|methyl hydrogen sulfate Methyl sulfate|methyl hydrogen sulfate Methyl sulfate|Monomethyl sulfate|methyl hydrogen sulfate http://purl.obolibrary.org/obo/CHEBI_17760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177607 biolink:ChemicalEntity Taranabant cas:701977-09-5|chemspider:9401143|drugbank:DB06624|kegg.drug:D09009|lincs.smallmolecule:LSM-45803|pdb-ccd:7DY Graph N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-2-methyl-2-[5-(triluoromethyl)pyridin-2-yl]oxypropanamide N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-2-methyl-2-[5-(triluoromethyl)pyridin-2-yl]oxypropanamide N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-2-methyl-2-[5-(triluoromethyl)pyridin-2-yl]oxypropanamide http://purl.obolibrary.org/obo/CHEBI_177607 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177609 biolink:ChemicalEntity Tariquidar cas:206873-63-4|chemspider:130650|drugbank:DB06240|kegg.drug:D06008|pdb-ccd:R1H Graph N-[2-[[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]carbamoyl]-4,5-dimethoxyphenyl]quinoline-3-carboxamide N-[2-[[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]carbamoyl]-4,5-dimethoxyphenyl]quinoline-3-carboxamide N-[2-[[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]carbamoyl]-4,5-dimethoxyphenyl]quinoline-3-carboxamide http://purl.obolibrary.org/obo/CHEBI_177609 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17761 biolink:ChemicalEntity ceramide Ceramides (N-acyl-sphingoid bases) are a major subclass of sphingoid base derivatives with an amide-linked fatty acid. The fatty acids are typically saturated or monounsaturated with chain lengths from 14 to 26 carbon atoms; the presence of a hydroxyl group on carbon 2 is fairly common. Ceramides are generally precursors of more complex sphingolipids. In the illustrated generalised structure, R1 = OH, OX (where X = acyl, glycosyl, phosphate, phosphonate, etc.), or H. kegg.compound:C00195|lipidmaps_class:LMSP02|pubmed:7542630|wikipedia.en:Ceramide Graph Cer|Ceramide|N-acylated sphingoid|a ceramide|ceramides Cer|Ceramide|N-acylated sphingoid|a ceramide|ceramides http://purl.obolibrary.org/obo/CHEBI_17761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17763 biolink:ChemicalEntity 4-methylumbelliferyl acetate An acetate ester consiting of umbelliferone carrying a 7-O-acetyl group. cas:2747-05-9|hmdb:HMDB0032989|kegg.compound:C03837|metacyc.compound:CPD-181|patent:US2008009544|patent:WO2007107846|pubmed:11888210|pubmed:23245880|reaxys:189667 Graph 4-Methylumbelliferyl acetate|4-methyl-2-oxo-2H-chromen-7-yl acetate|4-methyl-7-acetyloxy coumarin|4-methylumbelliferyl acetate|7-(Acetyloxy)-4-methyl-2-benzopyrone|7-(acetyloxy)-4-methyl-2H-1-benzopyran-2-one|7-Acetoxy-4-methylcoumarin|7-acetoxy-4-methylchromen-2-one|beta-Methylumbelliferyl acetate 4-methyl-2-oxo-2H-chromen-7-yl acetate 4-Methylumbelliferyl acetate|4-methyl-2-oxo-2H-chromen-7-yl acetate|4-methyl-7-acetyloxy coumarin|4-methylumbelliferyl acetate|7-(Acetyloxy)-4-methyl-2-benzopyrone|7-(acetyloxy)-4-methyl-2H-1-benzopyran-2-one|7-Acetoxy-4-methylcoumarin|7-acetoxy-4-methylchromen-2-one|beta-Methylumbelliferyl acetate http://purl.obolibrary.org/obo/CHEBI_17763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17764 biolink:ChemicalEntity 2-C-methyl-D-erythritol 4-(dihydrogen phosphate) kegg.compound:C11434|knapsack:C00007297 Graph (2R,3S)-2,3,4-trihydroxy-3-methylbutyl dihydrogen phosphate|2-C-Methyl-D-erythritol 4-phosphate (2R,3S)-2,3,4-trihydroxy-3-methylbutyl dihydrogen phosphate (2R,3S)-2,3,4-trihydroxy-3-methylbutyl dihydrogen phosphate|2-C-Methyl-D-erythritol 4-phosphate http://purl.obolibrary.org/obo/CHEBI_17764 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177647 biolink:ChemicalEntity Rolofylline chemspider:58188|kegg.drug:D08989 Graph 1,3-dipropyl-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione 1,3-dipropyl-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione 1,3-dipropyl-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione http://purl.obolibrary.org/obo/CHEBI_177647 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177658 biolink:ChemicalEntity Ganaxolone cas:38398-32-2|chemspider:5293511|drugbank:DB05087|kegg.drug:D04300|lincs.smallmolecule:LSM-45679 Graph 1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone 1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone 1-[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone http://purl.obolibrary.org/obo/CHEBI_177658 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17766 biolink:ChemicalEntity cyclohexane-1,3-dione A cyclohexanedione carrying oxo substituents at positions 1 and 3. cas:504-02-9|gmelin:200899|kegg.compound:C01066|metacyc.compound:CYCLOHEXANE-13-DIONE|pubmed:18863814|pubmed:5654929|reaxys:385888 Graph 1,3-Cyclohexanedione|Cyclohexane-1,3-dione|Dihydroresorcinol|cyclohexane-1,3-dione Cyclohexane-1,3-dione|cyclohexane-1,3-dione 1,3-Cyclohexanedione|Cyclohexane-1,3-dione|Dihydroresorcinol|cyclohexane-1,3-dione http://purl.obolibrary.org/obo/CHEBI_17766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17767 biolink:ChemicalEntity D-mannonate The D-enantiomer of mannonate. kegg.compound:C00514 Graph D-Mannonate|D-mannonate D-mannonate D-Mannonate|D-mannonate http://purl.obolibrary.org/obo/CHEBI_17767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17768 biolink:ChemicalEntity N-acetylputrescine An N-monoacetylalkane-α,ω-diamine that is the N-monoacetyl derivative of putrescine. cas:18233-70-0|cas:5699-41-2|hmdb:HMDB0002064|kegg.compound:C02714|metacyc.compound:CPD-569|pubmed:10198034|pubmed:15073218|pubmed:16232710|pubmed:197226|pubmed:22770225|pubmed:23081916|pubmed:2320051|pubmed:2775189|pubmed:3627168|pubmed:6257381|pubmed:7092834|pubmed:7406885|pubmed:7630314|pubmed:7663691|pubmed:7817785|pubmed:8441357|pubmed:894508|pubmed:8955325|reaxys:1749697 Graph N-(4-aminobutyl)acetamide|N-Acetylputrescine N-(4-aminobutyl)acetamide N-(4-aminobutyl)acetamide|N-Acetylputrescine http://purl.obolibrary.org/obo/CHEBI_17768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17769 biolink:ChemicalEntity 4-aminobutanal An ω-aminoaldehyde that is butanal in which one of the hydrogens of the terminal methyl group has been replaced by an amino group. kegg.compound:C00555|knapsack:C00019656 Graph 4-Aminobutanal|4-Aminobutyraldehyde|4-amino-butyraldehyde|4-aminobutanal|Butyraldehyde, 4-amino- 4-Aminobutanal|4-aminobutanal 4-Aminobutanal|4-Aminobutyraldehyde|4-amino-butyraldehyde|4-aminobutanal|Butyraldehyde, 4-amino- http://purl.obolibrary.org/obo/CHEBI_17769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17770 biolink:ChemicalEntity 1-hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone A monosaccharide derivative that is alizarin substituted by a β-D-glucopyranosyl residue at position 2 via a glycosidic linkage. beilstein:59007|cas:31297-82-2|kegg.compound:C04719 Graph 1,2-dihydroxy-9,10-anthraquinone 2-O-beta-D-glucopyranoside|1-Hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone|1-hydroxy-2-(beta-D-glucopyranosyloxy)-9,10-anthraquinone|1-hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone|1-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl beta-D-glucopyranoside|2-(beta-D-glucopyranosyloxy)-1-hydroxy-9,10-anthracenedione|2-alizarin-beta-D-glucoside|alizarin-2-beta-D-glucopyranoside 1-hydroxy-2-(beta-D-glucopyranosyloxy)-9,10-anthraquinone 1,2-dihydroxy-9,10-anthraquinone 2-O-beta-D-glucopyranoside|1-Hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone|1-hydroxy-2-(beta-D-glucopyranosyloxy)-9,10-anthraquinone|1-hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone|1-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl beta-D-glucopyranoside|2-(beta-D-glucopyranosyloxy)-1-hydroxy-9,10-anthracenedione|2-alizarin-beta-D-glucoside|alizarin-2-beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_17770 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17771 biolink:ChemicalEntity trans-urocanate A urocanate obtained by deprotonation of the carboxy group of trans-urocanic acid; major species at pH 7.3. reaxys:5735282 Graph (2E)-3-(1H-imidazol-4-yl)prop-2-enoate|(E)-3-(imidazol-4-yl)propenoate|trans-urocanate (2E)-3-(1H-imidazol-4-yl)prop-2-enoate (2E)-3-(1H-imidazol-4-yl)prop-2-enoate|(E)-3-(imidazol-4-yl)propenoate|trans-urocanate http://purl.obolibrary.org/obo/CHEBI_17771 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17772 biolink:ChemicalEntity (S)-tetrahydrocolumbamine A berberine alkaloid consisting of columbamine having four extra hydrogens at positions 5, 8, 13 and 13a and (S)-configuration. cas:483-34-1|kegg.compound:C04118|knapsack:C00025632|reaxys:4717587 Graph (13aS)-3,9,10-trimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolin-2-ol|(13aS)-5,8,13,13a-tetrahydro-3,9,10-trimethoxy-6H-Dibenzo[a,g]quinolizin-2-ol|(13aS)-5,8,13,13a-tetrahydro-3,9,10-trimethoxy-6H-dibenzo[a,g]quinolizin-2-ol|(S)-Tetrahydrocolumbamine|(S)-tetrahydrocolumbamine|5,8,13,13a-Tetrahydrocolumbamine|Isocorypalmine (13aS)-3,9,10-trimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolin-2-ol (13aS)-3,9,10-trimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolin-2-ol|(13aS)-5,8,13,13a-tetrahydro-3,9,10-trimethoxy-6H-Dibenzo[a,g]quinolizin-2-ol|(13aS)-5,8,13,13a-tetrahydro-3,9,10-trimethoxy-6H-dibenzo[a,g]quinolizin-2-ol|(S)-Tetrahydrocolumbamine|(S)-tetrahydrocolumbamine|5,8,13,13a-Tetrahydrocolumbamine|Isocorypalmine http://purl.obolibrary.org/obo/CHEBI_17772 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17773 biolink:ChemicalEntity D-ribonate Conjugate base of D-ribonic acid. beilstein:3905365|kegg.compound:C01685 Graph D-Ribonate|D-ribonate D-Ribonate|D-ribonate D-Ribonate|D-ribonate http://purl.obolibrary.org/obo/CHEBI_17773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177731 biolink:ChemicalEntity Sabeluzole cas:104383-17-7|chemspider:53964|kegg.drug:D05780 Graph 1-[4-[1,3-benzothiazol-2-yl(methyl)amino]piperidin-1-yl]-3-(4-luorophenoxy)propan-2-ol 1-[4-[1,3-benzothiazol-2-yl(methyl)amino]piperidin-1-yl]-3-(4-luorophenoxy)propan-2-ol 1-[4-[1,3-benzothiazol-2-yl(methyl)amino]piperidin-1-yl]-3-(4-luorophenoxy)propan-2-ol http://purl.obolibrary.org/obo/CHEBI_177731 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17774 biolink:ChemicalEntity pimelate(1-) A dicarboxylic acid monoanion that is the conjugate base of pimelic acid. gmelin:1449709 Graph 6-carboxyhexanoate|Pimelate|heptanedioate|hydrogen pimelate 6-carboxyhexanoate 6-carboxyhexanoate|Pimelate|heptanedioate|hydrogen pimelate http://purl.obolibrary.org/obo/CHEBI_17774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177741 biolink:ChemicalEntity Morphiceptin cas:74135-04-9|chemspider:106565|hmdb:HMDB0005777 Graph (2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_177741 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17775 biolink:ChemicalEntity 7,9-dihydro-1H-purine-2,6,8(3H)-trione An oxopurine in which the purine ring is substituted by oxo groups at positions 2, 6, and 8. cas:69-93-2|drugbank:DB01696|gmelin:241332|hmdb:HMDB0000289|kegg.compound:C00366|knapsack:C00007301|metacyc.compound:URATE|pdb-ccd:URC|pubmed:22770225|reaxys:156158|wikipedia.en:Uric_acid Graph 2,6,8-trioxopurine|2,6,8-trioxypurine|7,9-dihydro-1H-purine-2,6,8(3H)-trione|URIC ACID|Urate|Uric acid|purine-2,6,8(1H,3H,9H)-trione|urate 7,9-dihydro-1H-purine-2,6,8(3H)-trione 2,6,8-trioxopurine|2,6,8-trioxypurine|7,9-dihydro-1H-purine-2,6,8(3H)-trione|URIC ACID|Urate|Uric acid|purine-2,6,8(1H,3H,9H)-trione|urate http://purl.obolibrary.org/obo/CHEBI_17775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177758 biolink:ChemicalEntity Omadacycline chemspider:65322556|kegg.drug:D09647 Graph (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_177758 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177762 biolink:ChemicalEntity Alovudine cas:25526-93-6|chemspider:30578|drugbank:DB06198|kegg.drug:D02830 Graph 1-[(2R,4S,5R)-4-luoro-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione 1-[(2R,4S,5R)-4-luoro-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione 1-[(2R,4S,5R)-4-luoro-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione http://purl.obolibrary.org/obo/CHEBI_177762 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17778 biolink:ChemicalEntity 2-hydroxy-3-oxosuccinic acid beilstein:2358870|kegg.compound:C03459 Graph 2-Hydroxy-3-oxosuccinate|2-hydroxy-3-oxobutanedioic acid|Oxaloglycolate 2-hydroxy-3-oxobutanedioic acid 2-Hydroxy-3-oxosuccinate|2-hydroxy-3-oxobutanedioic acid|Oxaloglycolate http://purl.obolibrary.org/obo/CHEBI_17778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177783 biolink:ChemicalEntity eniluracil cas:59989-18-3|chemspider:39327|drugbank:DB03516|kegg.drug:D03998|pdb-ccd:Y3G Graph 5-ethynyl-1H-pyrimidine-2,4-dione 5-ethynyl-1H-pyrimidine-2,4-dione 5-ethynyl-1H-pyrimidine-2,4-dione http://purl.obolibrary.org/obo/CHEBI_177783 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177789 biolink:ChemicalEntity Carnidazole cas:42116-76-7|chemspider:2297829|kegg.drug:D03408 Graph O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate O-methyl N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]carbamothioate http://purl.obolibrary.org/obo/CHEBI_177789 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17780 biolink:ChemicalEntity 5-hydroxy-L-tryptophan The L-enantiomer of 5-hydroxytryptophan. cas:4350-09-8|drugbank:DB02959|drugcentral:4006|gmelin:1862149|hmdb:HMDB0000472|kegg.compound:C00643|kegg.drug:D07339|knapsack:C00001371|metacyc.compound:5-HYDROXY-TRYPTOPHAN|pdb-ccd:4PQ|pubmed:22964922|pubmed:24321061|pubmed:24369991|pubmed:5297581|pubmed:9295177|reaxys:88200|wikipedia.en:5-Hydroxytryptophan Graph (2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-Hydroxy-L-tryptophan|5-hydroxy-L-tryptophan|5-hydroxytryptophan L-form|Cincofarm|L-5-hydroxytryptophan|Levothym|Oxitriptan|Tript-OH|oxitriptan (2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-Hydroxy-L-tryptophan|5-hydroxy-L-tryptophan (2S)-2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-Hydroxy-L-tryptophan|5-hydroxy-L-tryptophan|5-hydroxytryptophan L-form|Cincofarm|L-5-hydroxytryptophan|Levothym|Oxitriptan|Tript-OH|oxitriptan http://purl.obolibrary.org/obo/CHEBI_17780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17781 biolink:ChemicalEntity lumichrome A compound showing blue fluorescence, formed by a photolysis of riboflavin in acid or neutral solution. cas:1086-80-2|drugbank:DB04345|kegg.compound:C01727|knapsack:C00030694|metacyc.compound:CPD-605|pdb-ccd:LUM|pubmed:15819908|pubmed:21126007|pubmed:22953948|pubmed:24001807|pubmed:24451190|pubmed:24643482|reaxys:226631 Graph 7,8-Dimethylalloxazine|7,8-dimethylbenzo[g]pteridine-2,4(1H,3H)-dione|LUMICHROME|Lumichrome|lumichrome 7,8-dimethylbenzo[g]pteridine-2,4(1H,3H)-dione 7,8-Dimethylalloxazine|7,8-dimethylbenzo[g]pteridine-2,4(1H,3H)-dione|LUMICHROME|Lumichrome|lumichrome http://purl.obolibrary.org/obo/CHEBI_17781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17782 biolink:ChemicalEntity 5-dehydro-4-deoxy-D-glucuronic acid A hexuronic acid that results from hydrolytic ring cleavage of the hemiacetal group of 4-deoxy-α-L-threo-hex-4-enopyranuronic acid with subsequent tautomerisation of the resulting enol to the corresponding ketone. kegg.compound:C04053|pubmed:10441389|pubmed:15148314|pubmed:16630576|pubmed:16893885|pubmed:19416976|pubmed:21147778 Graph 4-deoxy-L-threo-5-hexulosuronic acid|4-deoxy-L-threo-hex-5-ulosuronic acid 4-deoxy-L-threo-hex-5-ulosuronic acid 4-deoxy-L-threo-5-hexulosuronic acid|4-deoxy-L-threo-hex-5-ulosuronic acid http://purl.obolibrary.org/obo/CHEBI_17782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177824 biolink:ChemicalEntity terameprocol cas:24150-24-1|chemspider:418597|drugbank:DB12226|kegg.drug:D09014 Graph 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene http://purl.obolibrary.org/obo/CHEBI_177824 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:177833 biolink:ChemicalEntity cilengitide cas:188968-51-6|chemspider:154046|drugbank:DB11890|kegg.drug:D03497|lincs.smallmolecule:LSM-45233 Graph 2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,15-pentaoxo-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid 2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,15-pentaoxo-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid 2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,15-pentaoxo-8-propan-2-yl-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid http://purl.obolibrary.org/obo/CHEBI_177833 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17784 biolink:ChemicalEntity 2-amino-2-deoxy-D-gluconic acid Hexanoic acid with four hydroxy groups at C-3, C-4, C-5, C-6, and an amino group at C-2. cas:3646-68-2|kegg.compound:C03752|metacyc.compound:GLUCOSAMINATE|pubmed:10380620|pubmed:22735334|pubmed:23836865|pubmed:7068563|reaxys:1726033 Graph (3R,4S,5R)-3,4,5,6-tetrahydroxy-D-norleucine|2-Amino-2-deoxy-D-gluconate|2-amino-2-deoxy-D-gluconic acid|D-Glucosaminate|D-Glucosaminic acid|D-glucosaminate|Glucosaminate 2-Amino-2-deoxy-D-gluconate|2-amino-2-deoxy-D-gluconic acid (3R,4S,5R)-3,4,5,6-tetrahydroxy-D-norleucine|2-Amino-2-deoxy-D-gluconate|2-amino-2-deoxy-D-gluconic acid|D-Glucosaminate|D-Glucosaminic acid|D-glucosaminate|Glucosaminate http://purl.obolibrary.org/obo/CHEBI_17784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177844 biolink:ChemicalEntity avitriptan cas:151140-96-4|chemspider:117442 Graph 1-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]-N-methylmethanesulonamide 1-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]-N-methylmethanesulonamide 1-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]-N-methylmethanesulonamide http://purl.obolibrary.org/obo/CHEBI_177844 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17786 biolink:ChemicalEntity N-acetyl-L-leucine The N-acetyl derivative of L-leucine. cas:1188-21-2|chemspider:1918|gmelin:985259|hmdb:HMDB0011756|kegg.compound:C02710|lincs.smallmolecule:LSM-20975|metacyc.compound:CPD-433|pubmed:21185819|pubmed:22227165|pubmed:22770225|pubmed:3473611|reaxys:1724849|wikipedia.en:Acetylleucine Graph (2S)-2-(acetylamino)-4-methylpentanoic acid|N-Acetyl-L-leucine|N-acetyl-L-leucine|N-acetyl-Leu|N-acetylleucine|acetylleucine (2S)-2-(acetylamino)-4-methylpentanoic acid|N-Acetyl-L-leucine|N-acetyl-L-leucine|N-acetylleucine (2S)-2-(acetylamino)-4-methylpentanoic acid|N-Acetyl-L-leucine|N-acetyl-L-leucine|N-acetyl-Leu|N-acetylleucine|acetylleucine http://purl.obolibrary.org/obo/CHEBI_17786 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177869 biolink:ChemicalEntity indole-5,6-quinone-2-carboxylate An indolecarboxylate that is the conjugate base of indole-5,6-quinone-2-carboxylic acid resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3. metacyc.compound:CPD-12374|pubmed:7813420|pubmed:8027058 Graph 5,6-bis(oxidanylidene)-1H-indole-2-carboxylate|5,6-diketo-1H-indole-2-carboxylate|5,6-dioxo-1H-indole-2-carboxylate|5,6-dioxo-5,6-dihydro-1H-indole-2-carboxylate|5,6-indolequinone-2-carboxylate|indole-5,6-quinone-2-carboxylate 5,6-dioxo-5,6-dihydro-1H-indole-2-carboxylate 5,6-bis(oxidanylidene)-1H-indole-2-carboxylate|5,6-diketo-1H-indole-2-carboxylate|5,6-dioxo-1H-indole-2-carboxylate|5,6-dioxo-5,6-dihydro-1H-indole-2-carboxylate|5,6-indolequinone-2-carboxylate|indole-5,6-quinone-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_177869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17789 biolink:ChemicalEntity dihydrochelirubine A benzophenanthridine alkaloid that is dihydrosanguinarine bearing a methoxy substituent at position 10. agr:IND43865777|cas:28342-26-9|kegg.compound:C05194|knapsack:C00024643|pubmed:17077972|pubmed:20686258|pubmed:2213031|reaxys:630924 Graph 13,14-Dihydro-5-methoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydrochelirubine|dihydrochelirubine 5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine 13,14-Dihydro-5-methoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|5-methoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydrochelirubine|dihydrochelirubine http://purl.obolibrary.org/obo/CHEBI_17789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177898 biolink:ChemicalEntity omega-carboxy-(fatty acyl)-CoA(5-) An acyl-CoA oxoanion obtained by deprotonation of the phosphate, diphosphate and carboxy groups of any omega-carboxy-(fatty acyl)-CoA; major species at pH 7.3. Graph an omega-carboxy-(fatty acyl)-CoA an omega-carboxy-(fatty acyl)-CoA http://purl.obolibrary.org/obo/CHEBI_177898 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17790 biolink:ChemicalEntity methanol The primary alcohol that is the simplest aliphatic alcohol, comprising a methyl and an alcohol group. cas:67-56-1|gmelin:449|hmdb:HMDB0001875|kegg.compound:C00132|kegg.drug:D02309|metacyc.compound:METOH|pdb-ccd:MOH|pubmed:11141607|pubmed:11430978|pubmed:11489599|pubmed:11680737|pubmed:11684179|pubmed:14012711|pubmed:14678513|pubmed:14760634|pubmed:15172721|pubmed:15906011|pubmed:16705261|pubmed:17451998|pubmed:17733096|pubmed:19064074|pubmed:19850112|pubmed:20314698|reaxys:1098229|umbbd.compound:c0132|wikipedia.en:Methanol Graph CH3OH|METHANOL|MeOH|Methanol|Methyl alcohol|Methylalkohol|carbinol|methanol|spirit of wood|wood alcohol|wood naphtha|wood spirit METHANOL|Methanol|methanol CH3OH|METHANOL|MeOH|Methanol|Methyl alcohol|Methylalkohol|carbinol|methanol|spirit of wood|wood alcohol|wood naphtha|wood spirit http://purl.obolibrary.org/obo/CHEBI_17790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17791 biolink:ChemicalEntity obtusifoliol cas:16910-32-0|foodb.food:FDB004683|hmdb:HMDB0001242|kegg.compound:C01943|knapsack:C00007368|lipidmaps:LMST01030101|metacyc.compound:OBTUSIFOLIOL|pubmed:11437378|pubmed:27474490|pubmed:27534104|pubmed:32560825|pubmed:33371196|pubmed:34904497|pubmed:35975452|pubmed:36069327|pubmed:8955137|pubmed:9076987|wikipedia.en:Obtusifoliol Graph (+)-obtusifoliol|(3beta,4alpha,5alpha)-4,14-dimethylergosta-8,24(28)-dien-3-ol|4alpha,14-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol|4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol|4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol|4alpha,14alpha-dimethyl-24-methylene-cholest-8-en-3beta-ol|4alpha,14alpha-dimethyl-Delta(8,24(28))-ergostadien-3beta-ol|obtusifoliol 4alpha,14-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol (+)-obtusifoliol|(3beta,4alpha,5alpha)-4,14-dimethylergosta-8,24(28)-dien-3-ol|4alpha,14-dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol|4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol|4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol|4alpha,14alpha-dimethyl-24-methylene-cholest-8-en-3beta-ol|4alpha,14alpha-dimethyl-Delta(8,24(28))-ergostadien-3beta-ol|obtusifoliol http://purl.obolibrary.org/obo/CHEBI_17791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177917 biolink:ChemicalEntity phenolic steroid kegg.compound:C02453|metacyc.compound:PHENOLIC-STEROID|pubmed:13752799|pubmed:4303459|pubmed:4622133|pubmed:4753431|pubmed:4798212|pubmed:4957953|pubmed:5790329|pubmed:6078089 Graph a phenolic steroid|phenolic steroids a phenolic steroid|phenolic steroids http://purl.obolibrary.org/obo/CHEBI_177917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:177918 biolink:ChemicalEntity phenolic steroid 3-O-sulfate(1-) kegg.compound:C02590|metacyc.compound:STEROID-O-SULFATE Graph a phenolic steroid 3-O-sulfate a phenolic steroid 3-O-sulfate http://purl.obolibrary.org/obo/CHEBI_177918 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17792 biolink:ChemicalEntity organohalogen compound A compound containing at least one carbon-halogen bond (where X is a halogen atom). kegg.compound:C01322|metacyc.compound:Organohalogen-Compounds Graph RX|organic halide|organic halides|organohalogen compounds RX|organic halide|organic halides|organohalogen compounds http://purl.obolibrary.org/obo/CHEBI_17792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17793 biolink:ChemicalEntity calycosin A member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone which is substituted by an additional hydroxy group at the 3' position and a methoxy group at the 4' position. cas:20575-57-9|kegg.compound:C01562|knapsack:C00009389|lipidmaps:LMPK12050056|patent:CN102030735|patent:KR20080079237|patent:WO2009129260|pubmed:11025148|pubmed:16286304|pubmed:16441066|pubmed:17253088|reaxys:1292488|wikipedia.en:Calycosin Graph 3'-hydroxy-formononetin|7,3'-dihydroxy-4'-methoxyisoflavone|7-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one|7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one|Calycosin 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one 3'-hydroxy-formononetin|7,3'-dihydroxy-4'-methoxyisoflavone|7-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one|7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one|Calycosin http://purl.obolibrary.org/obo/CHEBI_17793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17794 biolink:ChemicalEntity 3-phospho-D-glyceric acid The D-enantiomer of 3-phosphoglyceric acid kegg.compound:C00197|knapsack:C00019551|metacyc.compound:G3P|pdb-ccd:3PG|wikipedia.en:3-Phosphoglyceric_acid Graph (2R)-2-hydroxy-3-(phosphonooxy)propanoic acid|3-Phospho-(R)-glycerate|3-Phospho-D-glycerate|3-Phosphoglycerate|3-phospho-D-glycerate|D-Glycerate 3-phosphate|D-glycerate 3-phosphate (2R)-2-hydroxy-3-(phosphonooxy)propanoic acid (2R)-2-hydroxy-3-(phosphonooxy)propanoic acid|3-Phospho-(R)-glycerate|3-Phospho-D-glycerate|3-Phosphoglycerate|3-phospho-D-glycerate|D-Glycerate 3-phosphate|D-glycerate 3-phosphate http://purl.obolibrary.org/obo/CHEBI_17794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17795 biolink:ChemicalEntity dihydroxyfumarate(2-) A C4-dicarboxylate resuting from deprotonation of both carboxy groups of dihydroxyfumaric acid. kegg.compound:C00975 Graph (2E)-2,3-dihydroxybut-2-enedioate|dihydroxyfumarate (2E)-2,3-dihydroxybut-2-enedioate (2E)-2,3-dihydroxybut-2-enedioate|dihydroxyfumarate http://purl.obolibrary.org/obo/CHEBI_17795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17796 biolink:ChemicalEntity L-idonate An optically active form of idonate having L-configuration; major species at pH 7.3. beilstein:3906522|cas:1114-17-6|kegg.compound:C00770|metacyc.compound:L-IDONATE Graph L-Idonate|L-idonate L-Idonate|L-idonate L-Idonate|L-idonate http://purl.obolibrary.org/obo/CHEBI_17796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17797 biolink:ChemicalEntity aldehydo-D-ribose 5-phosphate The acyclic form of D-ribose 5-phosphate. cas:4151-19-3|cas:4300-28-1|cas:62746-84-3|drugbank:DB02053|kegg.compound:C00117|metacyc.compound:RIBOSE-5P|reaxys:1728061|wikipedia.en:D-ribose_5-phosphate Graph 5-O-phosphono-D-ribose|D-Ribose 5-phosphate|D-ribose 5-(dihydrogen phosphate)|Ribose 5-phosphate D-Ribose 5-phosphate|D-ribose 5-(dihydrogen phosphate) 5-O-phosphono-D-ribose|D-Ribose 5-phosphate|D-ribose 5-(dihydrogen phosphate)|Ribose 5-phosphate http://purl.obolibrary.org/obo/CHEBI_17797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17798 biolink:ChemicalEntity L-gamma-glutamyl phosphate kegg.compound:C03287 Graph (2S)-2-amino-5-oxo-5-(phosphonooxy)pentanoic acid|5-oxo-5-(phosphonooxy)-L-norvaline|L-Glutamate 5-phosphate|L-Glutamyl 5-phosphate|L-gamma-glutamyl dihydrogen phosphate|L-glutam-5-yl phosphate L-gamma-glutamyl dihydrogen phosphate (2S)-2-amino-5-oxo-5-(phosphonooxy)pentanoic acid|5-oxo-5-(phosphonooxy)-L-norvaline|L-Glutamate 5-phosphate|L-Glutamyl 5-phosphate|L-gamma-glutamyl dihydrogen phosphate|L-glutam-5-yl phosphate http://purl.obolibrary.org/obo/CHEBI_17798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17799 biolink:ChemicalEntity 2-methyl-DL-serine A racemate comprising equimolar amounts of 2-methyl-D-serine and 2-methyl-L-serine. cas:5424-29-3|kegg.compound:C02115|metacyc.compound:CPD-390|pubmed:18952881|pubmed:19924838|pubmed:2503059|pubmed:33382|pubmed:8988636|pubmed:9028042|reaxys:1721693 Graph 2-Methylserine|2-methyl-DL-serine|DL-2-methylserine|alpha-methyl-DL-serine|rac-2-amino-2-methyl-3-hydroxypropanoic acid|rac-2-amino-2-methyl-3-hydroxypropionic acid|rac-2-amino-3-hydroxy-2-methylpropanoic acid|rac-2-amino-3-hydroxy-2-methylpropionic acid|rac-2-methylserine|rac-alpha-MeSer rac-2-methylserine 2-Methylserine|2-methyl-DL-serine|DL-2-methylserine|alpha-methyl-DL-serine|rac-2-amino-2-methyl-3-hydroxypropanoic acid|rac-2-amino-2-methyl-3-hydroxypropionic acid|rac-2-amino-3-hydroxy-2-methylpropanoic acid|rac-2-amino-3-hydroxy-2-methylpropionic acid|rac-2-methylserine|rac-alpha-MeSer http://purl.obolibrary.org/obo/CHEBI_17799 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17800 biolink:ChemicalEntity O-phosphoviomycin A derivative of viomycin having a phospho group attached to the side-chain OH group of one of the serine residues. kegg.compound:C02574 Graph O-Phosphoviomycin|[(2S,5S,8Z,11S,15S)-8-[(carbamoylamino)methylene]-15-{[(3S)-3,6-diaminohexanoyl]amino}-11-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-5-(hydroxymethyl)-3,6,9,12,16-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-2-yl]methyl dihydrogen phosphate [(2S,5S,8Z,11S,15S)-8-[(carbamoylamino)methylene]-15-{[(3S)-3,6-diaminohexanoyl]amino}-11-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-5-(hydroxymethyl)-3,6,9,12,16-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-2-yl]methyl dihydrogen phosphate O-Phosphoviomycin|[(2S,5S,8Z,11S,15S)-8-[(carbamoylamino)methylene]-15-{[(3S)-3,6-diaminohexanoyl]amino}-11-[(4R,6S)-6-hydroxy-2-iminohexahydropyrimidin-4-yl]-5-(hydroxymethyl)-3,6,9,12,16-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-2-yl]methyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_17800 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17802 biolink:ChemicalEntity pseudouridine A C-glycosyl pyrimidine that consists of uracil having a β-D-ribofuranosyl residue attached at position 5. The C-glycosyl isomer of the nucleoside uridine. beilstein:32779|cas:1445-07-4|hmdb:HMDB0000767|kegg.compound:C02067|knapsack:C00001508|metacyc.compound:CPD-497|pubmed:12810910|pubmed:13811056|pubmed:15199136|pubmed:15739475|pubmed:16236171|pubmed:18620915|pubmed:21628430|pubmed:21953190|pubmed:21960742|pubmed:22770225|reaxys:621385|wikipedia.en:Pseudouridine Graph (1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol|5-(beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione|5-(beta-D-ribofuranosyl)uracil|Pseudouridine|Psi-uridine|beta-Pseudouridine|p|pseudouridine 5-(beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione (1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol|5-(beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione|5-(beta-D-ribofuranosyl)uracil|Pseudouridine|Psi-uridine|beta-Pseudouridine|p|pseudouridine http://purl.obolibrary.org/obo/CHEBI_17802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178020 biolink:ChemicalEntity bongkrekate(3-) A tricarboxylic acid anion resulting from the deprotonation of the three carboxy groups of bongkrekic acid; major species at pH 7.3. metacyc.compound:CPD-21066 Graph (2E,4Z,6R,8Z,10E,14E,17S,18E,20Z)-20-(carboxylatomethyl)-6-methoxy-2,5,17-trimethyldocosa-2,4,8,10,14,18,20-heptaenedioate|bongkrekate|bongkrekic acid trianion|bongkrekic acid(3-) (2E,4Z,6R,8Z,10E,14E,17S,18E,20Z)-20-(carboxylatomethyl)-6-methoxy-2,5,17-trimethyldocosa-2,4,8,10,14,18,20-heptaenedioate (2E,4Z,6R,8Z,10E,14E,17S,18E,20Z)-20-(carboxylatomethyl)-6-methoxy-2,5,17-trimethyldocosa-2,4,8,10,14,18,20-heptaenedioate|bongkrekate|bongkrekic acid trianion|bongkrekic acid(3-) http://purl.obolibrary.org/obo/CHEBI_178020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178021 biolink:ChemicalEntity galanthamine(1+) A tertiary ammonium ion that is conjugate acid of galanthamine resulting from the protonation of the tertiary amino group; major species at pH 7.3. Graph (-)-galanthamine(1+)|(4aS,6R,8aS)-6-hydroxy-3-methoxy-11-methyl-5,6,9,10,11,12-hexahydro-4aH-[1]benzofuro[3a,3,2-ef][2]benzazepin-11-ium|galanthamine|galanthamine cation (4aS,6R,8aS)-6-hydroxy-3-methoxy-11-methyl-5,6,9,10,11,12-hexahydro-4aH-[1]benzofuro[3a,3,2-ef][2]benzazepin-11-ium (-)-galanthamine(1+)|(4aS,6R,8aS)-6-hydroxy-3-methoxy-11-methyl-5,6,9,10,11,12-hexahydro-4aH-[1]benzofuro[3a,3,2-ef][2]benzazepin-11-ium|galanthamine|galanthamine cation http://purl.obolibrary.org/obo/CHEBI_178021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17803 biolink:ChemicalEntity dehydro-D-arabinono-1,4-lactone A γ-lactone that is 5-(hydroxymethyl)furan-2(5H)-one substituted at positions 3 and 4 by hydroxy groups (the 5R-stereoisomer). agr:IND20363771|agr:IND20401001|kegg.compound:C06316|metacyc.compound:CPD-1789|patent:WO9529928|pubmed:10094636|pubmed:10508108|pubmed:11349062|pubmed:15809004|pubmed:17151466|pubmed:18282465|pubmed:19412602|pubmed:20403425|pubmed:20815349|pubmed:21369982|pubmed:25957768|pubmed:7612007|reaxys:82335 Graph (5R)-3,4-Dihydroxy-5-(hydroxymethyl)furan-2(5H)-one|(5R)-3,4-dihydroxy-5-(hydroxymethyl)furan-2(5H)-one|D-erythroascorbic acid|D-glycero-2-pentenono-l,4-lactone (5R)-3,4-dihydroxy-5-(hydroxymethyl)furan-2(5H)-one (5R)-3,4-Dihydroxy-5-(hydroxymethyl)furan-2(5H)-one|(5R)-3,4-dihydroxy-5-(hydroxymethyl)furan-2(5H)-one|D-erythroascorbic acid|D-glycero-2-pentenono-l,4-lactone http://purl.obolibrary.org/obo/CHEBI_17803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17804 biolink:ChemicalEntity dyspropterin A tetrahydropterin that is 2-amino-5,6,7,8-tetrahydropteridin-4(3H)-one substituted by a 2-oxopropanoyl group at position 6. cas:89687-39-8|hmdb:HMDB0001195|kegg.compound:C03684|metacyc.compound:6-PYRUVOYL-5678-TETRAHYDROPTERIN|pubmed:3888282 Graph 1-(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)propane-1,2-dione|6-(1,2-Dioxopropyl)-5,6,7,8-tetrahydropterin|6-(1,2-dioxopropyl)-5,6,7,8-tetrahydropterin|6-Pyruvoyl-5,6,7,8-tetrahydropterin|6-Pyruvoyltetrahydropterin|6-pyruvoyl-5,6,7,8-tetrahydropterin 1-(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)propane-1,2-dione 1-(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)propane-1,2-dione|6-(1,2-Dioxopropyl)-5,6,7,8-tetrahydropterin|6-(1,2-dioxopropyl)-5,6,7,8-tetrahydropterin|6-Pyruvoyl-5,6,7,8-tetrahydropterin|6-Pyruvoyltetrahydropterin|6-pyruvoyl-5,6,7,8-tetrahydropterin http://purl.obolibrary.org/obo/CHEBI_17804 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17805 biolink:ChemicalEntity D-erythro-1-(imidazol-4-yl)glycerol 3-phosphate kegg.compound:C04666|knapsack:C00007478 Graph (2R,3S)-2,3-dihydroxy-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate|D-erythro-1-(Imidazol-4-yl)glycerol 3-phosphate|D-erythro-Imidazole-glycerol 3-phosphate|D-erythro-Imidazole-glycerol phosphate (2R,3S)-2,3-dihydroxy-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate (2R,3S)-2,3-dihydroxy-3-(1H-imidazol-4-yl)propyl dihydrogen phosphate|D-erythro-1-(Imidazol-4-yl)glycerol 3-phosphate|D-erythro-Imidazole-glycerol 3-phosphate|D-erythro-Imidazole-glycerol phosphate http://purl.obolibrary.org/obo/CHEBI_17805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178051 biolink:ChemicalEntity a carboxymycobactin(1-) Graph a carboxymycobactin a carboxymycobactin http://purl.obolibrary.org/obo/CHEBI_178051 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:178058 biolink:ChemicalEntity alpha-ketoglutarate-13C4 Graph 2-oxo(1,2,3,4-13C4)pentanedioate 2-oxo(1,2,3,4-13C4)pentanedioate 2-oxo(1,2,3,4-13C4)pentanedioate http://purl.obolibrary.org/obo/CHEBI_178058 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17806 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl group The glycosyl group obtained by removing the hydroxy group from the hemiacetal function of N-acetyl-β-D-galactosamine. pubmed:26014598|pubmed:28701697 Graph 2-acetamido-2-deoxy-beta-D-galactopyranosyl|2-acetamido-2-deoxy-beta-D-galactopyranosyl group|N-Acetyl-D-galactosaminyl-R|N-acetyl-beta-D-galactosaminyl group|NAc-beta-1,4-galactose|beta-GalNAc-R 2-acetamido-2-deoxy-beta-D-galactopyranosyl 2-acetamido-2-deoxy-beta-D-galactopyranosyl|2-acetamido-2-deoxy-beta-D-galactopyranosyl group|N-Acetyl-D-galactosaminyl-R|N-acetyl-beta-D-galactosaminyl group|NAc-beta-1,4-galactose|beta-GalNAc-R http://purl.obolibrary.org/obo/CHEBI_17806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17807 biolink:ChemicalEntity 3-(3,4-dihydroxyphenyl)lactic acid kegg.compound:C01207 Graph 3-(3,4-Dihydroxyphenyl)lactate|3-(3,4-dihydroxyphenyl)-2-hydroxypropanoic acid 3-(3,4-dihydroxyphenyl)-2-hydroxypropanoic acid 3-(3,4-Dihydroxyphenyl)lactate|3-(3,4-dihydroxyphenyl)-2-hydroxypropanoic acid http://purl.obolibrary.org/obo/CHEBI_17807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17808 biolink:ChemicalEntity IDP A purine ribonucleoside 5'-diphosphate having inosine as the nucleobase. cas:86-04-4|ecmdb:ECMDB03335|hmdb:HMDB0003335|kegg.compound:C00104|metacyc.compound:IDP|pdb-ccd:IDP|pubmed:14389294|pubmed:16668340|pubmed:19561621|pubmed:22673202|reaxys:634026|ymdb:YMDB00910 Graph 2'-inosine-5'-diphosphate|IDP|INOSINE-5'-DIPHOSPHATE|Inosine 5'-diphosphate|Inosine 5'-pyrophosphate|Inosine diphosphate|inosine 5'-(trihydrogen diphosphate) Inosine 5'-diphosphate|inosine 5'-(trihydrogen diphosphate) 2'-inosine-5'-diphosphate|IDP|INOSINE-5'-DIPHOSPHATE|Inosine 5'-diphosphate|Inosine 5'-pyrophosphate|Inosine diphosphate|inosine 5'-(trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17808 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178083 biolink:ChemicalEntity alpha-ketoglutaric acid-13C4 Graph http://purl.obolibrary.org/obo/CHEBI_178083 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17810 biolink:ChemicalEntity 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine A glycero-3-phosphocholine compound having an alk-1-enyl substituent at the 1-position and an acyl substituent at the 2-position. kegg.compound:C00958 Graph 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphocholine|1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphocholines|1-Alkenyl-2-acyl-sn-glycero-3-phosphocholine|1-Alkenyl-2-acylglycerophosphocholine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholines|2-Acyl-1-(1-alkenyl)-sn-glycero-3-phosphocholine|Choline plasmalogen|Plasmenylcholine 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphocholine|1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphocholines|1-Alkenyl-2-acyl-sn-glycero-3-phosphocholine|1-Alkenyl-2-acylglycerophosphocholine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine|1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholines|2-Acyl-1-(1-alkenyl)-sn-glycero-3-phosphocholine|Choline plasmalogen|Plasmenylcholine http://purl.obolibrary.org/obo/CHEBI_17810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17811 biolink:ChemicalEntity myo-2-inosose cas:488-64-2|kegg.compound:C00691 Graph 2,4,6/3,5-Pentahydroxycyclohexanone|2,4,6/3,5-pentahydroxycyclohexanone|2-Inosose|2-inosose|myo-inosose-2|scyllo-1-inosose|scyllo-inosose 2,4,6/3,5-Pentahydroxycyclohexanone|2,4,6/3,5-pentahydroxycyclohexanone 2,4,6/3,5-Pentahydroxycyclohexanone|2,4,6/3,5-pentahydroxycyclohexanone|2-Inosose|2-inosose|myo-inosose-2|scyllo-1-inosose|scyllo-inosose http://purl.obolibrary.org/obo/CHEBI_17811 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17813 biolink:ChemicalEntity 4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol cas:64284-64-6|kegg.compound:C11455|lipidmaps:LMST01010149 Graph 4,4-Dimechol-8,14,24-trienol|4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol|4,4-Dimethylcholesta-8,14,24-trienol|4,4-dimethyl-5-alpha-cholesta-8,14,24-trien-3-beta-ol|4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol|4,4-dimethylcholesta-8(9),14,24-trien-3beta-ol 4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol|4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol 4,4-Dimechol-8,14,24-trienol|4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol|4,4-Dimethylcholesta-8,14,24-trienol|4,4-dimethyl-5-alpha-cholesta-8,14,24-trien-3-beta-ol|4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol|4,4-dimethylcholesta-8(9),14,24-trien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_17813 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178134 biolink:ChemicalEntity 4-Carboxyphenylglycine cas:7292-81-1|chemspider:4934|hmdb:HMDB0002016 Graph 4-[amino(carboxy)methyl]benzoic acid 4-[amino(carboxy)methyl]benzoic acid 4-[amino(carboxy)methyl]benzoic acid http://purl.obolibrary.org/obo/CHEBI_178134 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17814 biolink:ChemicalEntity salicin An aryl β-D-glucoside that is salicyl alcohol in which the phenolic hydrogen has been replaced by a β-D-glucosyl residue. cas:138-52-3|kegg.compound:C01451|knapsack:C00002672|lincs.smallmolecule:LSM-3442|pubmed:12221594|pubmed:20883292|pubmed:21226125|pubmed:21449910|reaxys:89593|wikipedia.en:Salicin Graph 2(hydroxymethyl)phenyl-beta-D-glucopyranoside|2-(hydroxymethyl)phenyl beta-D-glucopyranoside|2-(hydroxymethyl)phenyl-O-beta-D-glucopyranoside|2-(hydroxymethyl)phenyl-beta-D-glucopyranoside|D-(-)-salicin|Salicin|Salicoside|o-(hydroxymethyl)phenyl beta-D-glucopyranoside|salicin|salicyl alcohol glucoside|saligenin beta-D-glucopyranoside 2-(hydroxymethyl)phenyl beta-D-glucopyranoside 2(hydroxymethyl)phenyl-beta-D-glucopyranoside|2-(hydroxymethyl)phenyl beta-D-glucopyranoside|2-(hydroxymethyl)phenyl-O-beta-D-glucopyranoside|2-(hydroxymethyl)phenyl-beta-D-glucopyranoside|D-(-)-salicin|Salicin|Salicoside|o-(hydroxymethyl)phenyl beta-D-glucopyranoside|salicin|salicyl alcohol glucoside|saligenin beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_17814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178143 biolink:ChemicalEntity Chalcomoracin chemspider:384495|hmdb:HMDB0030069 Graph [2-[2,6-dihydroxy-4-(6-hydroxy-1-benzouran-2-yl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methylcyclohex-3-en-1-yl]-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]methanone [2-[2,6-dihydroxy-4-(6-hydroxy-1-benzouran-2-yl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methylcyclohex-3-en-1-yl]-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]methanone [2-[2,6-dihydroxy-4-(6-hydroxy-1-benzouran-2-yl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methylcyclohex-3-en-1-yl]-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]methanone http://purl.obolibrary.org/obo/CHEBI_178143 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17815 biolink:ChemicalEntity 1,2-diacyl-sn-glycerol kegg.compound:C00641|lipidmaps:LMGL02010000 Graph 1,2-Diacyl-sn-glycerol|1,2-Diacylglycerol|1,2-diacyl-sn-glycerols|D-1,2-Diacylglycerol|L-1,2-Diacylglycerol|a 1,2-diacyl-sn-glycerol 1,2-Diacyl-sn-glycerol|1,2-Diacylglycerol|1,2-diacyl-sn-glycerols|D-1,2-Diacylglycerol|L-1,2-Diacylglycerol|a 1,2-diacyl-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_17815 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17816 biolink:ChemicalEntity 1D-myo-inositol 1,4-bisphosphate beilstein:3628157|cas:47055-78-7|cas:74465-19-3|drugbank:DB03158|kegg.compound:C01220|knapsack:C00007484|pdb-ccd:2IP Graph 1D-myo-Inositol 1,4-bisphosphate|1D-myo-inositol 1,4-bis(dihydrogen phosphate)|D-MYO-INOSITOL-1,4-BISPHOSPHATE|D-myo-Inositol 1,4-bisphosphate|Inositol 1,4-bisphosphate|myo-Inositol 1,4-bisphosphate|myo-inositol 1,4-bisphosphate 1D-myo-inositol 1,4-bis(dihydrogen phosphate) 1D-myo-Inositol 1,4-bisphosphate|1D-myo-inositol 1,4-bis(dihydrogen phosphate)|D-MYO-INOSITOL-1,4-BISPHOSPHATE|D-myo-Inositol 1,4-bisphosphate|Inositol 1,4-bisphosphate|myo-Inositol 1,4-bisphosphate|myo-inositol 1,4-bisphosphate http://purl.obolibrary.org/obo/CHEBI_17816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17818 biolink:ChemicalEntity N-feruloyltyramine cas:65646-26-6|cas:66648-43-9|kegg.compound:C02717|knapsack:C00000660 Graph (2E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide|Moupinamide|N-((E)-feruloyl)tyramine|N-Feruloyltyramine|trans-N-Feruloyltyramine (2E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide (2E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide|Moupinamide|N-((E)-feruloyl)tyramine|N-Feruloyltyramine|trans-N-Feruloyltyramine http://purl.obolibrary.org/obo/CHEBI_17818 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178184 biolink:ChemicalEntity Silidianin cas:29782-68-1|chemspider:10154881|hmdb:HMDB0030584 Graph 3-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-8-(3,5,7-trihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-4-oxatricyclo[4.3.1.03,7]decan-2-one 3-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-8-(3,5,7-trihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-4-oxatricyclo[4.3.1.03,7]decan-2-one 3-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-8-(3,5,7-trihydroxy-4-oxo-2,3-dihydrochromen-2-yl)-4-oxatricyclo[4.3.1.03,7]decan-2-one http://purl.obolibrary.org/obo/CHEBI_178184 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:178193 biolink:ChemicalEntity L-lanthionine dizwitterion An L-α-amino acid zwitterion that is the dizwitterionic form of L-lanthionine obtained by migration of protons from both carboxy groups to the amino groups; major species at pH 7.3. metacyc.compound:CPD-3736|pubmed:19261609 Graph (2R,2'R)-3,3'-sulfanediylbis(2-azaniumylpropanoate)|3,3'-thiobis-L-alanine dizwitterion|3,3'-thiodi-L-alanine dizwitterion|L-lanthionine|L-lanthionine zwitterion|beta,beta'-thiodi-L-alanine dizwitterion (2R,2'R)-3,3'-sulfanediylbis(2-azaniumylpropanoate) (2R,2'R)-3,3'-sulfanediylbis(2-azaniumylpropanoate)|3,3'-thiobis-L-alanine dizwitterion|3,3'-thiodi-L-alanine dizwitterion|L-lanthionine|L-lanthionine zwitterion|beta,beta'-thiodi-L-alanine dizwitterion http://purl.obolibrary.org/obo/CHEBI_178193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178194 biolink:ChemicalEntity L-homolanthionine dizwitterion An L-α-amino acid zwitterion that is the dizwitterionic form of L-homolanthionine obtained by migration of protons from both carboxy groups to the amino groups; major species at pH 7.3. metacyc.compound:CPD66-96|pubmed:19261609 Graph (2S,2'S)-4,4'-sulfanediylbis(2-azaniumylbutanoate)|L-homolanthionine|L-homolanthionine zwitterion|homolanthionine dizwitterion (2S,2'S)-4,4'-sulfanediylbis(2-azaniumylbutanoate) (2S,2'S)-4,4'-sulfanediylbis(2-azaniumylbutanoate)|L-homolanthionine|L-homolanthionine zwitterion|homolanthionine dizwitterion http://purl.obolibrary.org/obo/CHEBI_178194 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178199 biolink:ChemicalEntity sotorasib A pyridopyrimidine that is pyrido[2,3-d]pyrimidin-2(1H)-one substituted by 4-methyl-2-(propan-2-yl)pyridin-3-yl, (2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl, fluoro and 2-fluoro-6-hydroxyphenyl groups at positions 1, 4, 6 and 7, respectively. It is approved for the treatment of patients with non-small cell lung cancer having KRASG12C mutations. cas:2296729-00-3|chemspider:72380148|drugbank:DB15569|kegg.drug:D12055|pubmed:31189530|pubmed:31666701|pubmed:31820981|pubmed:32540954|pubmed:32686745|pubmed:32955176|pubmed:33283304|pubmed:33466360|pubmed:33547148|pubmed:33957355|pubmed:33971321|pubmed:34004237|pubmed:34043291|pubmed:34094546|pubmed:34096690|pubmed:34137282|pubmed:34140669|pubmed:34144959|pubmed:34158284|pubmed:34219153|pubmed:34301758|pubmed:34357500|pubmed:34359807|wikipedia.en:Sotorasib Graph 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(propan-2-yl)pyridin-3-yl]-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-2(1H)-one|AMG 510|AMG-510|AMG510|Lumakras|sotorasib|sotorasibum 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(propan-2-yl)pyridin-3-yl]-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-2(1H)-one 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-[4-methyl-2-(propan-2-yl)pyridin-3-yl]-4-[(2S)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-2(1H)-one|AMG 510|AMG-510|AMG510|Lumakras|sotorasib|sotorasibum http://purl.obolibrary.org/obo/CHEBI_178199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17820 biolink:ChemicalEntity 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid Penta-2,4-dienoic acid in which the hydrogen at position 2 is substituted by hydroxy and one of the hydrogens at position 5 is substituted by a benzoyl group. It is a metabolic product of biphenyl from Pseudomonas putida. beilstein:2723676|cas:50480-67-6|kegg.compound:C01273|umbbd.compound:c0374 Graph 2,6-Dioxo-6-phenylhexa-3-enoate|2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate|2-hydroxy-6-oxo-6-phenyl-2,4-hexadienoic acid|2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid|HDPA|HOPDA 2,6-Dioxo-6-phenylhexa-3-enoate|2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid 2,6-Dioxo-6-phenylhexa-3-enoate|2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate|2-hydroxy-6-oxo-6-phenyl-2,4-hexadienoic acid|2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid|HDPA|HOPDA http://purl.obolibrary.org/obo/CHEBI_17820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17821 biolink:ChemicalEntity thymine A pyrimidine nucleobase that is uracil in which the hydrogen at position 5 is replaced by a methyl group. beilstein:607626|cas:65-71-4|drugbank:DB03462|gmelin:278790|kegg.compound:C00178|knapsack:C00001511|pdb-ccd:TDR|pubmed:23237383|wikipedia.en:Thymine Graph 2,4-dihydroxy-5-methylpyrimidine|5-Methyluracil|5-methyl-2,4(1H,3H)-pyrimidinedione|5-methylpyrimidine-2,4(1H,3H)-dione|5-methyluracil|T|THYMINE|Thy|Thymin|Thymine|thymine THYMINE|Thymine|thymine 2,4-dihydroxy-5-methylpyrimidine|5-Methyluracil|5-methyl-2,4(1H,3H)-pyrimidinedione|5-methylpyrimidine-2,4(1H,3H)-dione|5-methyluracil|T|THYMINE|Thy|Thymin|Thymine|thymine http://purl.obolibrary.org/obo/CHEBI_17821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17822 biolink:ChemicalEntity serine An α-amino acid that is alanine substituted at position 3 by a hydroxy group. cas:302-84-1|gmelin:26429|kegg.compound:C00716|knapsack:C00001393|reaxys:1721402|wikipedia.en:Serine Graph 2-Amino-3-hydroxypropionic acid|2-amino-3-hydroxypropanoic acid|3-Hydroxyalanine|Serin|Serine|serine Serine|serine 2-Amino-3-hydroxypropionic acid|2-amino-3-hydroxypropanoic acid|3-Hydroxyalanine|Serin|Serine|serine http://purl.obolibrary.org/obo/CHEBI_17822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17823 biolink:ChemicalEntity calcitriol A hydroxycalciol that is calcidiol in which the pro-S hydrogen of calcidiol is replaced by a hydroxy group. It is the active form of vitamin D3, produced fom calciol via hydoxylation in the liver to form calcidiol, which is subsequently oxidised in the kidney to give calcitriol. cas:32222-06-3|drugbank:DB00136|drugcentral:466|kegg.compound:C01673|kegg.drug:D00129|lipidmaps:LMST03020258|metacyc.compound:CALCITRIOL|pdb-ccd:VDX|pubmed:10217585|pubmed:15928596|pubmed:19429426|pubmed:20599255|pubmed:22905919|pubmed:23103122|pubmed:23144765|pubmed:6687801|reaxys:2227647|wikipedia.en:Calcitriol Graph (1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|(1S,3R,5Z,7E)-9,10-secocholesta-5,7,10-triene-1,3,25-triol|(1alpha,3beta,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|(5Z,7E)-(1S,3R)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|1,25-DHCC|1-alpha-25-Dihydroxyvitamin D3|1alpha,25(OH)2D3|1alpha,25-dihydroxycholecalciferol|1alpha,25-dihydroxyvitamin D3|5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANE-1,3-DIOL|Calcijex|Calcitriol|Decostriol|Rocaltrol|calcitriol|calcitriolum (1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol (1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|(1S,3R,5Z,7E)-9,10-secocholesta-5,7,10-triene-1,3,25-triol|(1alpha,3beta,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|(5Z,7E)-(1S,3R)-9,10-secocholesta-5,7,10(19)-triene-1,3,25-triol|1,25-DHCC|1-alpha-25-Dihydroxyvitamin D3|1alpha,25(OH)2D3|1alpha,25-dihydroxycholecalciferol|1alpha,25-dihydroxyvitamin D3|5-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANE-1,3-DIOL|Calcijex|Calcitriol|Decostriol|Rocaltrol|calcitriol|calcitriolum http://purl.obolibrary.org/obo/CHEBI_17823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17824 biolink:ChemicalEntity propan-2-ol A secondary alcohol that is propane in which one of the hydrogens attached to the central carbon is substituted by a hydroxy group. cas:67-63-0|drugbank:DB04402|drugcentral:4215|gmelin:1464|hmdb:HMDB0000863|kegg.compound:C01845|kegg.drug:D00137|knapsack:C00048438|metacyc.compound:ISO-PROPANOL|pdb-ccd:IPA|pubmed:24524727|pubmed:24653974|reaxys:635639|umbbd.compound:c0519|wikipedia.en:Isopropyl_Alcohol|ymdb:YMDB01718 Graph 1-methylethanol|1-methylethyl alcohol|2-Propanol|2-hydroxypropane|IPA|ISOPROPYL ALCOHOL|Isopropanol|Isopropyl alcohol|Isopropylalkohol|Propan-2-ol|i-Propylalkohol|i-propanol|isopropyl alcohol|propan-2-ol|sec-propanol Propan-2-ol|propan-2-ol 1-methylethanol|1-methylethyl alcohol|2-Propanol|2-hydroxypropane|IPA|ISOPROPYL ALCOHOL|Isopropanol|Isopropyl alcohol|Isopropylalkohol|Propan-2-ol|i-Propylalkohol|i-propanol|isopropyl alcohol|propan-2-ol|sec-propanol http://purl.obolibrary.org/obo/CHEBI_17824 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17825 biolink:ChemicalEntity 7-methylguanosine 5'-phosphate(1+) hmdb:HMDB0059612|kegg.compound:C03998|pdb-ccd:G7M Graph 7-Methylguanosine 5'-phosphate|7-methyl-5'-guanylic acid|7-methylguanosine 5'-(dihydrogen phosphate) 7-methyl-5'-guanylic acid 7-Methylguanosine 5'-phosphate|7-methyl-5'-guanylic acid|7-methylguanosine 5'-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17826 biolink:ChemicalEntity methylarsonous acid A one-carbon compound that is arsonous acid in which the hydrogen attached to arsenic is replaced by a methyl group. cas:25400-23-1|foodb.food:FDB028898|hmdb:HMDB0012259|kegg.compound:C07295|metacyc.compound:METHYLARSONITE|pdb-ccd:6OL|pubmed:10698679|pubmed:16581540|pubmed:18701095|pubmed:19095002|pubmed:21193388|pubmed:22398986|pubmed:23891734|pubmed:24091636|pubmed:24625837|pubmed:24915088|pubmed:25092648|pubmed:26554712|pubmed:27327130|pubmed:34274428|reaxys:2231128|umbbd.compound:c0772 Graph MMA(III)|MMAIII|MeAs(OH)2|Methanearsonous acid|Methylarsonite|Methylarsonous acid|Mma(III)|Monomethylarsonous acid|methylarsonous acid|monomethylarsenous acid Methylarsonite|Methylarsonous acid|methylarsonous acid MMA(III)|MMAIII|MeAs(OH)2|Methanearsonous acid|Methylarsonite|Methylarsonous acid|Mma(III)|Monomethylarsonous acid|methylarsonous acid|monomethylarsenous acid http://purl.obolibrary.org/obo/CHEBI_17826 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17827 biolink:ChemicalEntity methyl-CoM beilstein:1754074|cas:53501-90-9|kegg.compound:C03920|knapsack:C00000762|umbbd.compound:c0353 Graph 2-(Methylthio)ethanesulfonate|2-(methylsulfanyl)ethanesulfonic acid|2-(methylthio)ethanesulfonic acid|Methyl CoM|Methylcoenzym M|Methylcoenzyme M|methyl coenzyme M|methyl-coenzyme M|metilcoenzima M 2-(methylsulfanyl)ethanesulfonic acid 2-(Methylthio)ethanesulfonate|2-(methylsulfanyl)ethanesulfonic acid|2-(methylthio)ethanesulfonic acid|Methyl CoM|Methylcoenzym M|Methylcoenzyme M|methyl coenzyme M|methyl-coenzyme M|metilcoenzima M http://purl.obolibrary.org/obo/CHEBI_17827 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17828 biolink:ChemicalEntity 2,3-dihydroxyindole kegg.compound:C02775 Graph 1H-indole-2,3-diol|2,3-Dihydroxyindole|2,3-dihydroxyindole|Dihydroxyindole 1H-indole-2,3-diol 1H-indole-2,3-diol|2,3-Dihydroxyindole|2,3-dihydroxyindole|Dihydroxyindole http://purl.obolibrary.org/obo/CHEBI_17828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17830 biolink:ChemicalEntity 7,8-diaminononanoate kegg.compound:C01037 Graph 7,8-diaminononanoate 7,8-diaminononanoate 7,8-diaminononanoate http://purl.obolibrary.org/obo/CHEBI_17830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17831 biolink:ChemicalEntity heparosan-N-sulfate D-glucuronic acid A heparan sulfate composed of a backbone of repeating β-D-glucuronosyl-(1→4)-N-sulfonyl-α-D-glucosamine units joined by (1→4)-linkages. kegg.compound:C04196|pubmed:16860191 Graph Heparosan-N-sulfate D-glucuronate|[4)-beta-D-GlcA-(1->4)-alpha-D-GlcNS-(1->]n|[4)-beta-D-GlcpA-(1->4)-alpha-D-GlcpNS-(1->]n|poly[(1->4)-(beta-D-glucopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl]|poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-sulfo-alpha-D-glucosaminyl] poly[(1->4)-(beta-D-glucopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl] Heparosan-N-sulfate D-glucuronate|[4)-beta-D-GlcA-(1->4)-alpha-D-GlcNS-(1->]n|[4)-beta-D-GlcpA-(1->4)-alpha-D-GlcpNS-(1->]n|poly[(1->4)-(beta-D-glucopyranosyluronic acid)-(1->4)-2-deoxy-2-sulfoamino-alpha-D-glucopyranosyl]|poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-sulfo-alpha-D-glucosaminyl] http://purl.obolibrary.org/obo/CHEBI_17831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17832 biolink:ChemicalEntity 1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine An sn-glycero-3-phosphocholine substituted at the 1-oxygen by an alk-1-enyl group. kegg.compound:C04517 Graph 1-(1-Alkenyl)-sn-glycero-3-phosphocholine|1-Alkenyl-sn-glycero-3-phosphocholine|1-Alkenylglycerophosphocholine|1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine|1-O-Alk-1-enyl-glycero-3-phosphocholine 1-(1-Alkenyl)-sn-glycero-3-phosphocholine|1-Alkenyl-sn-glycero-3-phosphocholine|1-Alkenylglycerophosphocholine|1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine|1-O-Alk-1-enyl-glycero-3-phosphocholine http://purl.obolibrary.org/obo/CHEBI_17832 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17833 biolink:ChemicalEntity gentamycin Any of a group of aminoglycoside antibiotics produced by fermentation of some Micromonospora spp. cas:1403-66-3|drugbank:DB00798|kegg.compound:C00505 Graph 4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)heptopyranoside|Gentamicin|gentamycins 4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)heptopyranoside 4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)heptopyranoside|Gentamicin|gentamycins http://purl.obolibrary.org/obo/CHEBI_17833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17835 biolink:ChemicalEntity 2-phospho-D-glyceric acid A 2-phosphoglyceric acid in which the glyceric acid moiety has D (R) configuration. drugbank:DB03465|hmdb:HMDB0003391|kegg.compound:C00631|knapsack:C00000123|metacyc.compound:2-PG|pdb-ccd:2PG|pubmed:15299448|pubmed:22750626|pubmed:24430205|reaxys:1726823 Graph (2R)-3-hydroxy-2-(phosphonooxy)propanoic acid|2-PHOSPHOGLYCERIC ACID|2-Phospho-D-glycerate|2-phospho-D-glycerate|D-Glycerate 2-phosphate|D-glycerate 2-phosphate (2R)-3-hydroxy-2-(phosphonooxy)propanoic acid (2R)-3-hydroxy-2-(phosphonooxy)propanoic acid|2-PHOSPHOGLYCERIC ACID|2-Phospho-D-glycerate|2-phospho-D-glycerate|D-Glycerate 2-phosphate|D-glycerate 2-phosphate http://purl.obolibrary.org/obo/CHEBI_17835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17836 biolink:ChemicalEntity 4-aminobenzoate An aromatic amino-acid anion that is the conjugate base of 4-aminobenzoic acid. cas:2906-28-7|gmelin:82609|kegg.compound:C00568|reaxys:3904778|umbbd.compound:c0550 Graph 4-aminobenzoate|4-aminobenzoic acid, ion(1-)|p-aminobenzoate 4-aminobenzoate 4-aminobenzoate|4-aminobenzoic acid, ion(1-)|p-aminobenzoate http://purl.obolibrary.org/obo/CHEBI_17836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17837 biolink:ChemicalEntity D-tagatose 6-phosphate Graph 6-O-phosphono-D-lyxo-hex-2-ulose|6-O-phosphono-D-tagatose|D-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|D-tagatose 6-(dihydrogen phosphate) 6-O-phosphono-D-lyxo-hex-2-ulose|6-O-phosphono-D-tagatose|D-lyxo-hex-2-ulose 6-(dihydrogen phosphate)|D-tagatose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17837 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17838 biolink:ChemicalEntity (3S)-3-hydroxy-L-aspartate(2-) Graph (2S,3S)-2-amino-3-hydroxybutanedioate|(3S)-3-hydroxy-L-aspartate (2S,3S)-2-amino-3-hydroxybutanedioate|(3S)-3-hydroxy-L-aspartate (2S,3S)-2-amino-3-hydroxybutanedioate|(3S)-3-hydroxy-L-aspartate http://purl.obolibrary.org/obo/CHEBI_17838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17839 biolink:ChemicalEntity 7,8-dihydropteroate A pteroate that is the conjugate base of 7,8-dihydropteroic acid, arising from deprotonation of the carboxy group. kegg.compound:C00921|metacyc.compound:7-8-DIHYDROPTEROATE|pubmed:9118956 Graph 4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoate|7,8-dihydropteroate 4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoate 4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}benzoate|7,8-dihydropteroate http://purl.obolibrary.org/obo/CHEBI_17839 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1784 biolink:ChemicalEntity biphenyl-4-amine An aminobiphenyl that is biphenyl substituted by an amino group at position 4. cas:92-67-1|gmelin:365629|hmdb:HMDB0013195|kegg.compound:C10998|pubmed:12778203|pubmed:15880493|pubmed:20433335|pubmed:841184|pubmed:8847111|reaxys:386533|wikipedia.en:4-Aminobiphenyl Graph 4-Aminobiphenyl|4-amino-1,1'-biphenyl|4-aminodiphenyl|4-biphenylamine|[1,1'-biphenyl]-4-amine|biphenyl-4-ylamine|p-aminodiphenyl|p-biphenylamine|p-phenylaniline|p-xenylamine|paraaminodiphenyl [1,1'-biphenyl]-4-amine 4-Aminobiphenyl|4-amino-1,1'-biphenyl|4-aminodiphenyl|4-biphenylamine|[1,1'-biphenyl]-4-amine|biphenyl-4-ylamine|p-aminodiphenyl|p-biphenylamine|p-phenylaniline|p-xenylamine|paraaminodiphenyl http://purl.obolibrary.org/obo/CHEBI_1784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17840 biolink:ChemicalEntity indoxyl A member of the class of hydroxyindoles that is 1H-indole substituted by a hydroxy group at position 3. cas:480-93-3|kegg.compound:C05658|reaxys:3028 Graph 1H-indol-3-ol|Indoxyl|indoxyl 1H-indol-3-ol 1H-indol-3-ol|Indoxyl|indoxyl http://purl.obolibrary.org/obo/CHEBI_17840 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17842 biolink:ChemicalEntity trypanothione beilstein:6559471|cas:96304-42-6|drugbank:DB03470|kegg.compound:C02090|pdb-ccd:GCG Graph (2S,7R,26R,31S)-2,31-diamino-5,8,11,22,25,28-hexaoxo-7,26-bis(sulfanylmethyl)-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid|(2S,7R,26R,31S)-2,31-diamino-7,26-bis(mercaptomethyl)-5,8,11,22,25,28-hexaoxo-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid|BIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINE|N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine|N1,N8-Bis(glutathionyl)spermidine|N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine|N1,N8-Bis-(glutathionyl)spermidine|Reduced trypanothione|TSH|Trypanothion|Trypanothione (2S,7R,26R,31S)-2,31-diamino-5,8,11,22,25,28-hexaoxo-7,26-bis(sulfanylmethyl)-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid (2S,7R,26R,31S)-2,31-diamino-5,8,11,22,25,28-hexaoxo-7,26-bis(sulfanylmethyl)-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid|(2S,7R,26R,31S)-2,31-diamino-7,26-bis(mercaptomethyl)-5,8,11,22,25,28-hexaoxo-6,9,12,16,21,24,27-heptaazadotriacontane-1,32-dioic acid|BIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINE|N1,N8-Bis(gamma-L-glutamyl-L-cysteinyl-glycyl)spermidine|N1,N8-Bis(glutathionyl)spermidine|N1,N8-Bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine|N1,N8-Bis-(glutathionyl)spermidine|Reduced trypanothione|TSH|Trypanothion|Trypanothione http://purl.obolibrary.org/obo/CHEBI_17842 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17843 biolink:ChemicalEntity transfer RNA A single-stranded RNA molecule containing about 70-90 nucleotides, folded by intrastrand base pairing into a characteristic secondary ('cloverleaf') structure that carries a specific amino acid and matches it to its corresponding codon on an mRNA during protein synthesis. cas:9014-25-9|kegg.compound:C00066 Graph RNA, transfer|tRNA|transfer RNA transfer RNA RNA, transfer|tRNA|transfer RNA http://purl.obolibrary.org/obo/CHEBI_17843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17844 biolink:ChemicalEntity 2-amino-3-oxobutanoic acid An α-amino acid that is acetoacetic acid which is substituted by an amino group at position 2. cas:6531-42-6|kegg.compound:C03214 Graph 2-Amino-3-oxobutanoate|2-Amino-acetoacetate|2-amino-3-ketobutyrate|2-amino-3-oxobutanoic acid 2-amino-3-oxobutanoic acid 2-Amino-3-oxobutanoate|2-Amino-acetoacetate|2-amino-3-ketobutyrate|2-amino-3-oxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_17844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17845 biolink:ChemicalEntity 1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol kegg.compound:C04673 Graph 1-[(1S,2S,3R,4S,6R)-2,3,4,6-tetrahydroxy-5-oxocyclohexyl]guanidine|1D-1-Guanidino-1-deoxy-3-dehydro-scyllo-inositol|1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol|Amidino-3-keto-scyllo-inosamine 1-[(1S,2S,3R,4S,6R)-2,3,4,6-tetrahydroxy-5-oxocyclohexyl]guanidine 1-[(1S,2S,3R,4S,6R)-2,3,4,6-tetrahydroxy-5-oxocyclohexyl]guanidine|1D-1-Guanidino-1-deoxy-3-dehydro-scyllo-inositol|1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol|Amidino-3-keto-scyllo-inosamine http://purl.obolibrary.org/obo/CHEBI_17845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17846 biolink:ChemicalEntity (S)-naringenin The (S)-enantiomer of naringenin. cas:480-41-1|drugbank:DB03467|hmdb:HMDB0002670|kegg.compound:C00509|knapsack:C00000982|lipidmaps:LMPK12140001|metacyc.compound:NARINGENIN-CMPD|pdb-ccd:NAR|pubmed:11093936|pubmed:17664077|reaxys:90699|wikipedia.en:Naringenin Graph (-)-(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one|(-)-(2S)-Naringenin|(-)-(2S)-naringenin|(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-Naringenin|(2S)-naringenin|(S)-2,3-dihydo-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|4',5,7-Trihydroxyflavanone|4',5,7-trihydroxyflavanone|NARINGENIN|Naringenin|naringetol|pelargidanon|salipurpol (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one (-)-(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one|(-)-(2S)-Naringenin|(-)-(2S)-naringenin|(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-Naringenin|(2S)-naringenin|(S)-2,3-dihydo-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|4',5,7-Trihydroxyflavanone|4',5,7-trihydroxyflavanone|NARINGENIN|Naringenin|naringetol|pelargidanon|salipurpol http://purl.obolibrary.org/obo/CHEBI_17846 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17847 biolink:ChemicalEntity p-cresol A cresol that consists of toluene substituted by a hydroxy group at position 4. It is a metabolite of aromatic amino acid metabolism produced by intestinal microflora in humans and animals. cas:106-44-5|drugbank:DB01688|gmelin:2779|hmdb:HMDB0001858|kegg.compound:C01468|knapsack:C00002645|metacyc.compound:CPD-108|pdb-ccd:PCR|pubmed:12427124|pubmed:17660685|reaxys:1305151|umbbd.compound:c0127|wikipedia.en:P-cresol Graph 1-hydroxy-4-methylbenzene|4-Cresol|4-Hydroxytoluene|4-Methylphenol|4-methylphenol|P-CRESOL|p-Cresol|p-Kresol|p-methylphenol|p-tolyl alcohol|paracresol 4-methylphenol 1-hydroxy-4-methylbenzene|4-Cresol|4-Hydroxytoluene|4-Methylphenol|4-methylphenol|P-CRESOL|p-Cresol|p-Kresol|p-methylphenol|p-tolyl alcohol|paracresol http://purl.obolibrary.org/obo/CHEBI_17847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17848 biolink:ChemicalEntity 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine A 1,2-diacyl-sn-glycero 3-phosphocholine in which the acyl group at position 1 is unspecified while that at position 2 is specified as oleoyl kegg.compound:C01282 Graph 1-Acyl-2-oleoyl-sn-glycero-3-phosphocholine 1-Acyl-2-oleoyl-sn-glycero-3-phosphocholine http://purl.obolibrary.org/obo/CHEBI_17848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17851 biolink:ChemicalEntity m(7)G(5')pppAm mRNA containing a 2'-O-methyladenosine cap. kegg.compound:C01972|metacyc.compound:CPD-8628|pubmed:1194286|pubmed:513196|pubmed:627567|pubmed:6452534|pubmed:670176|pubmed:670177|pubmed:833934 Graph m(7)G(5')pppA(m)|m7G(5')pppAm m(7)G(5')pppA(m)|m7G(5')pppAm http://purl.obolibrary.org/obo/CHEBI_17851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17852 biolink:ChemicalEntity homocitric acid cas:3562-74-1|kegg.compound:C01251 Graph 2-hydroxybutane-1,2,4-tricarboxylic acid|3-Hydroxy-3-carboxyadipic acid|Homocitric acid 2-hydroxybutane-1,2,4-tricarboxylic acid 2-hydroxybutane-1,2,4-tricarboxylic acid|3-Hydroxy-3-carboxyadipic acid|Homocitric acid http://purl.obolibrary.org/obo/CHEBI_17852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17853 biolink:ChemicalEntity S-acetylcysteamine beilstein:1743121|kegg.compound:C03537 Graph S-(2-aminoethyl) ethanethioate|S-Acetylthioethanolamine S-(2-aminoethyl) ethanethioate S-(2-aminoethyl) ethanethioate|S-Acetylthioethanolamine http://purl.obolibrary.org/obo/CHEBI_17853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17854 biolink:ChemicalEntity cyclohexanone A cyclic ketone that consists of cyclohexane bearing a single oxo substituent. cas:108-94-1|drugbank:DB02060|hmdb:HMDB0003315|kegg.compound:C00414|metacyc.compound:CYCLOHEXANONE|patent:GB310055|patent:US2223493|patent:US2223494|patent:US2285914|pdb-ccd:CYH|ppdb:1308|pubmed:20928898|pubmed:21556397|pubmed:21647476|pubmed:21766129|pubmed:7814101|reaxys:385735|umbbd.compound:c0195|wikipedia.en:Cyclohexanone Graph CYCLOHEXANONE|Cyclohexanone|Cyclohexyl ketone|Ketocyclohexane|Ketohexamethylene|Oxocyclohexane|cyclohexanone CYCLOHEXANONE|Cyclohexanone|cyclohexanone CYCLOHEXANONE|Cyclohexanone|Cyclohexyl ketone|Ketocyclohexane|Ketohexamethylene|Oxocyclohexane|cyclohexanone http://purl.obolibrary.org/obo/CHEBI_17854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17855 biolink:ChemicalEntity triglyceride Any glyceride resulting from the condensation of all three hydroxy groups of glycerol (propane-1,2,3-triol) with fatty acids. kegg.compound:C00422|lipidmaps_class:LMGL0301|pubmed:2474544 Graph Triacylglycerol|Triglycerid|Triglyceride|Triglyzerid|a triacylglycerol|triacylglycerols|triglycerides triglycerides Triacylglycerol|Triglycerid|Triglyceride|Triglyzerid|a triacylglycerol|triacylglycerols|triglycerides http://purl.obolibrary.org/obo/CHEBI_17855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17856 biolink:ChemicalEntity glucuronoxylan 4-O-methyl-D-glucuronate kegg.compound:C04459|kegg.glycan:G11623 Graph 4-O-Methylglucuronoxylan|Glucuronoxylan 4-O-methyl-D-glucuronate|glucuronoxylan 4-O-methyl-D-glucuronate 4-O-Methylglucuronoxylan|Glucuronoxylan 4-O-methyl-D-glucuronate|glucuronoxylan 4-O-methyl-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_17856 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:17857 biolink:ChemicalEntity 4-methyl-5-(2-phosphonooxyethyl)thiazole beilstein:195538|drugbank:DB03145|kegg.compound:C04327|knapsack:C00007608|pdb-ccd:TZP Graph 2-(4-methyl-1,3-thiazol-5-yl)ethyl dihydrogen phosphate|4-METHYL-5-HYDROXYETHYLTHIAZOLE PHOSPHATE|4-Methyl-5-(2-phosphoethyl)-thiazole|4-Methyl-5-(2-phosphono-oxyethyl)-thiazole|4-methyl-5-(2-phosphonooxyethyl)-thiazole|PHOSPHORIC ACID MONO-[2-(4-METHYL-THIAZOL-5-YL)-ETHYL] ESTER 2-(4-methyl-1,3-thiazol-5-yl)ethyl dihydrogen phosphate 2-(4-methyl-1,3-thiazol-5-yl)ethyl dihydrogen phosphate|4-METHYL-5-HYDROXYETHYLTHIAZOLE PHOSPHATE|4-Methyl-5-(2-phosphoethyl)-thiazole|4-Methyl-5-(2-phosphono-oxyethyl)-thiazole|4-methyl-5-(2-phosphonooxyethyl)-thiazole|PHOSPHORIC ACID MONO-[2-(4-METHYL-THIAZOL-5-YL)-ETHYL] ESTER http://purl.obolibrary.org/obo/CHEBI_17857 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17858 biolink:ChemicalEntity glutathione disulfide cas:27025-41-8|drugbank:DB03310|drugcentral:5130|kegg.compound:C00127|kegg.drug:D00031|pdb-ccd:GDS Graph (2S,2'S)-5,5'-[disulfanediylbis({(2R)-3-[(carboxymethyl)amino]-3-oxopropane-1,2-diyl}imino)]bis(2-amino-5-oxopentanoic acid)|GSSG|Glutathione disulfide|OXIDIZED GLUTATHIONE DISULFIDE|Oxidized glutathione|Oxiglutatione|glutathione disulphide|oxidised glutathione (2S,2'S)-5,5'-[disulfanediylbis({(2R)-3-[(carboxymethyl)amino]-3-oxopropane-1,2-diyl}imino)]bis(2-amino-5-oxopentanoic acid) (2S,2'S)-5,5'-[disulfanediylbis({(2R)-3-[(carboxymethyl)amino]-3-oxopropane-1,2-diyl}imino)]bis(2-amino-5-oxopentanoic acid)|GSSG|Glutathione disulfide|OXIDIZED GLUTATHIONE DISULFIDE|Oxidized glutathione|Oxiglutatione|glutathione disulphide|oxidised glutathione http://purl.obolibrary.org/obo/CHEBI_17858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17859 biolink:ChemicalEntity glutaric acid An α,ω-dicarboxylic acid that is a linear five-carbon dicarboxylic acid. cas:110-94-1|drugbank:DB03553|gmelin:26809|hmdb:HMDB0000661|kegg.compound:C00489|knapsack:C00001184|lipidmaps:LMFA01170046|pdb-ccd:GUA|pubmed:24297153|pubmed:24587932|pubmed:24900967|reaxys:1209725|wikipedia.en:Glutaric_acid Graph 1,3-Propanedicarboxylic acid|1,5-pentanedioic acid|GLUTARIC ACID|Glutaric acid|Glutarsaeure|Pentanedioic acid|pentanedioic acid Pentanedioic acid|pentanedioic acid 1,3-Propanedicarboxylic acid|1,5-pentanedioic acid|GLUTARIC ACID|Glutaric acid|Glutarsaeure|Pentanedioic acid|pentanedioic acid http://purl.obolibrary.org/obo/CHEBI_17859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17860 biolink:ChemicalEntity 6-phospho-2-dehydro-3-deoxy-D-galactonic acid kegg.compound:C01286|pdb-ccd:KDP Graph 2-Dehydro-3-deoxy-D-galactonate 6-phosphate|2-dehydro-3-deoxy-D-galactonate 6-phosphate|6-O-phosphono-3-deoxy-D-threo-hex-2-ulosonic acid 6-O-phosphono-3-deoxy-D-threo-hex-2-ulosonic acid 2-Dehydro-3-deoxy-D-galactonate 6-phosphate|2-dehydro-3-deoxy-D-galactonate 6-phosphate|6-O-phosphono-3-deoxy-D-threo-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_17860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17861 biolink:ChemicalEntity 4-chlorobenzoate A chlorobenzoate that is the conjugate base of 4-chlorobenzoic acid. gmelin:326210|kegg.compound:C02370|reaxys:3904780|umbbd.compound:c0103 Graph 4-chlorobenzoate|p-chlorobenzoate|pCl-benzoate anion 4-chlorobenzoate 4-chlorobenzoate|p-chlorobenzoate|pCl-benzoate anion http://purl.obolibrary.org/obo/CHEBI_17861 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17862 biolink:ChemicalEntity 3-dehydrosphinganine A 2-amino-1-hydroxyoctadecan-3-one that has S-configuration. beilstein:6792651|kegg.compound:C02934|lipidmaps:LMSP01020002|pubmed:4315749|pubmed:4362562|reaxys:6792651 Graph (2S)-2-amino-1-hydroxyoctadecan-3-one|3-Dehydro-D-sphinganine|3-Dehydrosphinganine|3-dehydro-D-sphinganine|3-ketodihydrosphingosine|3-ketosphinganine (2S)-2-amino-1-hydroxyoctadecan-3-one (2S)-2-amino-1-hydroxyoctadecan-3-one|3-Dehydro-D-sphinganine|3-Dehydrosphinganine|3-dehydro-D-sphinganine|3-ketodihydrosphingosine|3-ketosphinganine http://purl.obolibrary.org/obo/CHEBI_17862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17863 biolink:ChemicalEntity cellobiono-1,5-lactone A disaccharide consisting of D-glucono-1,5-lactone having a β-D-glucosyl residue at the 4-position. cas:52762-22-8|kegg.compound:C01093|kegg.glycan:G10590 Graph Cellobiono-1,5-lactone|Cellobionolactone|Cellobiose-1,5-lactone|D-cellobiono-1,5-lactone|beta-D-glucopyranosyl-(1->4)-D-glucono-1,5-lactone Cellobiono-1,5-lactone|Cellobionolactone|Cellobiose-1,5-lactone|D-cellobiono-1,5-lactone|beta-D-glucopyranosyl-(1->4)-D-glucono-1,5-lactone http://purl.obolibrary.org/obo/CHEBI_17863 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17864 biolink:ChemicalEntity taurolithocholic acid sulfate The steroid sulfate of taurolithocholic acid. beilstein:9174999|cas:15324-65-9|hmdb:HMDB0002580|kegg.compound:C03642|lipidmaps:LMST05020003|pubmed:24177139|pubmed:8437507|pubmed:871063|pubmed:894140|reaxys:9174999 Graph (3alpha-sulfato-5beta-cholan-24-oyl)-2'-aminoethanesulfonate|2-[(24-oxo-3alpha-sulfooxy-5beta-cholan-24-yl)amino]ethanesulfonic acid|3alpha-Sulfatolithocholyltaurine|Slct-3-sulfate|TLC-S|Taurolithocholate 3-sulfate|Taurolithocholate sulfate|Taurolithocholic acid 3-sulfate 2-[(24-oxo-3alpha-sulfooxy-5beta-cholan-24-yl)amino]ethanesulfonic acid (3alpha-sulfato-5beta-cholan-24-oyl)-2'-aminoethanesulfonate|2-[(24-oxo-3alpha-sulfooxy-5beta-cholan-24-yl)amino]ethanesulfonic acid|3alpha-Sulfatolithocholyltaurine|Slct-3-sulfate|TLC-S|Taurolithocholate 3-sulfate|Taurolithocholate sulfate|Taurolithocholic acid 3-sulfate http://purl.obolibrary.org/obo/CHEBI_17864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17865 biolink:ChemicalEntity 4-methyl-2-oxopentanoate A 2-oxo monocarboxylic acid anion that is the conjugate base of 4-methyl-2-oxopentanoic acid. kegg.compound:C00233|reaxys:3904096 Graph 2-Oxoisocaproate|4-methyl-2-oxopentanoate|alpha-ketoisocaproate 4-methyl-2-oxopentanoate 2-Oxoisocaproate|4-methyl-2-oxopentanoate|alpha-ketoisocaproate http://purl.obolibrary.org/obo/CHEBI_17865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17866 biolink:ChemicalEntity digallate kegg.compound:C01572 Graph 3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyloxy)benzoate|digallate 3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyloxy)benzoate 3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyloxy)benzoate|digallate http://purl.obolibrary.org/obo/CHEBI_17866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17868 biolink:ChemicalEntity 1-palmitoylglycerone 3-phosphate cas:17378-38-0|kegg.compound:C01192 Graph 1-palmitoylglycerone 3-phosphate|2-oxo-3-(phosphonooxy)propyl hexadecanoate|Hexadecanoic acid 2-oxo-3-(phosphonooxy)propyl ester|Hexadecanoyl dihydroxyacetone phosphate|Palmitoyl dihydroxyacetone phosphate|Palmitoyl glycerone phosphate|Palmitoylglycerone phosphate 2-oxo-3-(phosphonooxy)propyl hexadecanoate 1-palmitoylglycerone 3-phosphate|2-oxo-3-(phosphonooxy)propyl hexadecanoate|Hexadecanoic acid 2-oxo-3-(phosphonooxy)propyl ester|Hexadecanoyl dihydroxyacetone phosphate|Palmitoyl dihydroxyacetone phosphate|Palmitoyl glycerone phosphate|Palmitoylglycerone phosphate http://purl.obolibrary.org/obo/CHEBI_17868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17869 biolink:ChemicalEntity 6-hydroxyhexanoic acid An ω-hydroxy fatty acid comprising hexanoic acid having a hydroxy group at the 6-position. cas:1191-25-9|hmdb:HMDB0012843|kegg.compound:C06103|lipidmaps:LMFA01050015|pubmed:14698179|pubmed:6630146|reaxys:1236785 Graph 5-carboxypentanol|5-hydroxypentanecarboxylic acid|6-Hydroxyhexanoate|6-Hydroxyhexanoic acid|6-hydroxy caproic acid|6-hydroxycaproic acid|6-hydroxyhexanoic acid|epsilon-hydroxycaproic acid|epsilon-hydroxyhexanoic acid 6-Hydroxyhexanoic acid|6-hydroxyhexanoic acid 5-carboxypentanol|5-hydroxypentanecarboxylic acid|6-Hydroxyhexanoate|6-Hydroxyhexanoic acid|6-hydroxy caproic acid|6-hydroxycaproic acid|6-hydroxyhexanoic acid|epsilon-hydroxycaproic acid|epsilon-hydroxyhexanoic acid http://purl.obolibrary.org/obo/CHEBI_17869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:178699 biolink:ChemicalEntity Ethanolamine Oleate cas:2272-11-9|chemspider:4445632|drugbank:DB06689|hmdb:HMDB0015638|kegg.drug:D02276 Graph 2-aminoethanol;(Z)-octadec-9-enoic acid 2-aminoethanol;(Z)-octadec-9-enoic acid 2-aminoethanol;(Z)-octadec-9-enoic acid http://purl.obolibrary.org/obo/CHEBI_178699 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17871 biolink:ChemicalEntity 3-hydroxypropanal cas:2134-29-4|kegg.compound:C00969 Graph 3-Hydroxypropanal|3-hydroxypropanal 3-Hydroxypropanal|3-hydroxypropanal 3-Hydroxypropanal|3-hydroxypropanal http://purl.obolibrary.org/obo/CHEBI_17871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17872 biolink:ChemicalEntity 2-oxo-2H-pyran-4,6-dicarboxylic acid kegg.compound:C03671 Graph 2-Pyrone-4,6-dicarboxylate|2-oxo-2H-pyran-4,6-dicarboxylic acid 2-oxo-2H-pyran-4,6-dicarboxylic acid 2-Pyrone-4,6-dicarboxylate|2-oxo-2H-pyran-4,6-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17874 biolink:ChemicalEntity dihydrozeatin A 6-alkylaminopurine that is 7H-purin-6-amine where one of the hydrogens of the amino group is replaced by a 4-hydroxy-3-methylbutyl group. It is an intermediate in the zeatin biosynthesis. cas:23599-75-9|hmdb:HMDB0012215|kegg.compound:C02029|knapsack:C00000093|metacyc.compound:CPD-332|pdb-ccd:WA2|pubmed:20488581|pubmed:22832308|pubmed:24325449|reaxys:1215977 Graph (2R)-2-methyl-4-(7H-purin-6-ylamino)butan-1-ol|2-Methyl-4-(1H-purin-6-ylamino)butan-1-ol|2-methyl-4-(9H-purin-6-ylamino)butan-1-ol|Dihydrozeatin|N(6)-(4-hydroxyisopentanyl)adenine|N6-(4-Hydroxyisopentanyl)adenine|dihydrozeatin (2R)-2-methyl-4-(7H-purin-6-ylamino)butan-1-ol (2R)-2-methyl-4-(7H-purin-6-ylamino)butan-1-ol|2-Methyl-4-(1H-purin-6-ylamino)butan-1-ol|2-methyl-4-(9H-purin-6-ylamino)butan-1-ol|Dihydrozeatin|N(6)-(4-hydroxyisopentanyl)adenine|N6-(4-Hydroxyisopentanyl)adenine|dihydrozeatin http://purl.obolibrary.org/obo/CHEBI_17874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17875 biolink:ChemicalEntity quercetin 3,3'-bissulfate A quercetin bissulfate having sulfo groups at positions 3 and 3'. kegg.compound:C01155|knapsack:C00004960|metacyc.compound:QUERCETIN-33-BISSULFATE|reaxys:3639579 Graph 5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate|Quercetin 3,3'-bissulfate|quercetin 3,3'-bis(hydrogen sulfate) 5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate 5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate|Quercetin 3,3'-bissulfate|quercetin 3,3'-bis(hydrogen sulfate) http://purl.obolibrary.org/obo/CHEBI_17875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17876 biolink:ChemicalEntity rifamycin B cas:13929-35-6|kegg.compound:C01848|lipidmaps:LMPK05000003 Graph 4-O-(Carboxymethyl)rifamycin|Acetic acid, ((1,2-dihydro-5,6,17,19,21-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-2,7-(epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-9-yl)-oxy)-, 21-acetate|Rifamycin B|[(2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-acetyloxy-5,6,17,19-tetrahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-9-yloxy]acetic acid [(2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-acetyloxy-5,6,17,19-tetrahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-9-yloxy]acetic acid 4-O-(Carboxymethyl)rifamycin|Acetic acid, ((1,2-dihydro-5,6,17,19,21-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-2,7-(epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-9-yl)-oxy)-, 21-acetate|Rifamycin B|[(2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-21-acetyloxy-5,6,17,19-tetrahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-9-yloxy]acetic acid http://purl.obolibrary.org/obo/CHEBI_17876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17877 biolink:ChemicalEntity FADH2 beilstein:1208989|cas:1910-41-4|kegg.compound:C01352|pdb-ccd:FDA Graph 1,5-dihydro-FAD|DIHYDROFLAVINE-ADENINE DINUCLEOTIDE|FADH2|adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate)|flavin adenine dinucleotide (reduced) adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate) 1,5-dihydro-FAD|DIHYDROFLAVINE-ADENINE DINUCLEOTIDE|FADH2|adenosine 5'-(3-{D-ribo-5-[7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2H)-yl]-2,3,4-trihydroxypentyl} dihydrogen diphosphate)|flavin adenine dinucleotide (reduced) http://purl.obolibrary.org/obo/CHEBI_17877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17878 biolink:ChemicalEntity 2-hydroxycyclohexan-1-one cas:533-60-8|kegg.compound:C01147 Graph 2-Hydroxycyclohexan-1-one|2-Hydroxycyclohexanone|2-hydroxycyclohexan-1-one|Adipoin 2-Hydroxycyclohexan-1-one|2-hydroxycyclohexan-1-one 2-Hydroxycyclohexan-1-one|2-Hydroxycyclohexanone|2-hydroxycyclohexan-1-one|Adipoin http://purl.obolibrary.org/obo/CHEBI_17878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17879 biolink:ChemicalEntity 4-hydroxybenzoate The conjugate base of 4-hydroxybenzoic acid, comprising a 4-hydroxybenzoic acid core with a proton missing to give a charge of -1. cas:456-23-5|gmelin:326508|kegg.compound:C00156|metacyc.compound:4-hydroxybenzoate|pubmed:35585492|pubmed:36161690|reaxys:3589159|umbbd.compound:c0104 Graph 4-hydroxybenzoate|4-hydroxybenzoic acid, ion(1-)|p-hydroxybenzoate 4-hydroxybenzoate 4-hydroxybenzoate|4-hydroxybenzoic acid, ion(1-)|p-hydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_17879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17881 biolink:ChemicalEntity 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2H)-one kegg.compound:C05155 Graph 5-Amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone|6-(4-amino-5-chloro-6-oxopyridazin-1(6H)-yl)-5-hydroxy-6-oxohexa-2,4-dienoic acid 6-(4-amino-5-chloro-6-oxopyridazin-1(6H)-yl)-5-hydroxy-6-oxohexa-2,4-dienoic acid 5-Amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone|5-amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone|6-(4-amino-5-chloro-6-oxopyridazin-1(6H)-yl)-5-hydroxy-6-oxohexa-2,4-dienoic acid http://purl.obolibrary.org/obo/CHEBI_17881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17882 biolink:ChemicalEntity UDP-N-acetylmuramic acid Graph uridine 5'-(3-{2-acetylamino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) uridine 5'-(3-{2-acetylamino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) uridine 5'-(3-{2-acetylamino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranosyl} dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17882 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17883 biolink:ChemicalEntity hydrogen chloride A mononuclear parent hydride consisting of covalently bonded hydrogen and chlorine atoms. cas:7647-01-0|drugcentral:4568|gmelin:322|hmdb:HMDB0002306|kegg.compound:C01327|kegg.drug:D02057|metacyc.compound:HCL|pubmed:15823700|pubmed:17492841|pubmed:22804993|reaxys:1098214|wikipedia.en:HCl|wikipedia.en:Hydrochloric_acid Graph Chlorwasserstoff|HCl|Hydrochloride|Hydrogen chloride|Hydrogenchlorid|Wasserstoffchlorid|[HCl]|chlorane|chloridohydrogen|chlorure d'hydrogene|cloruro de hidrogeno|hydrochloric acid|hydrogen chloride chlorane|chloridohydrogen|hydrogen chloride Chlorwasserstoff|HCl|Hydrochloride|Hydrogen chloride|Hydrogenchlorid|Wasserstoffchlorid|[HCl]|chlorane|chloridohydrogen|chlorure d'hydrogene|cloruro de hidrogeno|hydrochloric acid|hydrogen chloride http://purl.obolibrary.org/obo/CHEBI_17883 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17884 biolink:ChemicalEntity N(2)-phenylacetyl-L-glutamine An a N2-phenylacetylglutamine having L-configuration. cas:28047-15-6|hmdb:HMDB0006344|kegg.compound:C04148|metacyc.compound:CPD-1097|pubmed:14709615|pubmed:22770225|pubmed:2791363|reaxys:2593680|wikipedia.en:Phenylacetylglutamine Graph N(2)-(phenylacetyl)-L-glutamine|alpha-N-Phenylacetyl-L-glutamine|phenylacetyl-L-glutamine|phenylacetylglutamine N(2)-(phenylacetyl)-L-glutamine N(2)-(phenylacetyl)-L-glutamine|alpha-N-Phenylacetyl-L-glutamine|phenylacetyl-L-glutamine|phenylacetylglutamine http://purl.obolibrary.org/obo/CHEBI_17884 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17885 biolink:ChemicalEntity CDP-glycerol A nucleotide-alditol having cytidine-5'-diphosphate and glycerol as the nucleotide and alditol components respectively. cas:6665-99-2|foodb.food:FDB030719|hmdb:HMDB0059599|pubmed:13382807|pubmed:13911452|pubmed:14506262|pubmed:16344011|pubmed:18723614|pubmed:27795311|pubmed:29884773|pubmed:34255834|pubmed:3935442 Graph CDP-glycerol|cytidine 5'-[3-(2,3-dihydroxypropyl) dihydrogen diphosphate]|cytidine 5'-diphosphate glycerol|cytidine 5'-pyrophosphate, 2,3-dihydroxypropyl ester|cytidine diphosphate glycerol|cytidine diphosphoglycerol cytidine 5'-[3-(2,3-dihydroxypropyl) dihydrogen diphosphate] CDP-glycerol|cytidine 5'-[3-(2,3-dihydroxypropyl) dihydrogen diphosphate]|cytidine 5'-diphosphate glycerol|cytidine 5'-pyrophosphate, 2,3-dihydroxypropyl ester|cytidine diphosphate glycerol|cytidine diphosphoglycerol http://purl.obolibrary.org/obo/CHEBI_17885 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17886 biolink:ChemicalEntity D-tagaturonate Conjugate base of D-tagaturonic acid. beilstein:3907133|kegg.compound:C00558 Graph D-Tagaturonate|D-Tagaturonic acid|D-arabino-hex-5-ulosonate|keto-D-tagaturonate D-arabino-hex-5-ulosonate D-Tagaturonate|D-Tagaturonic acid|D-arabino-hex-5-ulosonate|keto-D-tagaturonate http://purl.obolibrary.org/obo/CHEBI_17886 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17888 biolink:ChemicalEntity 6-phospho-beta-D-glucosyl-(1->4)-D-glucose A disaccharide phosphate consisting of cellobiose having a monophosphate group at the 6'-position. beilstein:10613051 Graph 4-O-(6-O-phosphono-beta-D-glucopyranosyl)-D-glucopyranose|6'-O-phosphonocellobiose|6'-phosphocellobiose|6-O-phosphono-beta-D-glucopyranosyl-(1->4)-D-glucopyranose|6-phospho-beta-D-glucoside-(1,4)-D-glucose|6-phospho-beta-D-glucosyl-(1,4)-D-glucose|cellobiose monophosphate 6-O-phosphono-beta-D-glucopyranosyl-(1->4)-D-glucopyranose 4-O-(6-O-phosphono-beta-D-glucopyranosyl)-D-glucopyranose|6'-O-phosphonocellobiose|6'-phosphocellobiose|6-O-phosphono-beta-D-glucopyranosyl-(1->4)-D-glucopyranose|6-phospho-beta-D-glucoside-(1,4)-D-glucose|6-phospho-beta-D-glucosyl-(1,4)-D-glucose|cellobiose monophosphate http://purl.obolibrary.org/obo/CHEBI_17888 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17889 biolink:ChemicalEntity isopyridoxal A pyridinecarbaldehyde that is pyridine-5-carbaldehyde bearing methyl, hydroxy and hydroxymethyl substituents at positions 2, 3 and 4 respectively. cas:66-72-8|hmdb:HMDB0004290|kegg.compound:C06051|metacyc.compound:CPD-383|pubmed:13702476|pubmed:22770225|pubmed:5769992|reaxys:383768 Graph 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde|Isopyridoxal|isopyridoxal 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde|Isopyridoxal|isopyridoxal http://purl.obolibrary.org/obo/CHEBI_17889 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17890 biolink:ChemicalEntity tryptophol An indolyl alcohol that is ethanol substituted by a 1H-indol-3-yl group at position 2. cas:526-55-6|gmelin:142970|hmdb:HMDB0003447|kegg.compound:C00955|knapsack:C00000114|metacyc.compound:CPD-341|pubmed:10856636|pubmed:12499363|pubmed:16664264|pubmed:19842066|pubmed:23413824|pubmed:24032669|pubmed:24253838|reaxys:125553|wikipedia.en:Tryptophol Graph 1H-indole-3-ethanol|1H-indolyl-3-ethanol|2-(1H-indol-3-yl)ethanol|2-(indol-3-yl)ethanol|3-(2-hydroxyethyl)indole|Indole-3-ethanol|Tryptophanol|Tryptophol|indole-3-ethanol 2-(1H-indol-3-yl)ethanol 1H-indole-3-ethanol|1H-indolyl-3-ethanol|2-(1H-indol-3-yl)ethanol|2-(indol-3-yl)ethanol|3-(2-hydroxyethyl)indole|Indole-3-ethanol|Tryptophanol|Tryptophol|indole-3-ethanol http://purl.obolibrary.org/obo/CHEBI_17890 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17891 biolink:ChemicalEntity donor "A molecular entity that can transfer (""donate"") an electron, a pair of electrons, an atom or a group to another molecular entity." kegg.compound:C01351 Graph Donator|Donor|donneur Donator|Donor|donneur http://purl.obolibrary.org/obo/CHEBI_17891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17892 biolink:ChemicalEntity L-rhamnulose 1-phosphate A deoxyketohexose phosphate consisting of L-rhamnulose having a monophosphate group at the 1-position. beilstein:6143004|cas:444-09-7|kegg.compound:C01131|knapsack:C00019653|pubmed:1092965|pubmed:14339000|pubmed:17645352|pubmed:22735612|pubmed:4208690|pubmed:4975916|pubmed:5339367|pubmed:8774862 Graph 6-deoxy-1-O-phosphono-L-fructose|6-deoxy-L-fructose 1-(dihydrogen phosphate)|L-Rhamnulose 1-phosphate|Rhamnulose 1-phosphate 6-deoxy-L-fructose 1-(dihydrogen phosphate) 6-deoxy-1-O-phosphono-L-fructose|6-deoxy-L-fructose 1-(dihydrogen phosphate)|L-Rhamnulose 1-phosphate|Rhamnulose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_17892 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17893 biolink:ChemicalEntity (2R)-2-hydroxy monocarboxylic acid A 2-hydroxy monocarboxylic acid having (2R)-configuration. kegg.compound:C02489|kegg.compound:C15487 Graph (2R)-2-hydroxy monocarboxylic acids|(2R)-Hydroxy-carboxylate|(R)-2-Hydroxyacid|(R)-2-Hydroxycarboxylic acid (2R)-2-hydroxy monocarboxylic acids|(2R)-Hydroxy-carboxylate|(R)-2-Hydroxyacid|(R)-2-Hydroxycarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17895 biolink:ChemicalEntity L-tyrosine An optically active form of tyrosine having L-configuration. cas:60-18-4|drugbank:DB00135|drugcentral:2786|ecmdb:ECMDB00158|gmelin:50929|hmdb:HMDB0000158|kegg.compound:C00082|kegg.drug:D00022|knapsack:C00001397|metacyc.compound:TYR|pdb-ccd:TYR|pubmed:15171683|pubmed:22360849|pubmed:22402312|reaxys:392441|umbbd.compound:c0234|wikipedia.en:Tyrosine|ymdb:YMDB00364 Graph (-)-alpha-amino-p-hydroxyhydrocinnamic acid|(2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid|(S)-(-)-Tyrosine|(S)-2-Amino-3-(p-hydroxyphenyl)propionic acid|(S)-3-(p-Hydroxyphenyl)alanine|(S)-Tyrosine|(S)-alpha-amino-4-hydroxybenzenepropanoic acid|4-hydroxy-L-phenylalanine|L-Tyrosin|L-Tyrosine|L-tyrosine|TYROSINE|Tyr|Tyrosine|Y L-Tyrosine|L-tyrosine|TYROSINE (-)-alpha-amino-p-hydroxyhydrocinnamic acid|(2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid|(S)-(-)-Tyrosine|(S)-2-Amino-3-(p-hydroxyphenyl)propionic acid|(S)-3-(p-Hydroxyphenyl)alanine|(S)-Tyrosine|(S)-alpha-amino-4-hydroxybenzenepropanoic acid|4-hydroxy-L-phenylalanine|L-Tyrosin|L-Tyrosine|L-tyrosine|TYROSINE|Tyr|Tyrosine|Y http://purl.obolibrary.org/obo/CHEBI_17895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17897 biolink:ChemicalEntity L-rhamnulose A deoxyketohexose consisting of L-fructose lacking the 6-hydroxy group. cas:14807-05-7|foodb.food:FDB027362|hmdb:HMDB0010207|kegg.compound:C00861|knapsack:C00019652|metacyc.compound:RHAMNULOSE|pubmed:13825387|pubmed:20516598|pubmed:23070627|reaxys:1723712 Graph 6-deoxy-L-arabino-hex-2-ulose|6-deoxy-L-fructose|L-Rhamnulose|L-rhamnulose 6-deoxy-L-fructose 6-deoxy-L-arabino-hex-2-ulose|6-deoxy-L-fructose|L-Rhamnulose|L-rhamnulose http://purl.obolibrary.org/obo/CHEBI_17897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17898 biolink:ChemicalEntity all-trans-retinal A retinal in which all four exocyclic double bonds have E- (trans-) geometry. cas:116-31-4|chemspider:553582|foodb.food:FDB030668|hmdb:HMDB0001358|kegg.compound:C00376|lipidmaps:LMPR01090002|metacyc.compound:RETINAL|pdb-ccd:RET|pubmed:12168520|pubmed:15500295|pubmed:15686550|pubmed:15724104|pubmed:16004575|pubmed:16054134|pubmed:16128572|pubmed:17326003|pubmed:21447403|pubmed:21995425|pubmed:22162152|pubmed:22198730|pubmed:22220722|pubmed:22417174|pubmed:22428905|pubmed:22431612|pubmed:22515697|pubmed:22529810|pubmed:22559266|pubmed:22621924|pubmed:22841964|pubmed:22879987|pubmed:26568132|pubmed:28780307|pubmed:31931077|pubmed:32212312|pubmed:32371567|pubmed:32492112|pubmed:33034385|pubmed:33334878|reaxys:1914183|wikipedia.en:Retinal Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|E-retinal|all-E-retinal|all-trans-retinal|all-trans-retinaldehyde|all-trans-retinene|all-trans-vitamin A aldehyde|axerophthal|retinal|retinaldehyde|retinene|retinene 1|retinyl aldehyde|trans-retinal|trans-vitamin A aldehyde|vitamin A aldehyde|vitamin A1 aldehyde (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal|E-retinal|all-E-retinal|all-trans-retinal|all-trans-retinaldehyde|all-trans-retinene|all-trans-vitamin A aldehyde|axerophthal|retinal|retinaldehyde|retinene|retinene 1|retinyl aldehyde|trans-retinal|trans-vitamin A aldehyde|vitamin A aldehyde|vitamin A1 aldehyde http://purl.obolibrary.org/obo/CHEBI_17898 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17899 biolink:ChemicalEntity 7alpha-hydroxycholest-4-en-3-one A cholestanoid consisting of a cholesterol core having an oxo group at the 3-position, a C=C bond at the 4,5-position and an α-hydroxy group at the 7-position. cas:3862-25-7|kegg.compound:C05455|lipidmaps:LMST04030123 Graph 7-alpha-hydroxycholest-4-en-3-one|7alpha-Hydroxy-4-cholesten-3-one|7alpha-Hydroxycholest-4-en-3-one|7alpha-hydroxycholest-4-en-3-one|Cholest-4-en-7alpha-ol-3-one 7alpha-Hydroxycholest-4-en-3-one|7alpha-hydroxycholest-4-en-3-one 7-alpha-hydroxycholest-4-en-3-one|7alpha-Hydroxy-4-cholesten-3-one|7alpha-Hydroxycholest-4-en-3-one|7alpha-hydroxycholest-4-en-3-one|Cholest-4-en-7alpha-ol-3-one http://purl.obolibrary.org/obo/CHEBI_17899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17901 biolink:ChemicalEntity 6-O-acetyl-D-glucose kegg.compound:C02655 Graph 6-Acetyl-D-glucose|6-O-acetyl-D-glucopyranose|6-acetyl-D-glucose 6-O-acetyl-D-glucopyranose 6-Acetyl-D-glucose|6-O-acetyl-D-glucopyranose|6-acetyl-D-glucose http://purl.obolibrary.org/obo/CHEBI_17901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17902 biolink:ChemicalEntity N-carbamoylputrescine An N-substituted putrescine where the N-substituent is a carbamoyl group. cas:6851-51-0|kegg.compound:C00436|knapsack:C00001404 Graph 1-(4-aminobutyl)urea|N-Carbamoylputrescine|N-carbamoylputrescine 1-(4-aminobutyl)urea 1-(4-aminobutyl)urea|N-Carbamoylputrescine|N-carbamoylputrescine http://purl.obolibrary.org/obo/CHEBI_17902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17903 biolink:ChemicalEntity 4-(dimethylamino)azobenzene cas:60-11-7|kegg.compound:C03764 Graph 4-(Dimethylamino)azobenzene|4-(Dimethylamino)phenylazobenzene|4-(N,N-Dimethylamino)azobenzene|4-(Phenylazo)-N,N-dimethylaniline|4-(dimethylamino)azobenzene|Dimethyl yellow|Methyl yellow|N,N-Dimethyl-4-(phenylazo)benzenamine|N,N-dimethyl-4-(phenylazo)aniline|N,N-dimethyl-4-(phenylazo)benzenamine|N,N-dimethyl-4-(phenyldiazenyl)aniline N,N-dimethyl-4-(phenyldiazenyl)aniline 4-(Dimethylamino)azobenzene|4-(Dimethylamino)phenylazobenzene|4-(N,N-Dimethylamino)azobenzene|4-(Phenylazo)-N,N-dimethylaniline|4-(dimethylamino)azobenzene|Dimethyl yellow|Methyl yellow|N,N-Dimethyl-4-(phenylazo)benzenamine|N,N-dimethyl-4-(phenylazo)aniline|N,N-dimethyl-4-(phenylazo)benzenamine|N,N-dimethyl-4-(phenyldiazenyl)aniline http://purl.obolibrary.org/obo/CHEBI_17903 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17905 biolink:ChemicalEntity coenzyme M An organosulfonic acid consisting of sulfonic acid having a 2-mercaptoethyl group attached to sulfur. cas:3375-50-6|drugcentral:1711|gmelin:240303|hmdb:HMDB0003745|kegg.compound:C03576|knapsack:C00000761|lincs.smallmolecule:LSM-6047|metacyc.compound:CoM|pdb-ccd:COM|pubmed:24151448|reaxys:1098878 Graph 1-THIOETHANESULFONIC ACID|2-Mercaptoethanesulfonate|2-mercaptoethanesulfonic acid|2-mercaptoethanesulphonic acid|2-mercaptoethylsulfonate|2-sulfanylethanesulfonic acid|2-sulfanylethylsulfonate|CoM|Coenzym M|Coenzyme M|HS-CoM|Mesna|beta-mercaptoethanesulfonic acid|coenzima M|reduced CoM|reduced coenzyme M 2-sulfanylethanesulfonic acid 1-THIOETHANESULFONIC ACID|2-Mercaptoethanesulfonate|2-mercaptoethanesulfonic acid|2-mercaptoethanesulphonic acid|2-mercaptoethylsulfonate|2-sulfanylethanesulfonic acid|2-sulfanylethylsulfonate|CoM|Coenzym M|Coenzyme M|HS-CoM|Mesna|beta-mercaptoethanesulfonic acid|coenzima M|reduced CoM|reduced coenzyme M http://purl.obolibrary.org/obo/CHEBI_17905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17906 biolink:ChemicalEntity aminoacetone A propanone consisting of acetone having an amino group at the 1-position. cas:298-08-8|kegg.compound:C01888 Graph 1-AMINO-PROPAN-2-ONE|1-Amino-2-propanone|1-aminopropan-2-one|Aminoacetone 1-aminopropan-2-one 1-AMINO-PROPAN-2-ONE|1-Amino-2-propanone|1-aminopropan-2-one|Aminoacetone http://purl.obolibrary.org/obo/CHEBI_17906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17907 biolink:ChemicalEntity styrene oxide An epoxide that is oxirane in which one of the hydrogens has been replaced by a phenyl group. cas:96-09-3|gmelin:50213|kegg.compound:C02083|metacyc.compound:2-Phenyloxirane|pubmed:11551533|pubmed:19245253|pubmed:24320693|reaxys:108582|umbbd.compound:c0037|wikipedia.en:Styrene_oxide Graph (epoxyethyl)benzene|1,2-epoxy-1-phenylethane|1,2-epoxyethylbenzene|1-phenyl-1,2-epoxyethane|1-phenyloxirane|2-phenyloxirane|Styrene oxide|Styrene-7,8-oxide|alpha,beta-epoxystyrene|epoxyethylbenzene|epoxystyrene|phenethylene oxide|phenyl oxirane|phenylethylene oxide|phenyloxirane|styrene 7,8-oxide|styrene epoxide|styrene oxide|styrene-7,8-oxide|styryl oxide 2-phenyloxirane (epoxyethyl)benzene|1,2-epoxy-1-phenylethane|1,2-epoxyethylbenzene|1-phenyl-1,2-epoxyethane|1-phenyloxirane|2-phenyloxirane|Styrene oxide|Styrene-7,8-oxide|alpha,beta-epoxystyrene|epoxyethylbenzene|epoxystyrene|phenethylene oxide|phenyl oxirane|phenylethylene oxide|phenyloxirane|styrene 7,8-oxide|styrene epoxide|styrene oxide|styrene-7,8-oxide|styryl oxide http://purl.obolibrary.org/obo/CHEBI_17907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17909 biolink:ChemicalEntity polysulfur cas:7704-34-9|cas:9035-99-8|kegg.compound:C00087|pesticides:sulfur Graph S|Sn|Sulfur|Sulfur, precipitated|polysulfur|sulfur, homopolymer|sulphur Sulfur|polysulfur S|Sn|Sulfur|Sulfur, precipitated|polysulfur|sulfur, homopolymer|sulphur http://purl.obolibrary.org/obo/CHEBI_17909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17913 biolink:ChemicalEntity streptidine 6-phosphate A derivative of streptidine having a phosphate group at the 6-position. cas:73679-08-0|kegg.compound:C01121 Graph (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-3,5,6-trihydroxycyclohexyl dihydrogen phosphate|D-Streptamine, N,N'-bis(aminoiminomethyl)-, 6-(dihydrogen phosphate)|Streptidine 6-phosphate|Streptidine-6-phosphate (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-3,5,6-trihydroxycyclohexyl dihydrogen phosphate (1S,2R,3S,4S,5R,6S)-2,4-bis(carbamimidamido)-3,5,6-trihydroxycyclohexyl dihydrogen phosphate|D-Streptamine, N,N'-bis(aminoiminomethyl)-, 6-(dihydrogen phosphate)|Streptidine 6-phosphate|Streptidine-6-phosphate http://purl.obolibrary.org/obo/CHEBI_17913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:179145 biolink:ChemicalEntity Tricetinidin chemspider:9374719|hmdb:HMDB0034043|lipidmaps:LMPK12010440 Graph 5-(5,7-dihydroxychromenylium-2-yl)benzene-1,2,3-triol 5-(5,7-dihydroxychromenylium-2-yl)benzene-1,2,3-triol 5-(5,7-dihydroxychromenylium-2-yl)benzene-1,2,3-triol http://purl.obolibrary.org/obo/CHEBI_179145 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17915 biolink:ChemicalEntity hexano-6-lactone A ε-lactone that is oxepane substituted by an oxo group at position 2. cas:502-44-3|gmelin:675457|hmdb:HMDB0060476|kegg.compound:C01880|metacyc.compound:CPD-101|pubmed:24453135|reaxys:106919|umbbd.compound:c0059|wikipedia.en:Caprolactone Graph 1,6-hexanolide|1-Oxa-2-oxocycloheptane|2-Oxepanone|2-oxacycloheptanone|2-oxohexamethylene oxide|6-Hexanolide|6-hexanolactone|6-hydroxyhexanoic acid lactone|6-hydroxyhexanoic acid, epsilon-lactone|caprolactone|epsilon-Caprolactone|epsilon-caprolactone monomer|hexan-6-olide|hexano-6-lactone|hexanoic acid, epsilon-lactone|oxepan-2-one oxepan-2-one 1,6-hexanolide|1-Oxa-2-oxocycloheptane|2-Oxepanone|2-oxacycloheptanone|2-oxohexamethylene oxide|6-Hexanolide|6-hexanolactone|6-hydroxyhexanoic acid lactone|6-hydroxyhexanoic acid, epsilon-lactone|caprolactone|epsilon-Caprolactone|epsilon-caprolactone monomer|hexan-6-olide|hexano-6-lactone|hexanoic acid, epsilon-lactone|oxepan-2-one http://purl.obolibrary.org/obo/CHEBI_17915 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17917 biolink:ChemicalEntity L-allysine An optically active form of allysine having L-configuration. drugbank:DB02571|kegg.compound:C04076|pdb-ccd:DO2 Graph (2S)-2-amino-6-oxohexanoic acid|(S)-2-Amino-6-oxohexanoate|2-AMINO-6-OXO-HEXANOIC ACID|6-oxo-L-norleucine|Allysine|L-2-Aminoadipate 6-semialdehyde|L-6-oxonorleucine|L-Allysine|L-allysine (2S)-2-amino-6-oxohexanoic acid|L-allysine (2S)-2-amino-6-oxohexanoic acid|(S)-2-Amino-6-oxohexanoate|2-AMINO-6-OXO-HEXANOIC ACID|6-oxo-L-norleucine|Allysine|L-2-Aminoadipate 6-semialdehyde|L-6-oxonorleucine|L-Allysine|L-allysine http://purl.obolibrary.org/obo/CHEBI_17917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:179179 biolink:ChemicalEntity Pramanicin chemspider:7996417|chemspider:8770652|lipidmaps:LMSP01080048 Graph (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-[(2R,3R)-3-nonyloxiran-2-yl]prop-2-enoyl]pyrrolidin-2-one|3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-(3-nonyloxiran-2-yl)prop-2-enoyl]pyrrolidin-2-one (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-[(2R,3R)-3-nonyloxiran-2-yl]prop-2-enoyl]pyrrolidin-2-one|3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-(3-nonyloxiran-2-yl)prop-2-enoyl]pyrrolidin-2-one (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-[(2R,3R)-3-nonyloxiran-2-yl]prop-2-enoyl]pyrrolidin-2-one|3,4-dihydroxy-5-(hydroxymethyl)-3-[(E)-3-(3-nonyloxiran-2-yl)prop-2-enoyl]pyrrolidin-2-one http://purl.obolibrary.org/obo/CHEBI_179179 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17919 biolink:ChemicalEntity 3-mercapto-2-mercaptomethylpropanoic acid A sulfur-containing carboxylic acid consisting of isobutyric acid having mercapto substituents on both β-carbons. kegg.compound:C04371|knapsack:C00000305 Graph 3-Mercapto-2-mercaptomethylpropanoate|3-sulfanyl-2-(sulfanylmethyl)propanoic acid 3-sulfanyl-2-(sulfanylmethyl)propanoic acid 3-Mercapto-2-mercaptomethylpropanoate|3-sulfanyl-2-(sulfanylmethyl)propanoic acid http://purl.obolibrary.org/obo/CHEBI_17919 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17920 biolink:ChemicalEntity 3-methyleneoxindole cas:1861-29-6|kegg.compound:C02796 Graph 3-Methyleneoxindole|3-methylene-1,3-dihydro-2H-indol-2-one|3-methyleneoxindole|3-methylidene-1,3-dihydro-2H-indol-2-one 3-methylidene-1,3-dihydro-2H-indol-2-one 3-Methyleneoxindole|3-methylene-1,3-dihydro-2H-indol-2-one|3-methyleneoxindole|3-methylidene-1,3-dihydro-2H-indol-2-one http://purl.obolibrary.org/obo/CHEBI_17920 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17924 biolink:ChemicalEntity D-glucitol The D-enantiomer of glucitol (also known as D-sorbitol). beilstein:4656395|cas:50-70-4|drugbank:DB01638|drugcentral:2462|gmelin:83162|hmdb:HMDB0000247|kegg.compound:C00794|kegg.drug:D00096|knapsack:C00001173|pdb-ccd:SOR|ppdb:1320|pubmed:16901854|pubmed:17336832|pubmed:17979222|pubmed:19443021|pubmed:19695255|pubmed:22735334|pubmed:22878210|pubmed:23683321|pubmed:24643482|pubmed:25108762|pubmed:25568069|pubmed:31537530|reaxys:1721899|wikipedia.en:Sorbitol Graph (-)-sorbitol|(2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol|D-(-)-sorbitol|D-Glucitol|D-SORBITOL|D-Sorbit|D-Sorbitol|D-glucitol|D-sorbitol|E 420|E-420|E420|G-ol|Glc-ol|L-Gulitol D-Glucitol|D-glucitol (-)-sorbitol|(2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol|D-(-)-sorbitol|D-Glucitol|D-SORBITOL|D-Sorbit|D-Sorbitol|D-glucitol|D-sorbitol|E 420|E-420|E420|G-ol|Glc-ol|L-Gulitol http://purl.obolibrary.org/obo/CHEBI_17924 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17925 biolink:ChemicalEntity alpha-D-glucose D-Glucopyranose having α-configuration at the anomeric centre. beilstein:1281608|beilstein:5730158|cas:492-62-6|glygen:G58161NS|glytoucan:G58161NS|gmelin:329225|kegg.compound:C00267|knapsack:C00001122|pdb-ccd:GLC|pubmed:19443021|pubmed:25568069|pubmed:31537530 Graph ALPHA-D-GLUCOSE|alpha-D-Glc|alpha-D-Glucose|alpha-D-glucopyranose|alpha-D-glucose|alpha-dextrose alpha-D-glucopyranose ALPHA-D-GLUCOSE|alpha-D-Glc|alpha-D-Glucose|alpha-D-glucopyranose|alpha-D-glucose|alpha-dextrose http://purl.obolibrary.org/obo/CHEBI_17925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17926 biolink:ChemicalEntity hydrogenobyrinic acid beilstein:4227766|cas:23599-55-5|drugbank:DB02460|kegg.compound:C06399 Graph Hydrogenobyrinate|Hydrogenobyrinic acid|Hydrogenobyrinsaeure Hydrogenobyrinate|Hydrogenobyrinic acid|Hydrogenobyrinsaeure http://purl.obolibrary.org/obo/CHEBI_17926 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17927 biolink:ChemicalEntity N(1)-acetylspermidine An acetylspermidine having the acetyl group at the N1-position. cas:14278-49-0|hmdb:HMDB0001276|kegg.compound:C00612|metacyc.compound:CPD-568|pubmed:22770225|pubmed:8446047|reaxys:4176501 Graph 1-N-acetylspermidine|N-{3-[(4-aminobutyl)amino]propyl}acetamide|N1-Acetylspermidine N-{3-[(4-aminobutyl)amino]propyl}acetamide 1-N-acetylspermidine|N-{3-[(4-aminobutyl)amino]propyl}acetamide|N1-Acetylspermidine http://purl.obolibrary.org/obo/CHEBI_17927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17928 biolink:ChemicalEntity 1-amino-1-deoxy-scyllo-inositol 4-phosphate A scyllo-inositol phosphate having a monophosphate group at the 4-position as well as the hydroxy group at the 1-position replaced by an amino group. kegg.compound:C01283 Graph 1-Amino-1-deoxy-scyllo-inositol 4-phosphate|1-amino-1-deoxy-scyllo-inositol 4-(dihydrogen phosphate)|1-amino-1-deoxy-scyllo-inositol 4-phosphate|scyllo-Inosamine 4-phosphate 1-amino-1-deoxy-scyllo-inositol 4-(dihydrogen phosphate) 1-Amino-1-deoxy-scyllo-inositol 4-phosphate|1-amino-1-deoxy-scyllo-inositol 4-(dihydrogen phosphate)|1-amino-1-deoxy-scyllo-inositol 4-phosphate|scyllo-Inosamine 4-phosphate http://purl.obolibrary.org/obo/CHEBI_17928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17929 biolink:ChemicalEntity N(omega),N(omega)-dimethyl-L-arginine A L-arginine derivative having two methyl groups both attached to the primary amino moiety of the guanidino group. beilstein:2261521|cas:30315-93-6|drugbank:DB01686|kegg.compound:C03626|pdb-ccd:DA2 Graph (2S)-2-amino-5-(N',N'-dimethylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[(dimethylamino)(imino)methyl]amino}pentanoic acid|ADMA|N(5)-((dimethylamino)iminomethyl)-L-ornithine|N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine|N(5)-[(dimethylamino)(imino)methyl]-L-ornithine|N(G),N(G)-dimethylarginine|N(G)-dimethylarginine|N(G1),N(G1)-dimethylarginine|N,N-dimethylarginine|NG,NG-DIMETHYL-L-ARGININE|NG,NG-Dimethyl-L-arginine|asymmetric dimethylarginine|guanidino-N,N-dimethylarginine (2S)-2-amino-5-(N',N'-dimethylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[(dimethylamino)(imino)methyl]amino}pentanoic acid|N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine|N(5)-[(dimethylamino)(imino)methyl]-L-ornithine (2S)-2-amino-5-(N',N'-dimethylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[(dimethylamino)(imino)methyl]amino}pentanoic acid|ADMA|N(5)-((dimethylamino)iminomethyl)-L-ornithine|N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine|N(5)-[(dimethylamino)(imino)methyl]-L-ornithine|N(G),N(G)-dimethylarginine|N(G)-dimethylarginine|N(G1),N(G1)-dimethylarginine|N,N-dimethylarginine|NG,NG-DIMETHYL-L-ARGININE|NG,NG-Dimethyl-L-arginine|asymmetric dimethylarginine|guanidino-N,N-dimethylarginine http://purl.obolibrary.org/obo/CHEBI_17929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17931 biolink:ChemicalEntity N-hydroxy-2-acetamidofluorene cas:53-95-2|kegg.compound:C03954 Graph 2-(N-Acetylhydroxylamino)fluorene|2-(N-Hydroxyacetamido)fluorene|Fluorenyl-2-acethydroxamic acid|Hydroxyacetylaminofluorene|N-(9H-fluoren-2-yl)-N-hydroxyacetamide|N-Fluoren-2-ylacetohydroxamic acid|N-Hydroxy-2-acetamidofluorene|N-Hydroxy-N-acetyl-2-aminofluorene|N-hydroxy-2-acetamidofluorene N-(9H-fluoren-2-yl)-N-hydroxyacetamide 2-(N-Acetylhydroxylamino)fluorene|2-(N-Hydroxyacetamido)fluorene|Fluorenyl-2-acethydroxamic acid|Hydroxyacetylaminofluorene|N-(9H-fluoren-2-yl)-N-hydroxyacetamide|N-Fluoren-2-ylacetohydroxamic acid|N-Hydroxy-2-acetamidofluorene|N-Hydroxy-N-acetyl-2-aminofluorene|N-hydroxy-2-acetamidofluorene http://purl.obolibrary.org/obo/CHEBI_17931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17933 biolink:ChemicalEntity calcidiol A hydroxycalciol that is calciol in which the hydrogen at position 25 has been replaced by a hydroxy group. A prehormone resulting from the oxidation of calciol in the liver, it is further hydroxylated in the kidney to give calcitriol, the active form of vitamin D3. cas:19356-17-3|drugbank:DB00146|drugcentral:464|kegg.compound:C01561|lipidmaps:LMST03020246|pdb-ccd:VDY|pubmed:16549446|pubmed:18689406|pubmed:22487892|pubmed:22536761|pubmed:23090338|pubmed:23566108|pubmed:9080330|reaxys:4270041|wikipedia.en:Calcifediol Graph (3S,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|(3S,5Z,7E)-9,10-secocholesta-5,7,10-triene-3,25-diol|(3beta,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|(5Z,7E)-(3S)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|25(OH)D3|25-Hydroxyvitamin D3|25-hydroxycholecalciferol|25-hydroxyvitamin D3|3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANOL|Calcidiol|Calcifediol|Calcifediol anhydrous|Rayaldee|calcidiol|calcifediol|calcifediolum (3S,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol (3S,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|(3S,5Z,7E)-9,10-secocholesta-5,7,10-triene-3,25-diol|(3beta,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|(5Z,7E)-(3S)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol|25(OH)D3|25-Hydroxyvitamin D3|25-hydroxycholecalciferol|25-hydroxyvitamin D3|3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANOL|Calcidiol|Calcifediol|Calcifediol anhydrous|Rayaldee|calcidiol|calcifediol|calcifediolum http://purl.obolibrary.org/obo/CHEBI_17933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17934 biolink:ChemicalEntity pregnan-21-al kegg.compound:C00891 Graph Pregnan-21-al|pregnan-21-al Pregnan-21-al|pregnan-21-al Pregnan-21-al|pregnan-21-al http://purl.obolibrary.org/obo/CHEBI_17934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17935 biolink:ChemicalEntity octanal A saturated fatty aldehyde formally arising from reduction of the carboxy group of caprylic acid (octanoic acid). bpdb:1387|cas:124-13-0|gmelin:101464|hmdb:HMDB0001140|kegg.compound:C01545|knapsack:C00030880|lipidmaps:LMFA06000028|metacyc.compound:CPD-371|patent:US2012164085|pdb-ccd:OYA|pubmed:24001856|pubmed:24130214|pubmed:24295708|reaxys:1744086|umbbd.compound:c0046|wikipedia.en:Octanal Graph 1-Caprylaldehyde|1-Octaldehyde|1-Octanal|1-Octylaldehyde|C-8 aldehyde|Caprylaldehyd|Kaprylaldehyd|Octylaldehyd|Oktanal|Oktylaldehyd|aldehyde C-8|caprylaldehyde|caprylic aldehyde|n-caprylaldehyde|n-octaldehyde|n-octanal|n-octyl aldehyde|n-octylal|octan-1-al|octanal|octanaldehyde|octanoic aldehyde|octylaldehyde octanal 1-Caprylaldehyde|1-Octaldehyde|1-Octanal|1-Octylaldehyde|C-8 aldehyde|Caprylaldehyd|Kaprylaldehyd|Octylaldehyd|Oktanal|Oktylaldehyd|aldehyde C-8|caprylaldehyde|caprylic aldehyde|n-caprylaldehyde|n-octaldehyde|n-octanal|n-octyl aldehyde|n-octylal|octan-1-al|octanal|octanaldehyde|octanoic aldehyde|octylaldehyde http://purl.obolibrary.org/obo/CHEBI_17935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17936 biolink:ChemicalEntity 2-acyl-sn-glycero-3-phosphate An acyl-sn-glycero-3-phosphate in which a single acyl substituent is located at position 2. kegg.compound:C03974|lipidmaps:LMGP1005AA00|metacyc.compound:1-Lysophosphatidates|pubmed:20551224 Graph 2-Acyl-sn-glycerol 3-phosphate|2-acyl-sn-glycero-3-phosphates|2-acyl-sn-glycerol 3-phosphates 2-Acyl-sn-glycerol 3-phosphate|2-acyl-sn-glycero-3-phosphates|2-acyl-sn-glycerol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_17936 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17937 biolink:ChemicalEntity L-rhamnono-1,4-lactone A five-membered rhamnonolactone having L-configuration. kegg.compound:C02991 Graph (3R,4S,5S)-3,4-dihydroxy-5-[(1S)-1-hydroxyethyl]oxolan-2-one|6-deoxy-L-mannono-1,4-lactone|L-Rhamno-1,4-lactone|L-Rhamnono-1,4-lactone|L-rhamnono-1,4-lactone (3R,4S,5S)-3,4-dihydroxy-5-[(1S)-1-hydroxyethyl]oxolan-2-one (3R,4S,5S)-3,4-dihydroxy-5-[(1S)-1-hydroxyethyl]oxolan-2-one|6-deoxy-L-mannono-1,4-lactone|L-Rhamno-1,4-lactone|L-Rhamnono-1,4-lactone|L-rhamnono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_17937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17938 biolink:ChemicalEntity 5alpha-ergosta-7,22-diene-3beta,5-diol kegg.compound:C04416 Graph 5-alpha-ergosta-7,22-diene-3-beta,5-diol|5alpha-Ergosta-7,22-diene-3beta,5-diol|5alpha-ergosta-7,22-diene-3beta,5-diol 5alpha-Ergosta-7,22-diene-3beta,5-diol|5alpha-ergosta-7,22-diene-3beta,5-diol 5-alpha-ergosta-7,22-diene-3-beta,5-diol|5alpha-Ergosta-7,22-diene-3beta,5-diol|5alpha-ergosta-7,22-diene-3beta,5-diol http://purl.obolibrary.org/obo/CHEBI_17938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17939 biolink:ChemicalEntity puromycin An aminonucleoside antibiotic, derived from the Streptomyces alboniger bacterium, that causes premature chain termination during translation taking place in the ribosome. cas:53-79-2|drugbank:DB08437|kegg.compound:C01610|kegg.drug:D05653|knapsack:C00001507|lincs.smallmolecule:LSM-2788|pubmed:13945541|pubmed:15843471|pubmed:18322149|pubmed:323854|reaxys:70234|wikipedia.en:Puromycin Graph (S)-3'-((2-Amino-3-(4-methoxyphenyl)-1-oxopropyl)amino)-3'-deoxy-N,N-dimethyladenosine|3'-(L-alpha-Amino-p-methoxyhydrocinnamamido)-3'-deoxy-N,N-dimethyladenosine|3'-[[(2S)-2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-3'-deoxy-N,N-diemthyladenosine|3'-deoxy-N,N-dimethyl-3'-(O-methyl-L-tyrosinamido)adenosine|9-{3-deoxy-3-[(O-methyl-L-tyrosyl)amino]-beta-D-xylofuranosyl}-N,N-dimethyl-9H-purin-6-amine|Achromycin|Puromycin|puromicina|puromycin|puromycine|puromycinum 3'-deoxy-N,N-dimethyl-3'-(O-methyl-L-tyrosinamido)adenosine (S)-3'-((2-Amino-3-(4-methoxyphenyl)-1-oxopropyl)amino)-3'-deoxy-N,N-dimethyladenosine|3'-(L-alpha-Amino-p-methoxyhydrocinnamamido)-3'-deoxy-N,N-dimethyladenosine|3'-[[(2S)-2-amino-3-(4-methoxyphenyl)-1-oxopropyl]amino]-3'-deoxy-N,N-diemthyladenosine|3'-deoxy-N,N-dimethyl-3'-(O-methyl-L-tyrosinamido)adenosine|9-{3-deoxy-3-[(O-methyl-L-tyrosyl)amino]-beta-D-xylofuranosyl}-N,N-dimethyl-9H-purin-6-amine|Achromycin|Puromycin|puromicina|puromycin|puromycine|puromycinum http://purl.obolibrary.org/obo/CHEBI_17939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17941 biolink:ChemicalEntity diisopropyl fluorophosphate cas:55-91-4|drugbank:DB00677|drugcentral:1494|kegg.compound:C00202|kegg.drug:D00043|wikipedia.en:Isoflurophate Graph DFP|Diisopropoxyphosphoryl fluoride|Diisopropyl fluorophosphate|Diisopropyl fluorophosphonate|Diisopropyl phosphofluoridate|Diisopropyl phosphorofluoridate|Diisopropylfluorophosphate|Diisopropylfluorophosphoric acid ester|Diisopropylphosphorofluoridate|Fluorodiisopropyl phosphate|Isofluorphate|Isoflurophate|Isoflurophosphate|Isopropyl fluophosphate|Isopropyl phosphorofluoridate|Neoglaucit|O,O'-Diisopropyl phosphoryl fluoride|bis(propan-2-yl) fluorophosphate|diisopropyl fluorophosphate bis(propan-2-yl) fluorophosphate DFP|Diisopropoxyphosphoryl fluoride|Diisopropyl fluorophosphate|Diisopropyl fluorophosphonate|Diisopropyl phosphofluoridate|Diisopropyl phosphorofluoridate|Diisopropylfluorophosphate|Diisopropylfluorophosphoric acid ester|Diisopropylphosphorofluoridate|Fluorodiisopropyl phosphate|Isofluorphate|Isoflurophate|Isoflurophosphate|Isopropyl fluophosphate|Isopropyl phosphorofluoridate|Neoglaucit|O,O'-Diisopropyl phosphoryl fluoride|bis(propan-2-yl) fluorophosphate|diisopropyl fluorophosphate http://purl.obolibrary.org/obo/CHEBI_17941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17942 biolink:ChemicalEntity D-allose 6-phosphate An allose phosphate consisting of D-allose having a monophosphate group at the 6-position. kegg.compound:C02962 Graph 6-O-phosphono-D-allose|D-Allose 6-phosphate|D-allose 6-(hydrogen phosphate) 6-O-phosphono-D-allose|D-Allose 6-phosphate|D-allose 6-(hydrogen phosphate) 6-O-phosphono-D-allose|D-Allose 6-phosphate|D-allose 6-(hydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17942 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17943 biolink:ChemicalEntity (S)-2-O-sulfolactic acid kegg.compound:C02914 Graph (2S)-2-(sulfooxy)propanoic acid|(S)-2-O-Sulfolactate|(S)-2-O-sulfolactate (2S)-2-(sulfooxy)propanoic acid (2S)-2-(sulfooxy)propanoic acid|(S)-2-O-Sulfolactate|(S)-2-O-sulfolactate http://purl.obolibrary.org/obo/CHEBI_17943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17945 biolink:ChemicalEntity N-cyclohexylformamide A member of the class of formamides that is cyclohexane substituted by a formamido group. cas:766-93-8|drugbank:DB03559|gmelin:1650668|kegg.compound:C11519|metacyc.compound:N-CYCLOHEXYLFORMAMIDE|pdb-ccd:CXF|pubmed:11882632|pubmed:20733993|pubmed:9132002|pubmed:9760265|reaxys:2040181|umbbd.compound:c0909 Graph CYCLOHEXYLFORMAMIDE|N-Cyclohexylformamid|N-Cyclohexylformamide|N-Zyklohexylformamid|N-cyclohexylformamide|N-formylcyclohexylamine|formamidocyclohexane N-Cyclohexylformamide|N-cyclohexylformamide CYCLOHEXYLFORMAMIDE|N-Cyclohexylformamid|N-Cyclohexylformamide|N-Zyklohexylformamid|N-cyclohexylformamide|N-formylcyclohexylamine|formamidocyclohexane http://purl.obolibrary.org/obo/CHEBI_17945 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17947 biolink:ChemicalEntity 3-dehydroquinic acid A 4-oxo monocarboxylic acid derived from quinic acid by oxidation of the hydroxy group at position 3 to the corresponding keto group. drugbank:DB03868|hmdb:HMDB0012710|kegg.compound:C00944|knapsack:C00019664|metacyc.compound:DEHYDROQUINATE|pdb-ccd:DQA|pubmed:11603966|pubmed:13198937|pubmed:14269300|pubmed:14524706|reaxys:2115114|wikipedia.en:3-Dehydroquinic_acid Graph 3-Dehydroquinic acid|5-Dehydroquinic acid|rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylic acid rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylic acid 3-Dehydroquinic acid|5-Dehydroquinic acid|rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17947 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17948 biolink:ChemicalEntity (+)-taxifolin A taxifolin that has (2R,3R)-configuration. beilstein:93548|cas:480-18-2|drugbank:DB02224|kegg.compound:C01617|knapsack:C00000677|lincs.smallmolecule:LSM-5990|pdb-ccd:DQH|wikipedia.en:Taxifolin Graph (+)-Dihydroquercetin|(+)-Taxifolin|(2R,3R)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one|(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one|(2R,3R)-dihydroquercetin|(2R-trans)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-3,5,7-trihydroxy-4-benzopyrone|Dihydroquercetin|Taxifolin|trans-Dihydroquercetin (2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one (+)-Dihydroquercetin|(+)-Taxifolin|(2R,3R)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one|(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one|(2R,3R)-dihydroquercetin|(2R-trans)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-3,5,7-trihydroxy-4-benzopyrone|Dihydroquercetin|Taxifolin|trans-Dihydroquercetin http://purl.obolibrary.org/obo/CHEBI_17948 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17950 biolink:ChemicalEntity beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-N-acylsphingosine A diosylceramide having β-D-galactosyl-(1→4)-β-D-glucose as the disaccharide component. kegg.compound:C01290|kegg.glycan:G00092|lipidmaps:LMSP0501AB00|metacyc.compound:Lactosyl-Ceramides|pubmed:10320813|pubmed:10685614|pubmed:11946769|pubmed:14631106|pubmed:1551920|pubmed:15546874|pubmed:15918012|pubmed:16341241|pubmed:16631151|pubmed:1724444|pubmed:17986153|pubmed:18041581|pubmed:19015977|pubmed:19721395|pubmed:19852959|pubmed:2026613|pubmed:20574042|pubmed:21167756|pubmed:21376640|pubmed:21687659|pubmed:27242221|pubmed:2960671|pubmed:3112159|pubmed:3392043|pubmed:3759974|pubmed:7534889|pubmed:9593693 Graph (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 4-O-beta-D-galactopyranosyl-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Cer)1|D-Galactosyl-1,4-beta-D-glucosylceramide|Gal-beta1->4Glc-beta1->1'Cer|Galbeta1-4Glcbeta-Cer|LacCer|Lactosyl-N-acylsphingosine|Lactosylceramide|N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-lignoceroyl-1-sphingosyl lactoside|a beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer(d18:1(4E))|beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer|beta-D-Galactosyl-1,4-beta-D-glucosylceramide|beta-D-Galp-(1->4)-beta-D-Glc-(1<->)-Cer|beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|beta-D-galactosyl-1,4-beta-D-glucosylceramide|beta-D-galactosyl-1,4-beta-D-glucosylceramides|beta-lactosylceramide|lactosylceramides (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 4-O-beta-D-galactopyranosyl-beta-D-glucopyranoside|N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 4-O-beta-D-galactopyranosyl-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Cer)1|D-Galactosyl-1,4-beta-D-glucosylceramide|Gal-beta1->4Glc-beta1->1'Cer|Galbeta1-4Glcbeta-Cer|LacCer|Lactosyl-N-acylsphingosine|Lactosylceramide|N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-lignoceroyl-1-sphingosyl lactoside|a beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer(d18:1(4E))|beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer|beta-D-Galactosyl-1,4-beta-D-glucosylceramide|beta-D-Galp-(1->4)-beta-D-Glc-(1<->)-Cer|beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|beta-D-galactosyl-1,4-beta-D-glucosylceramide|beta-D-galactosyl-1,4-beta-D-glucosylceramides|beta-lactosylceramide|lactosylceramides http://purl.obolibrary.org/obo/CHEBI_17950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17952 biolink:ChemicalEntity flavonol 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]s Any glycosyloxyflavone that consists of a flavonol attached to a rhamnosylglucosyl residue at position 3 via a glycosidic linkage. kegg.compound:C04194 Graph 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|Flavonol 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]|Flavonol 3-O-rutinoside|a flavonol 3-O-(alpha-L-rhamnosyl-(1->6)-beta-D-glucoside) 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside 4-oxo-2-phenyl-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|Flavonol 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]|Flavonol 3-O-rutinoside|a flavonol 3-O-(alpha-L-rhamnosyl-(1->6)-beta-D-glucoside) http://purl.obolibrary.org/obo/CHEBI_17952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17953 biolink:ChemicalEntity xanthopterin-B2 A member of the class of pteridines that is 7,8-dihydropteridine-2,4(1H,3H)-dione carrying a lactoyl group at position 6. cas:14331-49-8|kegg.compound:C02333|metacyc.compound:CPD-1127 Graph 1-(7,8-Dihydro-2,4-dihydroxypteridin-6-yl)-2-hydroxypropan-1-one|6-lactoyl-7,8-dihydropteridine-2,4(1H,3H)-dione|Xanthopterin-B2 6-lactoyl-7,8-dihydropteridine-2,4(1H,3H)-dione 1-(7,8-Dihydro-2,4-dihydroxypteridin-6-yl)-2-hydroxypropan-1-one|6-lactoyl-7,8-dihydropteridine-2,4(1H,3H)-dione|Xanthopterin-B2 http://purl.obolibrary.org/obo/CHEBI_17953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17954 biolink:ChemicalEntity 1-alpha-D-galactosyl-sn-glycerol 3-phosphate A galactosylglycerol phosphate compond having an α-D-galactosyl residue attached to the 1-position of an sn-glycerol 3-phosphate kegg.compound:C04703 Graph (2R)-3-(alpha-D-galactopyranosyloxy)-2-hydroxypropyl dihydrogen phosphate|1-(alpha-D-galactopyranosyl)-sn-glycerol 3-(dihydrogen phosphate)|1-O-alpha-D-Galactosyl-sn-glycerol 3-phosphate|alpha-D-Galactosyl-(1,1')-sn-glycerol 3-phosphate (2R)-3-(alpha-D-galactopyranosyloxy)-2-hydroxypropyl dihydrogen phosphate (2R)-3-(alpha-D-galactopyranosyloxy)-2-hydroxypropyl dihydrogen phosphate|1-(alpha-D-galactopyranosyl)-sn-glycerol 3-(dihydrogen phosphate)|1-O-alpha-D-Galactosyl-sn-glycerol 3-phosphate|alpha-D-Galactosyl-(1,1')-sn-glycerol 3-phosphate http://purl.obolibrary.org/obo/CHEBI_17954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:179548 biolink:ChemicalEntity Ethyl 2-ethylhexanoate cas:2983-37-1|chemspider:92970|hmdb:HMDB0032264|lipidmaps:LMFA07010855 Graph ethyl 2-ethylhexanoate ethyl 2-ethylhexanoate ethyl 2-ethylhexanoate http://purl.obolibrary.org/obo/CHEBI_179548 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17955 biolink:ChemicalEntity 2'-deoxyribonucleoside diphosphate kegg.compound:C04232 Graph 2'-Deoxyribonucleoside diphosphate|2'-deoxyribonucleoside diphosphates 2'-Deoxyribonucleoside diphosphate|2'-deoxyribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_17955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17957 biolink:ChemicalEntity 5-(2-hydroxyethyl)-4-methylthiazole A 1,3-thiazole that is thiazole substituted by a methyl group at position 4 and a 2-hydroxyethyl group at position 5. cas:137-00-8|hmdb:HMDB0032985|kegg.compound:C04294|knapsack:C00007610|metacyc.compound:THZ|pdb-ccd:TZE|pubmed:543872|reaxys:114249 Graph 2-(4-methyl-1,3-thiazol-5-yl)ethanol|4-Methyl-5-(2'-hydroxyethyl)-thiazole|4-Methyl-5-(2-hydroxyethyl)-thiazole|4-Methyl-5-thiazolethanol|4-methyl-5-(2'-hydroxyethyl)-thiazole|5-(2-Hydroxyethyl)-4-methylthiazole|5-(2-hydroxyethyl)-4-methylthiazole|Hemineurine 2-(4-methyl-1,3-thiazol-5-yl)ethanol 2-(4-methyl-1,3-thiazol-5-yl)ethanol|4-Methyl-5-(2'-hydroxyethyl)-thiazole|4-Methyl-5-(2-hydroxyethyl)-thiazole|4-Methyl-5-thiazolethanol|4-methyl-5-(2'-hydroxyethyl)-thiazole|5-(2-Hydroxyethyl)-4-methylthiazole|5-(2-hydroxyethyl)-4-methylthiazole|Hemineurine http://purl.obolibrary.org/obo/CHEBI_17957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17958 biolink:ChemicalEntity alkyl cinnamate A cinnamate ester rusulting from the formal condensation of cinnamic acid with any alkyl alcohol. kegg.compound:C06357|pubmed:16608217|pubmed:16968063|pubmed:22414757|pubmed:25145249 Graph alkyl 3-phenylacrylate|alkyl cinnamates|an alkyl cinnamate alkyl 3-phenylacrylate alkyl 3-phenylacrylate|alkyl cinnamates|an alkyl cinnamate http://purl.obolibrary.org/obo/CHEBI_17958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17959 biolink:ChemicalEntity oxidized Renilla luciferin An aromatic amide obtained by formal condensation of the carboxy group of phenylacetic acid with the exocyclic amino group of 4-(5-amino-6-benzylpyrazin-2-yl)phenol. kegg.compound:C03717|metacyc.compound:OXIDIZED-LUCIFERIN|reaxys:711884 Graph N-[3-benzyl-5-(4-hydroxyphenyl)pyrazin-2-yl]-2-phenylacetamide|Oxidized Renilla luciferin|excited coelenteramide h N-[3-benzyl-5-(4-hydroxyphenyl)pyrazin-2-yl]-2-phenylacetamide N-[3-benzyl-5-(4-hydroxyphenyl)pyrazin-2-yl]-2-phenylacetamide|Oxidized Renilla luciferin|excited coelenteramide h http://purl.obolibrary.org/obo/CHEBI_17959 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17960 biolink:ChemicalEntity 3-oxopropanoic acid beilstein:1741700|cas:926-61-4|gmelin:164397|kegg.compound:C00222 Graph 3-oxopropanoic acid|formylacetic acid|malonic semialdehyde 3-oxopropanoic acid 3-oxopropanoic acid|formylacetic acid|malonic semialdehyde http://purl.obolibrary.org/obo/CHEBI_17960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17961 biolink:ChemicalEntity farnesyl triphosphate A polyprenol triphosphate where the polyprenol component is farnesol. kegg.compound:C03115|lipidmaps:LMPR03010006 Graph 3,7,11-trimethyldodeca-2,6,10-trien-1-yl tetrahydrogen triphosphate|Farnesyl triphosphate|farnesol triphosphate 3,7,11-trimethyldodeca-2,6,10-trien-1-yl tetrahydrogen triphosphate 3,7,11-trimethyldodeca-2,6,10-trien-1-yl tetrahydrogen triphosphate|Farnesyl triphosphate|farnesol triphosphate http://purl.obolibrary.org/obo/CHEBI_17961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17962 biolink:ChemicalEntity CDP-diacylglycerol A CDP-glycerol having unspecified acyl groups (most commonly fatty acyl groups) at the 1- and 2-positions. kegg.compound:C00269|lipidmaps:LMGP13010000|pubmed:12950685 Graph 1,2-Diacyl-sn-glycero-3-cytidine-5'-diphosphate|CDP-1,2-diacylglycerol|CDP-DAG|CDP-diacylglycerols|CDPdiacylglycerol|cytidine 5'-(3-{1-[(2S)-2,3-bis(acyloxy)propyl]} trihydrogen diphosphate) cytidine 5'-(3-{1-[(2S)-2,3-bis(acyloxy)propyl]} trihydrogen diphosphate) 1,2-Diacyl-sn-glycero-3-cytidine-5'-diphosphate|CDP-1,2-diacylglycerol|CDP-DAG|CDP-diacylglycerols|CDPdiacylglycerol|cytidine 5'-(3-{1-[(2S)-2,3-bis(acyloxy)propyl]} trihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_17962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17963 biolink:ChemicalEntity 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine A tetrahydropyridine that is 1,2,3,6-tetrahydropyridine substituted by a methyl group at position 1 and a phenyl group at position 4. cas:28289-54-5|kegg.compound:C04599|pubmed:21798732|pubmed:21830164|pubmed:22393538|pubmed:23296790|reaxys:133712|wikipedia.en:MPTP Graph 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine|1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine|MPTP 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine|1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine 1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine|1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine|MPTP http://purl.obolibrary.org/obo/CHEBI_17963 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17964 biolink:ChemicalEntity pipecolic acid A piperidinemonocarboxylic acid in which the carboxy group is located at position C-2. beilstein:112883|cas:535-75-1|ecmdb:ECMDB21385|gmelin:68953|hmdb:HMDB0000070|pubmed:22770225|reaxys:81095|wikipedia.en:Pipecolic_acid|ymdb:YMDB01675 Graph 2-piperidinecarboxylic acid|homoproline|pipecolinic acid|piperidine-2-carboxylic acid piperidine-2-carboxylic acid 2-piperidinecarboxylic acid|homoproline|pipecolinic acid|piperidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_17964 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17965 biolink:ChemicalEntity isoorientin A flavone C-glycoside consisting of luteolin having a β-D-glucosyl residue at the 6-position. cas:4261-42-1|kegg.compound:C01821|knapsack:C00001055|lipidmaps:LMPK12110469|pubmed:21080643|pubmed:22529049|pubmed:22948221|pubmed:22980875|pubmed:23026832|pubmed:23220614|reaxys:68256|wikipedia.en:Isoorientin Graph (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-D-glucitol|2-(3,4-dihydroxyphenyl)-6-beta-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one|Homoorientin|Isoorientin|Luteolin-6-C-beta-D-glucoside (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-D-glucitol (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-D-glucitol|2-(3,4-dihydroxyphenyl)-6-beta-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one|Homoorientin|Isoorientin|Luteolin-6-C-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_17965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17966 biolink:ChemicalEntity cyclohexyl isocyanide An isocyanide having a cyclohexyl group attached to nitrogen. cas:931-53-3|kegg.compound:C11520 Graph Cyclohexaneisonitrile|Cyclohexyl isocyanide|N-Cyclohexylisocyanide|cyclohexyl isocyanide|isocyanocyclohexane isocyanocyclohexane Cyclohexaneisonitrile|Cyclohexyl isocyanide|N-Cyclohexylisocyanide|cyclohexyl isocyanide|isocyanocyclohexane http://purl.obolibrary.org/obo/CHEBI_17966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17967 biolink:ChemicalEntity urethane A carbamate ester obtained by the formal condensation of ethanol with carbamic acid. It has been found in alcoholic beverages. cas:51-79-6|drugbank:DB04827|hmdb:HMDB0031219|kegg.compound:C01537|lincs.smallmolecule:LSM-37020|pubmed:15790490|pubmed:24386880|reaxys:635810|wikipedia.en:Ethyl_carbamate Graph Ethyl carbamate|Urethane|carbamic acid ethyl ester|ethyl carbamate|urethane Ethyl carbamate|ethyl carbamate Ethyl carbamate|Urethane|carbamic acid ethyl ester|ethyl carbamate|urethane http://purl.obolibrary.org/obo/CHEBI_17967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17968 biolink:ChemicalEntity butyrate A short-chain fatty acid anion that is the conjugate base of butyric acid, obtained by deprotonation of the carboxy group. cas:461-55-2|gmelin:324289|kegg.compound:C00246|metacyc.compound:BUTYRIC_ACID|pubmed:17190852|pubmed:7496326|reaxys:3601060|umbbd.compound:c0035 Graph 1-butanoate|1-butyrate|1-propanecarboxylate|CH3-[CH2]2-COO(-)|butanate|butanoate|butanoic acid, ion(1-)|butyrate|n-butanoate|n-butyrate|propanecarboxylate|propylformate butanoate 1-butanoate|1-butyrate|1-propanecarboxylate|CH3-[CH2]2-COO(-)|butanate|butanoate|butanoic acid, ion(1-)|butyrate|n-butanoate|n-butyrate|propanecarboxylate|propylformate http://purl.obolibrary.org/obo/CHEBI_17968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17969 biolink:ChemicalEntity sedoheptulose 1,7-bisphosphate beilstein:4271614|cas:815-91-8|kegg.compound:C00447 Graph D-Sedoheptulose 1,7-bisphosphate|D-altro-Heptulose 1,7-biphosphate|D-altro-hept-2-ulose 1,7-bis(dihydrogen phosphate)|Sedoheptulose 1,7-bisphosphate|altro-Heptulose 1,7-biphosphate D-altro-hept-2-ulose 1,7-bis(dihydrogen phosphate) D-Sedoheptulose 1,7-bisphosphate|D-altro-Heptulose 1,7-biphosphate|D-altro-hept-2-ulose 1,7-bis(dihydrogen phosphate)|Sedoheptulose 1,7-bisphosphate|altro-Heptulose 1,7-biphosphate http://purl.obolibrary.org/obo/CHEBI_17969 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17970 biolink:ChemicalEntity N-acyl-D-mannosaminolactone Graph an N-acyl-D-mannosaminolactone an N-acyl-D-mannosaminolactone http://purl.obolibrary.org/obo/CHEBI_17970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17972 biolink:ChemicalEntity ribonucleoside triphosphate kegg.compound:C03802 Graph Ribonucleoside triphosphate|ribonucleoside triphosphates Ribonucleoside triphosphate|ribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_17972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17973 biolink:ChemicalEntity alpha-D-galactose 1-phosphate A D-galactopyranose 1-phosphate having α-configuration at the anomeric centre. cas:2255-14-3|drugbank:DB02317|hmdb:HMDB0000645|kegg.compound:C00446|knapsack:C00007391|metacyc.compound:GALACTOSE-1P|pdb-ccd:GL1|pubmed:8154046|reaxys:87854|wikipedia.en:Galactose_1-phosphate Graph 1-O-phosphono-alpha-D-galactopyranose|Galactose-1-phosphate|alpha-D-Gal-1-P|alpha-D-Galactopyranose 1-phosphate|alpha-D-Galactopyranose, 1-(dihydrogen phosphate)|alpha-D-Galactopyranosyl phosphate|alpha-D-Galactose 1-phosphate|alpha-D-Galactosyl phosphate|alpha-D-galactopyranose 1-(dihydrogen phosphate) alpha-D-Galactopyranose 1-phosphate|alpha-D-galactopyranose 1-(dihydrogen phosphate) 1-O-phosphono-alpha-D-galactopyranose|Galactose-1-phosphate|alpha-D-Gal-1-P|alpha-D-Galactopyranose 1-phosphate|alpha-D-Galactopyranose, 1-(dihydrogen phosphate)|alpha-D-Galactopyranosyl phosphate|alpha-D-Galactose 1-phosphate|alpha-D-Galactosyl phosphate|alpha-D-galactopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17973 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17975 biolink:ChemicalEntity 5,10-(methanylylidene)tetrahydromethanopterin A tetrahydromethanopterin having a methanylylidene joined to the nitrogens at the 5- and 10-positions. kegg.compound:C04330|umbbd.compound:c0349 Graph 1-{4-[(6S,6aR,7R)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6,6a,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]phenyl}-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|5,10-(methanylylidene)tetrahydromethanopterin|5,10-Methenyl-5,6,7,8-tetrahydromethanopterin|5,10-Methenyltetrahydromethanopterin|N5,N10-Methenyltetrahydromethanopterin 5,10-(methanylylidene)tetrahydromethanopterin 1-{4-[(6S,6aR,7R)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6,6a,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]phenyl}-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|5,10-(methanylylidene)tetrahydromethanopterin|5,10-Methenyl-5,6,7,8-tetrahydromethanopterin|5,10-Methenyltetrahydromethanopterin|N5,N10-Methenyltetrahydromethanopterin http://purl.obolibrary.org/obo/CHEBI_17975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17976 biolink:ChemicalEntity ubiquinol cas:56275-39-9|kegg.compound:C00390 Graph CoQH2|QH(2)|QH2|Ubiquinol|a ubiquinol|coenzymes QH2|reduced ubiquinone|ubiquinols CoQH2|QH(2)|QH2|Ubiquinol|a ubiquinol|coenzymes QH2|reduced ubiquinone|ubiquinols http://purl.obolibrary.org/obo/CHEBI_17976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17977 biolink:ChemicalEntity 1,4-benzosemiquinone A member of the class of benzosemiquinones which results from the removal of one hydrogen atom with its electron from hydroquinone (or from the addition of one hydrogen atom with its electron to p-benzoquinone). kegg.compound:C02389|reaxys:2040548 Graph (4-hydroxyphenyl)oxidanyl|1,4-benzosemiquinone|1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl|4-Hydroxyphenoxy radical|4-hydroxyphenyloxyl|Benzosemiquinone|benzosemiquinone|hydroquinone radical|p-Benzosemiquinone|p-benzosemiquinone radical|semiquinone radical (4-hydroxyphenyl)oxidanyl (4-hydroxyphenyl)oxidanyl|1,4-benzosemiquinone|1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl|4-Hydroxyphenoxy radical|4-hydroxyphenyloxyl|Benzosemiquinone|benzosemiquinone|hydroquinone radical|p-Benzosemiquinone|p-benzosemiquinone radical|semiquinone radical http://purl.obolibrary.org/obo/CHEBI_17977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17978 biolink:ChemicalEntity 5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid beilstein:180967|kegg.compound:C04604 Graph 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate|5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid 5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate|5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_17978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17979 biolink:ChemicalEntity aldehydo-L-xylose A xylose of ring-opened form having L-configuration. cas:609-06-3|glytoucan:G41915IH|pubmed:12596851|reaxys:1723080 Graph L(+)-Xylose|L-Xyl|L-Xylofuranose|L-Xylose|L-xylo-pentose|L-xylose L-Xylose|L-xylose L(+)-Xylose|L-Xyl|L-Xylofuranose|L-Xylose|L-xylo-pentose|L-xylose http://purl.obolibrary.org/obo/CHEBI_17979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17980 biolink:ChemicalEntity 3'-phospho-5'-adenylyl sulfate An adenosine bisphosphate having monophosphate groups at the 3'- and 5'-positions and a sulfo group attached to the phosphate at position 5'. cas:482-67-7|kegg.compound:C00053|knapsack:C00007446|pdb-ccd:PPS Graph 3'-O-phosphono-5'-adenylyl sulfate|3'-Phospho-5'-adenylyl sulfate|3'-Phosphoadenosine 5'-phosphosulfate|3'-Phosphoadenylyl sulfate|3'-phospho-5'-adenylyl sulfate|3'-phosphoadenosine 5'-phosphosulfate|PAPS 3'-O-phosphono-5'-adenylyl sulfate 3'-O-phosphono-5'-adenylyl sulfate|3'-Phospho-5'-adenylyl sulfate|3'-Phosphoadenosine 5'-phosphosulfate|3'-Phosphoadenylyl sulfate|3'-phospho-5'-adenylyl sulfate|3'-phosphoadenosine 5'-phosphosulfate|PAPS http://purl.obolibrary.org/obo/CHEBI_17980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17981 biolink:ChemicalEntity O-acetyl-L-serine An acetyl-L-serine where the acetyl group is attached to the side-chain oxygen. It is an intermediate in the biosynthesis of the amino acid cysteine in bacteria. cas:5147-00-2|drugbank:DB01837|hmdb:HMDB0003011|kegg.compound:C00979|knapsack:C00007459|metacyc.compound:ACETYLSERINE|pdb-ccd:OAS|pubmed:23483228|reaxys:1723791|wikipedia.en:O-Acetylserine Graph L-Serine, acetate (ester)|O-Acetyl-L-serine|O-acetyl-L-serine|O3-Acetyl-L-serine|O3-acetyl-L-serine O-Acetyl-L-serine|O-acetyl-L-serine L-Serine, acetate (ester)|O-Acetyl-L-serine|O-acetyl-L-serine|O3-Acetyl-L-serine|O3-acetyl-L-serine http://purl.obolibrary.org/obo/CHEBI_17981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17982 biolink:ChemicalEntity 6-acetamido-3-oxohexanoate kegg.compound:C03682 Graph 6-acetamido-3-oxohexanoate 6-acetamido-3-oxohexanoate 6-acetamido-3-oxohexanoate http://purl.obolibrary.org/obo/CHEBI_17982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17983 biolink:ChemicalEntity UDP-L-arabinose A UDP-sugar having L-arabinose as the sugar component. kegg.compound:C00935|kegg.glycan:G11111 Graph UDP-L-arabinopyranose|UDP-L-arabinose|uridine 5'-[3-(L-arabinopyranosyl) dihydrogen diphosphate]|uridine 5'-diphospho-L-arabinopyranose uridine 5'-[3-(L-arabinopyranosyl) dihydrogen diphosphate] UDP-L-arabinopyranose|UDP-L-arabinose|uridine 5'-[3-(L-arabinopyranosyl) dihydrogen diphosphate]|uridine 5'-diphospho-L-arabinopyranose http://purl.obolibrary.org/obo/CHEBI_17983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17984 biolink:ChemicalEntity acyl-CoA A thioester that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any carboxylic acid. kegg.compound:C00040|pubmed:11264983|pubmed:11524729|pubmed:16495773|pubmed:21514367|pubmed:21541677 Graph Acyl coenzyme A|Acyl-CoA Acyl coenzyme A|Acyl-CoA http://purl.obolibrary.org/obo/CHEBI_17984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17985 biolink:ChemicalEntity adenosine 3',5'-bismonophosphate An adenosine bisphosphate having two monophosphate groups at the 3'- and 5'-positions. cas:1053-73-2|kegg.compound:C00054|knapsack:C00019352|pdb-ccd:A3P Graph 3'-Phosphoadenylate|3'-phosphoadenylate|Adenosine 3',5'-bisphosphate|PAP|Phosphoadenosine phosphate|adenosine 3',5'-bis(dihydrogen phosphate) adenosine 3',5'-bis(dihydrogen phosphate) 3'-Phosphoadenylate|3'-phosphoadenylate|Adenosine 3',5'-bisphosphate|PAP|Phosphoadenosine phosphate|adenosine 3',5'-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_17985 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17987 biolink:ChemicalEntity benzyl alcohol An aromatic alcohol that consists of benzene bearing a single hydroxymethyl substituent. cas:100-51-6|drugcentral:334|gmelin:26514|hmdb:HMDB0003119|kegg.compound:C00556|kegg.compound:C03485|kegg.drug:D00077|knapsack:C00029811|metacyc.compound:BENZYL-ALCOHOL|pubmed:11766131|pubmed:21557223|pubmed:22036973|reaxys:878307|umbbd.compound:c0278|wikipedia.en:Benzyl_Alcohol Graph (hydroxymethyl)benzene|Aromatic alcohol|Benzenemethanol|Benzyl alcohol|Benzylalkohol|Hydroxymethylbenzene|Phenylcarbinol|Phenylmethanol|alcoholum benzylicum|alcool benzylique|alpha-Hydroxytoluene|alpha-toluenol|benzenecarbinol|benzyl alcohol|benzylic alcohol|phenylmethanol|phenylmethyl alcohol Phenylmethanol|phenylmethanol (hydroxymethyl)benzene|Aromatic alcohol|Benzenemethanol|Benzyl alcohol|Benzylalkohol|Hydroxymethylbenzene|Phenylcarbinol|Phenylmethanol|alcoholum benzylicum|alcool benzylique|alpha-Hydroxytoluene|alpha-toluenol|benzenecarbinol|benzyl alcohol|benzylic alcohol|phenylmethanol|phenylmethyl alcohol http://purl.obolibrary.org/obo/CHEBI_17987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17989 biolink:ChemicalEntity daphnin cas:486-55-5|kegg.compound:C01421 Graph 7-(beta-D-glucopyranosyloxy)-8-hydroxy-2H-chromen-2-one|7-(beta-D-glucopyranosyloxy)-8-hydroxycoumarin|7-beta-D-glucopyranosyloxy-8-hydroxy-2H-1-benzopyran-2-one|8-hydroxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside|Daphnin|daphnin 7-(beta-D-glucopyranosyloxy)-8-hydroxy-2H-chromen-2-one 7-(beta-D-glucopyranosyloxy)-8-hydroxy-2H-chromen-2-one|7-(beta-D-glucopyranosyloxy)-8-hydroxycoumarin|7-beta-D-glucopyranosyloxy-8-hydroxy-2H-1-benzopyran-2-one|8-hydroxy-2-oxo-2H-chromen-7-yl beta-D-glucopyranoside|Daphnin|daphnin http://purl.obolibrary.org/obo/CHEBI_17989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17990 biolink:ChemicalEntity 1-O-(indol-3-ylacetyl)-beta-D-glucose beilstein:496559|cas:19817-95-9|kegg.compound:C04197 Graph 1-O-(1H-indol-3-ylacetyl)-beta-D-glucopyranose|1-O-(Indol-3-yl)acetyl-beta-D-glucose|1-O-(indol-3-ylacetyl)-beta-D-glucose|1-O-(indole-3-acetyl)-beta-1-D-glucose|1-O-Indol-3-ylacetyl-beta-D-glucose|1-O-Indol-3-ylacetylglucose|Iaa-glucose|Indole-3-acetyl-beta-1-D-glucose|Indole-3-acetyl-beta-1-D-glucoside|beta-D-glucopyranose, 1-(1H-indole-3-acetate)|indole-3-acetic acid beta-D-glucoside 1-O-(1H-indol-3-ylacetyl)-beta-D-glucopyranose 1-O-(1H-indol-3-ylacetyl)-beta-D-glucopyranose|1-O-(Indol-3-yl)acetyl-beta-D-glucose|1-O-(indol-3-ylacetyl)-beta-D-glucose|1-O-(indole-3-acetyl)-beta-1-D-glucose|1-O-Indol-3-ylacetyl-beta-D-glucose|1-O-Indol-3-ylacetylglucose|Iaa-glucose|Indole-3-acetyl-beta-1-D-glucose|Indole-3-acetyl-beta-1-D-glucoside|beta-D-glucopyranose, 1-(1H-indole-3-acetate)|indole-3-acetic acid beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_17990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:179906 biolink:ChemicalEntity 3-Phenylpropyl propanoate cas:122-74-7|chemspider:55011|hmdb:HMDB0036388 Graph 3-phenylpropyl propanoate 3-phenylpropyl propanoate 3-phenylpropyl propanoate http://purl.obolibrary.org/obo/CHEBI_179906 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:179916 biolink:ChemicalEntity Senkyunolide cas:63038-10-8|chemspider:2342201|kegg.compound:C17853 Graph (3S)-3-butyl-4,5-dihydro-3H-2-benzouran-1-one (3S)-3-butyl-4,5-dihydro-3H-2-benzouran-1-one (3S)-3-butyl-4,5-dihydro-3H-2-benzouran-1-one http://purl.obolibrary.org/obo/CHEBI_179916 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:17992 biolink:ChemicalEntity sucrose A glycosyl glycoside formed by glucose and fructose units joined by an acetal oxygen bridge from hemiacetal of glucose to the hemiketal of the fructose. cas:57-50-1|drugbank:DB02772|drugcentral:4610|gmelin:97695|hmdb:HMDB0000258|kegg.compound:C00089|kegg.drug:D00025|kegg.drug:D06533|kegg.glycan:G00370|knapsack:C00001151|metacyc.compound:SUCROSE|pdb-ccd:SUC|pubmed:11021636|pubmed:11093712|pubmed:11111003|pubmed:12065720|pubmed:12706980|pubmed:13508893|pubmed:15291457|pubmed:15660210|pubmed:15792978|pubmed:15845855|pubmed:16228482|pubmed:16304615|pubmed:16313996|pubmed:16525719|pubmed:16660545|pubmed:16663947|pubmed:16665852|pubmed:17233733|pubmed:17439666|pubmed:17597061|pubmed:18625236|pubmed:19199566|pubmed:19726178|pubmed:21703290|pubmed:21972845|pubmed:22085755|pubmed:22311778|pubmed:22404833|pubmed:22751876|reaxys:1435311|reaxys:90825|wikipedia.en:Sucrose Graph 1-alpha-D-Glucopyranosyl-2-beta-D-fructofuranoside|Cane sugar|SUCROSE|Saccharose|Sacharose|Sucrose|White sugar|beta-D-Fruf-(2<->1)-alpha-D-Glcp|beta-D-fructofuranosyl alpha-D-glucopyranoside|sacarosa|sucrose|table sugar beta-D-fructofuranosyl alpha-D-glucopyranoside 1-alpha-D-Glucopyranosyl-2-beta-D-fructofuranoside|Cane sugar|SUCROSE|Saccharose|Sacharose|Sucrose|White sugar|beta-D-Fruf-(2<->1)-alpha-D-Glcp|beta-D-fructofuranosyl alpha-D-glucopyranoside|sacarosa|sucrose|table sugar http://purl.obolibrary.org/obo/CHEBI_17992 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17993 biolink:ChemicalEntity 3-(3,4-dihydroxypyridinium-1-yl)-L-alanine A pyridinium ion that is L-alanine in which a methyl hydrogen is replaced by a 3,4-dioxidopyridinium-1-yl group. kegg.compound:C04446 Graph 3-(3,4-Dihydroxypyridin-1-yl)-L-alanine|3-(3,4-dihydroxypyridin-1-yl)-L-alanine|3-(3,4-dihydroxypyridinium-1-yl)-L-alanine 3-(3,4-dihydroxypyridinium-1-yl)-L-alanine 3-(3,4-Dihydroxypyridin-1-yl)-L-alanine|3-(3,4-dihydroxypyridin-1-yl)-L-alanine|3-(3,4-dihydroxypyridinium-1-yl)-L-alanine http://purl.obolibrary.org/obo/CHEBI_17993 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17994 biolink:ChemicalEntity D-ribose 1,5-bisphosphate A ribose bisphosphate that consists of D-ribose having two monophosphate groups at the 1- and 5-positions. cas:14689-84-0|kegg.compound:C01151 Graph 1,5-di-O-phosphono-D-ribofuranose|D-Ribofuranose, 1,5-bis(dihydrogen phosphate)|D-Ribose 1,5-bisphosphate|D-ribofuranose 1,5-bis(dihydrogen phosphate)|Ribose-1,5-bisphosphate|Ribose-1,5-diphosphate 1,5-di-O-phosphono-D-ribofuranose|D-ribofuranose 1,5-bis(dihydrogen phosphate) 1,5-di-O-phosphono-D-ribofuranose|D-Ribofuranose, 1,5-bis(dihydrogen phosphate)|D-Ribose 1,5-bisphosphate|D-ribofuranose 1,5-bis(dihydrogen phosphate)|Ribose-1,5-bisphosphate|Ribose-1,5-diphosphate http://purl.obolibrary.org/obo/CHEBI_17994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17996 biolink:ChemicalEntity chloride A halide anion formed when chlorine picks up an electron to form an an anion. beilstein:3587171|cas:16887-00-6|foodb.food:FDB006557|gmelin:14910|hmdb:HMDB0000492|kegg.compound:C00698|metacyc.compound:CL-|pdb-ccd:CL|pubmed:38280867|pubmed:38573803|pubmed:38604039|umbbd.compound:c0884|wikipedia.en:Chloride Graph CHLORIDE ION|Chloride|Chloride ion|Chloride(1-)|Chlorine anion|Cl(-)|Cl-|chloride|chloride(1-) Chloride|chloride|chloride(1-) CHLORIDE ION|Chloride|Chloride ion|Chloride(1-)|Chlorine anion|Cl(-)|Cl-|chloride|chloride(1-) http://purl.obolibrary.org/obo/CHEBI_17996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17997 biolink:ChemicalEntity dinitrogen An elemental molecule consisting of two trivalently-bonded nitrogen atoms. cas:7727-37-9|drugcentral:4251|gmelin:150|hmdb:HMDB0001371|kegg.compound:C00697|kegg.drug:D00083|metacyc.compound:NITROGEN-MOLECULE|pdb-ccd:HDZ|pubmed:18334638|pubmed:22237545|reaxys:15940095|wikipedia.en:Nitrogen Graph N#N|N(2)|N2|Nitrogen|dinitrogen|molecular nitrogen Nitrogen|dinitrogen N#N|N(2)|N2|Nitrogen|dinitrogen|molecular nitrogen http://purl.obolibrary.org/obo/CHEBI_17997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17998 biolink:ChemicalEntity 4-methylpentanal cas:1119-16-0|kegg.compound:C02373 Graph 4-Methyl valeraldehyde|4-Methylpentanal|4-methylpentanal|Isocaproaldehyde|Isohexanal 4-Methylpentanal|4-methylpentanal 4-Methyl valeraldehyde|4-Methylpentanal|4-methylpentanal|Isocaproaldehyde|Isohexanal http://purl.obolibrary.org/obo/CHEBI_17998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:17999 biolink:ChemicalEntity protein dithiol kegg.compound:C02315 Graph Protein dithiol|protein dithiols Protein dithiol|protein dithiols http://purl.obolibrary.org/obo/CHEBI_17999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18000 biolink:ChemicalEntity aralkylamine An alkylamine in which the alkyl group is substituted by an aromatic group. kegg.compound:C01890|metacyc.compound:Arylalkylamines|wikipedia.en:Arylalkylamine Graph Aralkylamine|Arylalkylamine|aralkylamines Aralkylamine|Arylalkylamine|aralkylamines http://purl.obolibrary.org/obo/CHEBI_18000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18002 biolink:ChemicalEntity (-)-secologanin An iridoid monoterpenoid that is acetaldehyde in which on of the hydrogens of the methyl group has been replaced by a 2-(β-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-4-yl group which is substituted at positions 3 and 5 by a vinyl and a methoxycarbonyl group, respectively (the 2S,3R,4S stereoisomer). beilstein:1441446|cas:19351-63-4|kegg.compound:C01852|knapsack:C00003098|lipidmaps:LMPR0102070002|metacyc.compound:SECOLOGANIN-CPD|pdb-ccd:SCG|pubmed:24104568|pubmed:26285573|reaxys:1441446|wikipedia.en:Secologanin Graph (-)-Secologanin|3-Ethenyl-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-4-(2-oxoethyl)-2H-pyran-5-carboxylic acid, methyl ester|METHYL (2S,3R,4S)-2-(BETA-D-GLUCOPYRANOSYLOXY)-4-(2-OXOETHYL)-3-VINYL-3,4-DIHYDRO-2H-PYRAN-5-CARBOXYLATE|Secologanin|methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-(2-oxoethyl)-3,4-dihydro-2H-pyran-5-carboxylate|methyl (2S,3R,4S)-4-(formylmethyl)-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-3-vinyl-2H-pyran-5-carboxylate|secologanin methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-(2-oxoethyl)-3,4-dihydro-2H-pyran-5-carboxylate (-)-Secologanin|3-Ethenyl-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-4-(2-oxoethyl)-2H-pyran-5-carboxylic acid, methyl ester|METHYL (2S,3R,4S)-2-(BETA-D-GLUCOPYRANOSYLOXY)-4-(2-OXOETHYL)-3-VINYL-3,4-DIHYDRO-2H-PYRAN-5-CARBOXYLATE|Secologanin|methyl (2S,3R,4S)-3-ethenyl-2-(beta-D-glucopyranosyloxy)-4-(2-oxoethyl)-3,4-dihydro-2H-pyran-5-carboxylate|methyl (2S,3R,4S)-4-(formylmethyl)-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-3-vinyl-2H-pyran-5-carboxylate|secologanin http://purl.obolibrary.org/obo/CHEBI_18002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18003 biolink:ChemicalEntity 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioic acid A carboxy-2-hydroxymuconate semialdehyde having the carboxy group at the 3-position. kegg.compound:C04480 Graph 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioic acid|3-Carboxy-2-hydroxymuconate semialdehyde 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioic acid 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioic acid|3-Carboxy-2-hydroxymuconate semialdehyde http://purl.obolibrary.org/obo/CHEBI_18003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18004 biolink:ChemicalEntity D-hamamelose An aldopentose comprising D-ribose having a hydroxymethyl group at the 2-position. cas:4573-78-8|kegg.compound:C01906 Graph 2-C-(hydroxymethyl)-D-ribose|2-C-Hydroxymethyl-D-ribose|D-Hamamelose|D-hamamelose 2-C-(hydroxymethyl)-D-ribose 2-C-(hydroxymethyl)-D-ribose|2-C-Hydroxymethyl-D-ribose|D-Hamamelose|D-hamamelose http://purl.obolibrary.org/obo/CHEBI_18004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18005 biolink:ChemicalEntity keto-phenylpyruvate A 2-oxo monocarboxylic acid anion resulting from deprotonation of the carboxy group of keto-phenylpyruvic acid. beilstein:3944391|gmelin:847922|kegg.compound:C00166|metacyc.compound:PHENYL-PYRUVATE Graph 2-oxo-3-phenylpropanoate|3-(4-hydroxyphenyl)pyruvate|3-phenyl-2-oxopropanoate|3-phenylpyruvate 2-oxo-3-phenylpropanoate 2-oxo-3-phenylpropanoate|3-(4-hydroxyphenyl)pyruvate|3-phenyl-2-oxopropanoate|3-phenylpyruvate http://purl.obolibrary.org/obo/CHEBI_18005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18007 biolink:ChemicalEntity 3-[hydroxy(oxido)phosphoranyl]pyruvic acid beilstein:4965716|cas:144705-32-8|kegg.compound:C06368 Graph (2-carboxy-2-oxoethyl)hydroxyphosphine oxide|(Hydroxyphosphinyl)pyruvate|(hydroxyphosphinyl)pyruvic acid|3-(Hydrohydroxyphosphoryl)pyruvate|3-[hydroxy(oxido)-lambda(5)-phosphanyl]-2-oxopropanoic acid|3-[hydroxy(oxido)phosphino]-2-oxopropanoic acid|3-[hydroxy(oxido)phosphoranyl]-2-oxopropanoic acid|OHPPA 3-[hydroxy(oxido)-lambda(5)-phosphanyl]-2-oxopropanoic acid (2-carboxy-2-oxoethyl)hydroxyphosphine oxide|(Hydroxyphosphinyl)pyruvate|(hydroxyphosphinyl)pyruvic acid|3-(Hydrohydroxyphosphoryl)pyruvate|3-[hydroxy(oxido)-lambda(5)-phosphanyl]-2-oxopropanoic acid|3-[hydroxy(oxido)phosphino]-2-oxopropanoic acid|3-[hydroxy(oxido)phosphoranyl]-2-oxopropanoic acid|OHPPA http://purl.obolibrary.org/obo/CHEBI_18007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18009 biolink:ChemicalEntity NADP(+) beilstein:3645734|cas:53-59-8|kegg.compound:C00006|pdb-ccd:NAP Graph 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|NADP|NADP+|Nicotinamide adenine dinucleotide phosphate|TPN|Triphosphopyridine nucleotide|beta-Nicotinamide adenine dinucleotide phosphate|beta-nicotinamide adenine dinucleotide phosphate|oxidized nicotinamide-adenine dinucleotide phosphate 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate} 2'-O-phosphonoadenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|NADP|NADP+|Nicotinamide adenine dinucleotide phosphate|TPN|Triphosphopyridine nucleotide|beta-Nicotinamide adenine dinucleotide phosphate|beta-nicotinamide adenine dinucleotide phosphate|oxidized nicotinamide-adenine dinucleotide phosphate http://purl.obolibrary.org/obo/CHEBI_18009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18010 biolink:ChemicalEntity 3',4',5-trihydroxy-3,7-dimethoxyflavone A dimethoxyflavone that the 3,7-di-O-methyl derivative of quercetin. cas:2068-02-2|kegg.compound:C01265|knapsack:C00004638|metacyc.compound:345-TRIHYDROXY-37-DIMETHOXYFLAVONE|pubmed:19031255|pubmed:2632060|reaxys:338444 Graph 2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4-benzopyrone|2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one|3',4',5-Trihydroxy-3,7-dimethoxyflavone|3,7-Di-O-methylquercetin|3,7-O-dimethylquercetin 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one 2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4-benzopyrone|2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-chromen-4-one|3',4',5-Trihydroxy-3,7-dimethoxyflavone|3,7-Di-O-methylquercetin|3,7-O-dimethylquercetin http://purl.obolibrary.org/obo/CHEBI_18010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18011 biolink:ChemicalEntity androstane-3alpha,17beta-diol beilstein:5262418|kegg.compound:C03852 Graph Androstan-3alpha,17beta-diol|androstan-3-alpha,17-beta-diol|androstane-3alpha,17beta-diol androstane-3alpha,17beta-diol Androstan-3alpha,17beta-diol|androstan-3-alpha,17-beta-diol|androstane-3alpha,17beta-diol http://purl.obolibrary.org/obo/CHEBI_18011 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18012 biolink:ChemicalEntity fumaric acid A butenedioic acid in which the C=C double bond has E geometry. It is an intermediate metabolite in the citric acid cycle. cas:110-17-8|drugbank:DB01677|drugcentral:3229|foodb.food:FDB003291|gmelin:49855|hmdb:HMDB0000134|kegg.compound:C00122|kegg.drug:D02308|knapsack:C00001183|metacyc.compound:FUM|pdb-ccd:FUM|ppdb:1347|pubmed:17439666|pubmed:21414846|pubmed:22113915|pubmed:22217732|pubmed:22516248|pubmed:23472183|reaxys:605763|wikipedia.en:Fumaric_Acid Graph (2E)-2-butenedioic acid|(2E)-but-2-enedioic acid|(E)-2-butenedioic acid|E297|FUMARIC ACID|Fumaric acid|Fumarsaeure|trans-1,2-ethylenedicarboxylic acid|trans-Butenedioic acid|trans-but-2-enedioic acid|trans-ethene-1,2-dioic acid (2E)-but-2-enedioic acid (2E)-2-butenedioic acid|(2E)-but-2-enedioic acid|(E)-2-butenedioic acid|E297|FUMARIC ACID|Fumaric acid|Fumarsaeure|trans-1,2-ethylenedicarboxylic acid|trans-Butenedioic acid|trans-but-2-enedioic acid|trans-ethene-1,2-dioic acid http://purl.obolibrary.org/obo/CHEBI_18012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18013 biolink:ChemicalEntity 4-O-feruloyl-D-quinic acid The 4-O-feruloyl derivative of D-quinic acid. kegg.compound:C02572|reaxys:2779349 Graph (1S,3R,4S,5R)-1,3,5-trihydroxy-4-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexanecarboxylic acid|O-Feruloylquinate (1S,3R,4S,5R)-1,3,5-trihydroxy-4-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexanecarboxylic acid (1S,3R,4S,5R)-1,3,5-trihydroxy-4-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexanecarboxylic acid|O-Feruloylquinate http://purl.obolibrary.org/obo/CHEBI_18013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18014 biolink:ChemicalEntity CMP-3-deoxy-alpha-D-manno-octulosonic acid A CMP-sugar having 3-deoxy-α-D-manno-octulosonic acid as the sugar component. Graph CMP-KDO|cytidine 5'-[(3-deoxy-alpha-D-manno-oct-2-ulopyranosonyl) hydrogen phosphate] cytidine 5'-[(3-deoxy-alpha-D-manno-oct-2-ulopyranosonyl) hydrogen phosphate] CMP-KDO|cytidine 5'-[(3-deoxy-alpha-D-manno-oct-2-ulopyranosonyl) hydrogen phosphate] http://purl.obolibrary.org/obo/CHEBI_18014 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18015 biolink:ChemicalEntity oxidized Latia luciferin A methyl ketone in which the keto group is attached to a 2-(2,6,6-trimethylcyclohex-1-en-1-yl)ethyl group. cas:17283-81-7|kegg.compound:C03527|metacyc.compound:OXIDIZED-LATIA-LUCIFERIN Graph 4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-one|7,8-dihydro-beta-ionone|Oxidized Latia luciferin|dihydro-beta-ionone|oxidized Latia luciferin 4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-one 4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-one|7,8-dihydro-beta-ionone|Oxidized Latia luciferin|dihydro-beta-ionone|oxidized Latia luciferin http://purl.obolibrary.org/obo/CHEBI_18015 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18016 biolink:ChemicalEntity 3',4',5-trihydroxy-3,6,7-trimethoxyflavone A trimethoxyflavone that is the 3,6,7-trimethyl ether derivative of quercetagetin. kegg.compound:C04552|knapsack:C00004692|lipidmaps:LMPK12112998|pubmed:11141110|pubmed:18855445|pubmed:21469236|reaxys:350587 Graph 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one|3',4',5-Trihydroxy-3,6,7-trimethoxyflavone|3',4',5-trihydroxy-3,6,7-trimethoxyflavone|Chrysosplenol D|quercetagetin 3,6,7-trimethyl ether 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4H-chromen-4-one|3',4',5-Trihydroxy-3,6,7-trimethoxyflavone|3',4',5-trihydroxy-3,6,7-trimethoxyflavone|Chrysosplenol D|quercetagetin 3,6,7-trimethyl ether http://purl.obolibrary.org/obo/CHEBI_18016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18019 biolink:ChemicalEntity L-lysine An L-α-amino acid; the L-isomer of lysine. cas:56-87-1|drugbank:DB00123|drugcentral:1622|ecmdb:ECMDB00182|gmelin:364182|hmdb:HMDB0000182|kegg.compound:C00047|kegg.drug:D02304|knapsack:C00001378|metacyc.compound:LYS|pubmed:10930630|pubmed:16901854|pubmed:17051348|pubmed:17979222|pubmed:22019452|pubmed:22064742|pubmed:22575419|pubmed:22735334|pubmed:23167968|pubmed:23325920|pubmed:23722415|pubmed:24064214|pubmed:24831709|pubmed:25108762|pubmed:8070089|pubmed:8587651|reaxys:1722531|wikipedia.en:Lysine|ymdb:YMDB00330 Graph (2S)-2,6-diaminohexanoic acid|(S)-2,6-diaminohexanoic acid|(S)-alpha,epsilon-diaminocaproic acid|(S)-lysine|6-ammonio-L-norleucine|K|L-2,6-Diaminocaproic acid|L-Lysin|L-Lysine|L-lysine|Lys|Lysine acid|lysina|lysine|lysinum (2S)-2,6-diaminohexanoic acid|L-Lysine|L-lysine (2S)-2,6-diaminohexanoic acid|(S)-2,6-diaminohexanoic acid|(S)-alpha,epsilon-diaminocaproic acid|(S)-lysine|6-ammonio-L-norleucine|K|L-2,6-Diaminocaproic acid|L-Lysin|L-Lysine|L-lysine|Lys|Lysine acid|lysina|lysine|lysinum http://purl.obolibrary.org/obo/CHEBI_18019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18020 biolink:ChemicalEntity 4-trimethylammoniobutanal cas:64595-66-0|kegg.compound:C01149 Graph 4-(trimethylamino)butanal|4-Trimethylammoniobutanal|N,N,N-trimethyl-4-oxobutan-1-aminium N,N,N-trimethyl-4-oxobutan-1-aminium 4-(trimethylamino)butanal|4-Trimethylammoniobutanal|N,N,N-trimethyl-4-oxobutan-1-aminium http://purl.obolibrary.org/obo/CHEBI_18020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18021 biolink:ChemicalEntity phosphoenolpyruvate A monocarboxylic acid anion resuting from selective deprotonation of the carboxy group of phosphoenolpyruvic acid. cas:73-89-2|kegg.compound:C00074|pdb-ccd:PEP|reaxys:3946007 Graph 2-(phosphonooxy)-2-propenoate|2-(phosphonooxy)acrylate|2-(phosphonooxy)prop-2-enoate|2-hydroxy-2-propenoate (dihydrogen phosphate) (ester)|2-hydroxy-2-propenoate phosphate (ester)|O-phosphono-enol-pyruvate|PEP|PHOSPHOENOLPYRUVATE|Phosphoenolpyruvate|phosphoenolpyruvate(1-) 2-(phosphonooxy)prop-2-enoate 2-(phosphonooxy)-2-propenoate|2-(phosphonooxy)acrylate|2-(phosphonooxy)prop-2-enoate|2-hydroxy-2-propenoate (dihydrogen phosphate) (ester)|2-hydroxy-2-propenoate phosphate (ester)|O-phosphono-enol-pyruvate|PEP|PHOSPHOENOLPYRUVATE|Phosphoenolpyruvate|phosphoenolpyruvate(1-) http://purl.obolibrary.org/obo/CHEBI_18021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18022 biolink:ChemicalEntity thiocyanate A pseudohalide anion obtained by deprotonation of the thiol group of thiocyanic acid. beilstein:1901207|cas:302-04-5|gmelin:1089|pdb-ccd:SCN|umbbd.compound:c0560 Graph N#C-S(-)|NCS-|Rhodanid|SCN(-)|THIOCYANATE ION|Thiozyanat|[S-C#N](-)|nitridosulfidocarbonate(1-)|nitridothiocarbonate(1-)|nitridothiocarbonate(IV)|rhodanide|thiocyanate|thiocyanate ion (1-) nitridosulfidocarbonate(1-)|nitridothiocarbonate(1-)|nitridothiocarbonate(IV) N#C-S(-)|NCS-|Rhodanid|SCN(-)|THIOCYANATE ION|Thiozyanat|[S-C#N](-)|nitridosulfidocarbonate(1-)|nitridothiocarbonate(1-)|nitridothiocarbonate(IV)|rhodanide|thiocyanate|thiocyanate ion (1-) http://purl.obolibrary.org/obo/CHEBI_18022 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18023 biolink:ChemicalEntity sirohydrochlorin cas:65207-12-7|kegg.compound:C05778|knapsack:C00007315 Graph (7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrapropionic acid|Sirohydrochlorin|sirohydrochlorin Sirohydrochlorin|sirohydrochlorin (7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrapropionic acid|Sirohydrochlorin|sirohydrochlorin http://purl.obolibrary.org/obo/CHEBI_18023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18024 biolink:ChemicalEntity D-galacturonic acid The D-enantiomer of galacturonic acid. It is the main component of pectin. pubmed:21683149|pubmed:24502254 Graph D-galacturonate|D-galacturonic acid|D-galacturonic acids D-galacturonate|D-galacturonic acid D-galacturonate|D-galacturonic acid|D-galacturonic acids http://purl.obolibrary.org/obo/CHEBI_18024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18025 biolink:ChemicalEntity 2-hydroxypropyl dihydrogen phosphate A hydroxyalkyl phosphate consisting of propane-1,2-diol having a phosphate group at the 1-position. beilstein:1705123|cas:10602-14-9|kegg.compound:C03894 Graph 1,2-propanediol, 1-phosphate|2-hydroxypropyl dihydrogen phosphate|Propane-1,2-diol 1-phosphate 2-hydroxypropyl dihydrogen phosphate 1,2-propanediol, 1-phosphate|2-hydroxypropyl dihydrogen phosphate|Propane-1,2-diol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_18025 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18026 biolink:ChemicalEntity 2,3-dihydroxybenzoic acid A dihydroxybenzoic acid that is benzoic acid substituted by hydroxy groups at positions 2 and 3. It occurs naturally in Phyllanthus acidus and in the aquatic fern Salvinia molesta. cas:303-38-8|drugbank:DB01672|hmdb:HMDB0000397|kegg.compound:C00196|knapsack:C00002669|pdb-ccd:DBH|pubmed:17065237|pubmed:24171385|pubmed:3575393|reaxys:2209117|wikipedia.en:2,3-Dihydroxybenzoic_acid Graph 2,3 DHB|2,3-DIHYDROXY-BENZOIC ACID|2,3-Dihydroxybenzoic acid|2,3-dihydroxybenzoic acid|2-pyrocatechuic acid|3-hydroxysalicylic acid|DOBK|catechol-3-carboxylic acid|o-pyrocatechuic acid|pyrocatechuic acid 2,3-Dihydroxybenzoic acid|2,3-dihydroxybenzoic acid 2,3 DHB|2,3-DIHYDROXY-BENZOIC ACID|2,3-Dihydroxybenzoic acid|2,3-dihydroxybenzoic acid|2-pyrocatechuic acid|3-hydroxysalicylic acid|DOBK|catechol-3-carboxylic acid|o-pyrocatechuic acid|pyrocatechuic acid http://purl.obolibrary.org/obo/CHEBI_18026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18027 biolink:ChemicalEntity (-)-aristolochene beilstein:2249047|beilstein:3588802|cas:26620-71-3|kegg.compound:C02004 Graph (-)-aristolochene|(1R,7R,8aS)-aristolochene|(4R,4aS,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH,5alpha-eremophila-9,11-diene|Aristolochene (4R,4aS,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH,5alpha-eremophila-9,11-diene (-)-aristolochene|(1R,7R,8aS)-aristolochene|(4R,4aS,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH,5alpha-eremophila-9,11-diene|Aristolochene http://purl.obolibrary.org/obo/CHEBI_18027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18029 biolink:ChemicalEntity dihydromacarpine A benzophenanthridine alkaloid that is dihydrosanguinarine bearing two methoxy substituents. cas:77785-12-7|kegg.compound:C05316|knapsack:C00024644|knapsack:C00028198|pubmed:2213031|reaxys:4338795 Graph 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13,14-dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|5,7-dimethoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydromacarpine|dihydromacarpine 5,7-dimethoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|13,14-dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine|5,7-dimethoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine|Dihydromacarpine|dihydromacarpine http://purl.obolibrary.org/obo/CHEBI_18029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18030 biolink:ChemicalEntity quercetin 3,4'-bissulfate A quercetin bissulfate having the sulfo groups at the 3- and 4'-positions. kegg.compound:C01156|knapsack:C00004961|metacyc.compound:QUERCETIN-34-BISSULFATE|reaxys:6773573 Graph 5,7-dihydroxy-2-[3-hydroxy-4-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate|Quercetin 3,4'-bissulfate|quercetin 3,4'-bis(hydrogen sulfate) 5,7-dihydroxy-2-[3-hydroxy-4-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate 5,7-dihydroxy-2-[3-hydroxy-4-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl hydrogen sulfate|Quercetin 3,4'-bissulfate|quercetin 3,4'-bis(hydrogen sulfate) http://purl.obolibrary.org/obo/CHEBI_18030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18032 biolink:ChemicalEntity 4-amino-2-methyl-5-phosphooxymethylpyrimidine An aminopyrimidine having the amino group at the 4-position together with methyl and phosphooxymethyl groups at the 2- and 5-positions respectively. kegg.compound:C04556|knapsack:C00007607|pdb-ccd:MP5|pubmed:15967475|pubmed:24161603|pubmed:26324451|reaxys:210187 Graph (4-amino-2-methylpyrimidin-5-yl)methyl dihydrogen phosphate|4-Amino-2-methyl-5-phosphomethylpyrimidine|4-Amino-5-phosphomethyl-2-methylpyrimidine|4-amino-2-methyl-5-hydroxymethylpyrimidine phosphate|4-amino-2-methyl-5-phosphonooxymethylpyrimidine|4-amino-5-phosphomethyl-2-methylpyrimidine|HMP-P (4-amino-2-methylpyrimidin-5-yl)methyl dihydrogen phosphate (4-amino-2-methylpyrimidin-5-yl)methyl dihydrogen phosphate|4-Amino-2-methyl-5-phosphomethylpyrimidine|4-Amino-5-phosphomethyl-2-methylpyrimidine|4-amino-2-methyl-5-hydroxymethylpyrimidine phosphate|4-amino-2-methyl-5-phosphonooxymethylpyrimidine|4-amino-5-phosphomethyl-2-methylpyrimidine|HMP-P http://purl.obolibrary.org/obo/CHEBI_18032 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18033 biolink:ChemicalEntity 2-formylphenylformamide kegg.compound:C03574 Graph 2-Formylaminobenzaldehyde|2-formamidobenzaldehyde|2-formylphenylformamide 2-formylphenylformamide 2-Formylaminobenzaldehyde|2-formamidobenzaldehyde|2-formylphenylformamide http://purl.obolibrary.org/obo/CHEBI_18033 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18034 biolink:ChemicalEntity 4-fumarylacetoacetate(2-) A dicarboxylic acid dianion resuting from removal of a proton from both carboxy groups of 4-fumarylacetoacetic acid. kegg.compound:C01061|pubmed:11532983|umbbd.compound:c0110 Graph (2E)-4,6-dioxooct-2-enedioate|4-fumarylacetoacetate|4-fumarylacetoacetate dianion|fumarylacetoacetate (2E)-4,6-dioxooct-2-enedioate (2E)-4,6-dioxooct-2-enedioate|4-fumarylacetoacetate|4-fumarylacetoacetate dianion|fumarylacetoacetate http://purl.obolibrary.org/obo/CHEBI_18034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18035 biolink:ChemicalEntity diglyceride A glyceride that is glycerol in which any two of the hydroxy groups have been acylated. In the structure shown, two of the R groups (positions not specified) are acyl groups while the remaining R group can be either H or an alkyl group. kegg.compound:C00165|lipidmaps_class:LMGL0201 Graph Diacylglycerol|Diglyceride|a diacylglycerol|di-O-acylglycerols|diacylglycerols|diglycerides diglycerides Diacylglycerol|Diglyceride|a diacylglycerol|di-O-acylglycerols|diacylglycerols|diglycerides http://purl.obolibrary.org/obo/CHEBI_18035 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18036 biolink:ChemicalEntity triphosphate(5-) cas:14127-68-5|gmelin:28089|gmelin:4290|kegg.compound:C00536 Graph Inorganic triphosphate|P3O10(5-)|Triphosphate|Tripolyphosphate|bis(tetraoxidophosphato)dioxidophosphate(5-)|catena-triphosphate|triphosphate bis(tetraoxidophosphato)dioxidophosphate(5-) Inorganic triphosphate|P3O10(5-)|Triphosphate|Tripolyphosphate|bis(tetraoxidophosphato)dioxidophosphate(5-)|catena-triphosphate|triphosphate http://purl.obolibrary.org/obo/CHEBI_18036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18037 biolink:ChemicalEntity 3-oxolauric acid kegg.compound:C02367|lipidmaps:LMFA01060091|pdb-ccd:3LA Graph 3-Oxododecanoate|3-Oxododecanoic acid|3-oxododecanoic acid 3-Oxododecanoic acid|3-oxododecanoic acid 3-Oxododecanoate|3-Oxododecanoic acid|3-oxododecanoic acid http://purl.obolibrary.org/obo/CHEBI_18037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18038 biolink:ChemicalEntity GDP-L-galactose A GDP-galactose where the galactose moiety has L-configuration. kegg.compound:C02280 Graph GDP-L-galactose|guanosine 5'-[3-(L-galactopyranosyl) dihydrogen diphosphate] guanosine 5'-[3-(L-galactopyranosyl) dihydrogen diphosphate] GDP-L-galactose|guanosine 5'-[3-(L-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_18038 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18039 biolink:ChemicalEntity N-phospho-L-lombricine A phosphoramide consisting of L-lombricine having a phospho group attached to the guanidine. cas:25540-15-2|kegg.compound:C14178 Graph N-Phospho-L-lombricine|N-Phospholombricine|N-Phosphoryl lombricine|N-Phosphoryllombricine|N-phosphonolombricine|O-[hydroxy(2-{[imino(phosphonoamino)methyl]amino}ethoxy)phosphoryl]-L-serine O-[hydroxy(2-{[imino(phosphonoamino)methyl]amino}ethoxy)phosphoryl]-L-serine N-Phospho-L-lombricine|N-Phospholombricine|N-Phosphoryl lombricine|N-Phosphoryllombricine|N-phosphonolombricine|O-[hydroxy(2-{[imino(phosphonoamino)methyl]amino}ethoxy)phosphoryl]-L-serine http://purl.obolibrary.org/obo/CHEBI_18039 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18040 biolink:ChemicalEntity erythro-5-hydroxy-L-lysine A 5-hydroxylysine consisting of L-lysine having an (R)-hydroxy group at the 5-position. cas:1190-94-9|hmdb:HMDB0000450|kegg.compound:C16741|metacyc.compound:CPD-14226|pdb-ccd:LYZ|reaxys:1723696 Graph (2S,5R)-2,6-diamino-5-hydroxyhexanoic acid|(2S,5R)-5-hydroxylysine|(5R)-5-Hydroxy-L-lysine|5-HYDROXYLYSINE|L-erythro-5-Hydroxylysine|L-normal-5-hydroxylysine|alpha,epsilon-diamino-delta-hydroxycaproic acid|erythro-5-Hydroxy-L-lysine (2S,5R)-2,6-diamino-5-hydroxyhexanoic acid|5-HYDROXYLYSINE (2S,5R)-2,6-diamino-5-hydroxyhexanoic acid|(2S,5R)-5-hydroxylysine|(5R)-5-Hydroxy-L-lysine|5-HYDROXYLYSINE|L-erythro-5-Hydroxylysine|L-normal-5-hydroxylysine|alpha,epsilon-diamino-delta-hydroxycaproic acid|erythro-5-Hydroxy-L-lysine http://purl.obolibrary.org/obo/CHEBI_18040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18041 biolink:ChemicalEntity (S)-lactaldehyde agr:IND607369847|cas:3913-64-2|cas:598-35-6|drugbank:DB03776|kegg.compound:C00424|knapsack:C00019649|pubmed:15995211|pubmed:18793327|pubmed:2644239|pubmed:3275622|pubmed:36354948|pubmed:37261425 Graph (2S)-2-hydroxypropanal|(S)-Lactaldehyde|(S)-lactaldehyde|L-2-Hydroxypropionaldehyde|L-2-hydroxypropionaldehyde|L-Lactaldehyde|L-lactaldehyde (2S)-2-hydroxypropanal (2S)-2-hydroxypropanal|(S)-Lactaldehyde|(S)-lactaldehyde|L-2-Hydroxypropionaldehyde|L-2-hydroxypropionaldehyde|L-Lactaldehyde|L-lactaldehyde http://purl.obolibrary.org/obo/CHEBI_18041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18043 biolink:ChemicalEntity ricinine cas:524-40-3|kegg.compound:C01526|knapsack:C00002069|lincs.smallmolecule:LSM-3851 Graph 1,2-dihydro-4-methoxy-1-methyl-2-oxo-3-pyridimecarbonitrile|4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile|Ricinine|ricinine 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile 1,2-dihydro-4-methoxy-1-methyl-2-oxo-3-pyridimecarbonitrile|4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile|Ricinine|ricinine http://purl.obolibrary.org/obo/CHEBI_18043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18044 biolink:ChemicalEntity dialkyl ketone kegg.compound:C02146 Graph Dialkyl ketone|dialkyl ketone|dialkyl ketones Dialkyl ketone|dialkyl ketone|dialkyl ketones http://purl.obolibrary.org/obo/CHEBI_18044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180459 biolink:ChemicalEntity tetrodotoxin(1+) An iminium ion resulting from the protonation of the imine group of tetrodotoxin; major species at pH 7.3. Graph (4R,4aR,5R,6S,7S,9S,10S,10aR,11R)-4,6,9,10,11-pentahydroxy-6-(hydroxymethyl)octahydro-5,9-epoxy-7,10a-methanooxocino[4,5-d]pyrimidin-2(1H)-iminium|TTX(1+)|tetrodotoxin|tetrodotoxin cation (4R,4aR,5R,6S,7S,9S,10S,10aR,11R)-4,6,9,10,11-pentahydroxy-6-(hydroxymethyl)octahydro-5,9-epoxy-7,10a-methanooxocino[4,5-d]pyrimidin-2(1H)-iminium (4R,4aR,5R,6S,7S,9S,10S,10aR,11R)-4,6,9,10,11-pentahydroxy-6-(hydroxymethyl)octahydro-5,9-epoxy-7,10a-methanooxocino[4,5-d]pyrimidin-2(1H)-iminium|TTX(1+)|tetrodotoxin|tetrodotoxin cation http://purl.obolibrary.org/obo/CHEBI_180459 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18046 biolink:ChemicalEntity 4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde A carboxy-2-hydroxymuconate semialdehyde having the carboxy group at the 4-position and the aldehyde functijon at the 6-position. cas:28345-81-5|kegg.compound:C04484|umbbd.compound:c0192 Graph (2E,4E)-2-hydroxy-4-(2-oxoethylidene)pent-2-enedioic acid|2-hydroxy-4-carboxymuconate semialdehyde|4-Carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde|4-Carboxy-2-hydroxymuconate semialdehyde|4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde (2E,4E)-2-hydroxy-4-(2-oxoethylidene)pent-2-enedioic acid (2E,4E)-2-hydroxy-4-(2-oxoethylidene)pent-2-enedioic acid|2-hydroxy-4-carboxymuconate semialdehyde|4-Carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde|4-Carboxy-2-hydroxymuconate semialdehyde|4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde http://purl.obolibrary.org/obo/CHEBI_18046 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180460 biolink:ChemicalEntity Paracetamol-Cys-Gly conjugate An intermediate metabolite in the detoxification of the active paracetamol metabolite NAPQI Graph http://purl.obolibrary.org/obo/CHEBI_180460 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18047 biolink:ChemicalEntity dihydrolipoic acid A thio-fatty acid that is reduced form of lipoic acid. A potent antioxidant shown to directly destroy superoxide, hydroperoxy and hydroxyl radicals; also has neuroprotective and anti-tumour effects. cas:462-20-4|drugbank:DB03760|gmelin:675796|hmdb:HMDB0012210|kegg.compound:C02147|pubmed:12127266|pubmed:1345759|pubmed:17403519|pubmed:18951944|reaxys:1722777|wikipedia.en:Dihydrolipoic_acid Graph 6,8-Dihydrothioctic acid|6,8-bis-sulfanyloctanoic acid|6,8-dimercapto-octanoic acid|6,8-dimercaptooctanoic acid|6,8-disulfanyloctanoic acid|DHLA|Dihydrolipoic acid|Dihydrothioctic acid|dihydro-alpha-lipoic acid|dihydro-lipoic acid 6,8-disulfanyloctanoic acid 6,8-Dihydrothioctic acid|6,8-bis-sulfanyloctanoic acid|6,8-dimercapto-octanoic acid|6,8-dimercaptooctanoic acid|6,8-disulfanyloctanoic acid|DHLA|Dihydrolipoic acid|Dihydrothioctic acid|dihydro-alpha-lipoic acid|dihydro-lipoic acid http://purl.obolibrary.org/obo/CHEBI_18047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18048 biolink:ChemicalEntity DIMBOA A lactol that is DIBOA in which the hydrogen at position 7 is replaced by a methoxy group. It has been isolated from the maize plants. cas:15893-52-4|hmdb:HMDB0034864|kegg.compound:C04720|knapsack:C00026498|pubmed:23647315|pubmed:23771234|reaxys:1078658|wikipedia.en:DIMBOA Graph 2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one|2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one|2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one|DIMBOA 2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one|2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one|2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one|2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one|DIMBOA http://purl.obolibrary.org/obo/CHEBI_18048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180480 biolink:ChemicalEntity amperozide A member of the class of ureas that is urea in which three of the four hydrogens are replaced by ethyl and 4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl groups. An atypical antipsychotic which was in clinical development for the treatment of schizophrenia and substance-related disorders. It is a potent 5-HT2A antagonist and used in veterinary medicine because of its sedative effect on pigs. cas:75558-90-6|chemspider:66062|drugbank:DB08927|drugcentral:193|hmdb:HMDB0248358|lincs.smallmolecule:LSM-3159|patent:EP0517787|patent:WO9112805|pubmed:10068147|pubmed:10512574|pubmed:10627067|pubmed:10975635|pubmed:12127016|pubmed:12213521|pubmed:18666714|pubmed:19850474|pubmed:2106131|pubmed:2111999|pubmed:2154737|pubmed:2224491|pubmed:2304894|pubmed:2304896|pubmed:2406715|pubmed:24134630|pubmed:2746728|pubmed:3751811|pubmed:7879876|pubmed:8050470|pubmed:8060520|pubmed:8255902|pubmed:8405119|pubmed:9443541|pubmed:9597673|pubmed:9631953|pubmed:9686999|wikipedia.en:Amperozide Graph 4-(4,4-bis(p-fluorophenyl)butyl)-N-ethyl-1-piperazinecarboxamide|4-[4,4-bis(4-fluorophenyl)butyl]-N-ethylpiperazine-1-carboxamide|amperozida|amperozide|amperozidum 4-[4,4-bis(4-fluorophenyl)butyl]-N-ethylpiperazine-1-carboxamide 4-(4,4-bis(p-fluorophenyl)butyl)-N-ethyl-1-piperazinecarboxamide|4-[4,4-bis(4-fluorophenyl)butyl]-N-ethylpiperazine-1-carboxamide|amperozida|amperozide|amperozidum http://purl.obolibrary.org/obo/CHEBI_180480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180481 biolink:ChemicalEntity ribavirin 5'-diphosphate A 1-ribosyltriazole that is ribavirin in which the hydroxy group at the 5'-position is replaced by a diphosphate group. It is the metabolite of the antiviral agent ribavirin. cas:63142-70-1|chemspider:111258|pubmed:10349689|pubmed:10961691|pubmed:15633995|pubmed:17029670|pubmed:22943620|pubmed:2552007|pubmed:2556073|pubmed:25645847|pubmed:280136|pubmed:28053102|pubmed:2837139 Graph 1-{5-O-[hydroxy(phosphonooxy)phosphoryl]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide|RDP|ribavirin diphosphate|ribavirin-DP 1-{5-O-[hydroxy(phosphonooxy)phosphoryl]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide 1-{5-O-[hydroxy(phosphonooxy)phosphoryl]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide|RDP|ribavirin diphosphate|ribavirin-DP http://purl.obolibrary.org/obo/CHEBI_180481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180482 biolink:ChemicalEntity 1,2,4-triazole-3-carboxamide A member of the class of triazoles that is 1H-1,2,4-triazole substituted by an aminocarbonyl group at position 3. It is the major catabolite and aglycon of ribavirin. cas:3641-08-5|chemspider:58634|hmdb:HMDB0244869|pubmed:1368697|pubmed:1368721|pubmed:17845853|pubmed:21202621|pubmed:212973|pubmed:2737800|pubmed:6660848|reaxys:775120 Graph 1H-1,2,4-triazole-3-carboxamide|3-(aminocarbonyl)-1H-1,2,4-triazole|3-carbamoyl-1H-1,2,4-triazole 1H-1,2,4-triazole-3-carboxamide 1H-1,2,4-triazole-3-carboxamide|3-(aminocarbonyl)-1H-1,2,4-triazole|3-carbamoyl-1H-1,2,4-triazole http://purl.obolibrary.org/obo/CHEBI_180482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180483 biolink:ChemicalEntity ribavirin carboxylic acid A 1-ribosyltriazole that is ribavirin in which the carbamoyl group at position 3 is replaced by a carboxy group. It is a catabolite and impurity of ribavirin. cas:39925-19-4|chemspider:20038397|pubmed:17379518|pubmed:222909|pubmed:280136 Graph 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-3-carboxylic acid|1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylic acid|ribavirin related compound A|ribavirin specified impurity A 1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylic acid 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-3-carboxylic acid|1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylic acid|ribavirin related compound A|ribavirin specified impurity A http://purl.obolibrary.org/obo/CHEBI_180483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180484 biolink:ChemicalEntity amperozide(1+) A tertiary ammonium ion that is conjugate acid of amperozide resulting from the protonation of the piperazine moiety; major species at pH 7.3. Graph 1-[4,4-bis(4-fluorophenyl)butyl]-4-(ethylcarbamoyl)piperazin-1-ium|amperozide cation 1-[4,4-bis(4-fluorophenyl)butyl]-4-(ethylcarbamoyl)piperazin-1-ium 1-[4,4-bis(4-fluorophenyl)butyl]-4-(ethylcarbamoyl)piperazin-1-ium|amperozide cation http://purl.obolibrary.org/obo/CHEBI_180484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18049 biolink:ChemicalEntity piperidine An azacycloalkane that is cyclohexane in which one of the carbons is replaced by a nitrogen. It is a metabolite of cadaverine, a polyamine found in the human intestine. cas:110-89-4|chemspider:7791|foodb.food:FDB012644|hmdb:HMDB0034301|kegg.compound:C01746|knapsack:C00051876|metacyc.compound:PIPERIDINE|pdb-ccd:PIP|pubmed:12355363|pubmed:15017096|pubmed:15412|pubmed:25897321|pubmed:32120931|pubmed:33021609|pubmed:5300194|pubmed:5308835|pubmed:799462|reaxys:102438|wikipedia.en:Piperidine Graph Azacyclohexane|Hexahydropyridine|Piperidin|Piperidine|azinane|cyclopentimine|cypentil|hexazane|pentamethyleneamine|pentamethyleneimine|pentamethylenimine|perhydropyridine|pip|piperidine Piperidine|piperidine Azacyclohexane|Hexahydropyridine|Piperidin|Piperidine|azinane|cyclopentimine|cypentil|hexazane|pentamethyleneamine|pentamethyleneimine|pentamethylenimine|perhydropyridine|pip|piperidine http://purl.obolibrary.org/obo/CHEBI_18049 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18050 biolink:ChemicalEntity L-glutamine An optically active form of glutamine having L-configuration. cas:56-85-9|drugbank:DB00130|drugcentral:1311|ecmdb:ECMDB00641|gmelin:3509|hmdb:HMDB0000641|kegg.compound:C00064|kegg.drug:D00015|knapsack:C00001359|lincs.smallmolecule:LSM-4741|metacyc.compound:GLN|pdb-ccd:GLN|pubmed:11139387|pubmed:15204730|pubmed:22055478|pubmed:22206385|pubmed:22451274|pubmed:22453904|pubmed:22575040|pubmed:22770225|pubmed:29438107|reaxys:1723797|wikipedia.en:Glutamine|ymdb:YMDB00002 Graph (2S)-2,5-diamino-5-oxopentanoic acid|(2S)-2-amino-4-carbamoylbutanoic acid|(S)-2,5-diamino-5-oxopentanoic acid|GLUTAMINE|Glutamic acid 5-amide|Glutamic acid amide|L-(+)-glutamine|L-2-Aminoglutaramic acid|L-2-aminoglutaramic acid|L-Glutamin|L-Glutamine|L-Glutaminsaeure-5-amid|L-glutamic acid gamma-amide|L-glutamine|Levoglutamide|Q GLUTAMINE|L-Glutamine|L-glutamine (2S)-2,5-diamino-5-oxopentanoic acid|(2S)-2-amino-4-carbamoylbutanoic acid|(S)-2,5-diamino-5-oxopentanoic acid|GLUTAMINE|Glutamic acid 5-amide|Glutamic acid amide|L-(+)-glutamine|L-2-Aminoglutaramic acid|L-2-aminoglutaramic acid|L-Glutamin|L-Glutamine|L-Glutaminsaeure-5-amid|L-glutamic acid gamma-amide|L-glutamine|Levoglutamide|Q http://purl.obolibrary.org/obo/CHEBI_18050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180503 biolink:ChemicalEntity chlorprothixene(1+) A tertiary ammonium ion that is the conjugate acid of chlorprothixene resulting from the protonation of the tertiary amino group; major species at pH 7.3. Graph 3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-aminium|chlorprothixene cation 3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-aminium 3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-aminium|chlorprothixene cation http://purl.obolibrary.org/obo/CHEBI_180503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18051 biolink:ChemicalEntity L-aspartic acid 4-semialdehyde cas:2338-03-6|chemspider:388372|foodb.food:FDB028891|hmdb:HMDB0012249|kegg.compound:C00441|knapsack:C00007469|pubmed:10759521|pubmed:14353904|pubmed:1955861|pubmed:3697846|pubmed:4390206|pubmed:4390536|pubmed:4609075|pubmed:7041905|pubmed:9260954|pubmed:974097|pubmed:9864317 Graph (2S)-2-amino-4-oxobutanoic acid|(S)-2-amino-4-oxobutanoic acid|3-formylalanine|L-aspartic 4-semialdehyde|L-aspartic acid beta-semialdehyde|L-aspartic beta-semialdehyde|aspartic beta-semialdehyde (2S)-2-amino-4-oxobutanoic acid (2S)-2-amino-4-oxobutanoic acid|(S)-2-amino-4-oxobutanoic acid|3-formylalanine|L-aspartic 4-semialdehyde|L-aspartic acid beta-semialdehyde|L-aspartic beta-semialdehyde|aspartic beta-semialdehyde http://purl.obolibrary.org/obo/CHEBI_18051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18052 biolink:ChemicalEntity loganate kegg.compound:C01512 Graph (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate|loganate (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate (1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate|loganate http://purl.obolibrary.org/obo/CHEBI_18052 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18053 biolink:ChemicalEntity 1-aminocyclopropanecarboxylic acid A non-proteinogenic α-amino acid consisting of cyclopropane having amino and carboxy substituents both at the 1-position. cas:22059-21-8|drugbank:DB02085|gmelin:362607|hmdb:HMDB0036458|kegg.compound:C01234|knapsack:C00007566|metacyc.compound:CPD-68|pdb-ccd:1AC|pesticides:acc|pubmed:24120532|pubmed:24495994|reaxys:2076413|wikipedia.en:1-Aminocyclopropane-1-carboxylic_acid Graph 1-AMINOCYCLOPROPANECARBOXYLIC ACID|1-Aminocyclopropane-1-carboxylic acid|1-aminocyclopropane-1-carboxylic acid|ACC 1-Aminocyclopropane-1-carboxylic acid|1-aminocyclopropane-1-carboxylic acid 1-AMINOCYCLOPROPANECARBOXYLIC ACID|1-Aminocyclopropane-1-carboxylic acid|1-aminocyclopropane-1-carboxylic acid|ACC http://purl.obolibrary.org/obo/CHEBI_18053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180536 biolink:ChemicalEntity 7-Hydroxymitragynine cas:174418-82-7|chemspider:23152144 Graph methyl (E)-2-[(2S,3S,7aS,12bS)-3-ethyl-7a-hydroxy-8-methoxy-2,3,4,6,7,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate methyl (E)-2-[(2S,3S,7aS,12bS)-3-ethyl-7a-hydroxy-8-methoxy-2,3,4,6,7,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate methyl (E)-2-[(2S,3S,7aS,12bS)-3-ethyl-7a-hydroxy-8-methoxy-2,3,4,6,7,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate http://purl.obolibrary.org/obo/CHEBI_180536 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18054 biolink:ChemicalEntity diphthine A quaternary ammonium ion consisting of L-histidine with a 3-(trimethylammonio)-3-carboxypropyl group at the 2-position of the the imidazole ring. cas:75645-23-7|kegg.compound:C01573 Graph (1S)-3-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-1-carboxy-N,N,N-trimethylpropan-1-aminium|2-[(3S)-3-carboxy-3-(trimethylammonio)propyl]-L-histidine|Diphthine|EF-2 diphthine|Elongation factor 2 diphthine (1S)-3-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-1-carboxy-N,N,N-trimethylpropan-1-aminium (1S)-3-{4-[(2S)-2-amino-2-carboxyethyl]-1H-imidazol-2-yl}-1-carboxy-N,N,N-trimethylpropan-1-aminium|2-[(3S)-3-carboxy-3-(trimethylammonio)propyl]-L-histidine|Diphthine|EF-2 diphthine|Elongation factor 2 diphthine http://purl.obolibrary.org/obo/CHEBI_18054 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180543 biolink:ChemicalEntity (S)-2-hydroxymethylglutarate The dicarboxylate anion of (S)-2-hydroxymethylglutaric acid; mahor microspecies at pH 7.3. metacyc.compound:CPD-9438|pubmed:16894175 Graph (2S)-2-(hydroxymethyl)pentanedioate|(S)-2-hydroxymethylglutarate (2S)-2-(hydroxymethyl)pentanedioate|(S)-2-hydroxymethylglutarate http://purl.obolibrary.org/obo/CHEBI_180543 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180544 biolink:ChemicalEntity 7-hydroxy-8-methoxycoumarin metacyc.compound:CPD-14430|pubmed:12480941 Graph 7-hydroxy-8-methoxychromen-2-one|7-hydroxy-8-methoxycoumarin|hydrangetin 7-hydroxy-8-methoxychromen-2-one|7-hydroxy-8-methoxycoumarin|hydrangetin http://purl.obolibrary.org/obo/CHEBI_180544 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18056 biolink:ChemicalEntity N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide A glycopentaosylceramide having α-D-GalNAc-(1→3)-β-D-GalNAc-(1→3)-α-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-Glc as the pentasaccharide portion; reported to be the Forssman hapten of horse spleen. kegg.compound:C04925|kegg.glycan:G00095|pubmed:10988247|pubmed:1193672|pubmed:13239189|pubmed:13239190|pubmed:1373469|pubmed:14210803|pubmed:1528196|pubmed:19351707|pubmed:4199759|pubmed:4358346|pubmed:4459265|pubmed:4474139|pubmed:4538505|pubmed:4605408|pubmed:469271|pubmed:5461254|pubmed:8623166 Graph (Gal)2 (GalNAc)2 (Glc)1 (Cer)1|Forssman hapten|GalNAc-alpha1->3GalNAc-beta1->3Gal-alpha1->4Gal-beta1->4Glc-beta1->1'Cer|GalNAc-alpha1->3GalNAc-beta1->3Gal-alpha1->4LacCer|IV(3)GalNAcalpha-Gb4Cer|N-Acetyl-D-galactosaminyl-N-Acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|a globoside Forssman (d18:1(4E))|alpha-D-GalNAc-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc(1<->1)Cer N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide (Gal)2 (GalNAc)2 (Glc)1 (Cer)1|Forssman hapten|GalNAc-alpha1->3GalNAc-beta1->3Gal-alpha1->4Gal-beta1->4Glc-beta1->1'Cer|GalNAc-alpha1->3GalNAc-beta1->3Gal-alpha1->4LacCer|IV(3)GalNAcalpha-Gb4Cer|N-Acetyl-D-galactosaminyl-N-Acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|a globoside Forssman (d18:1(4E))|alpha-D-GalNAc-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc(1<->1)Cer http://purl.obolibrary.org/obo/CHEBI_18056 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18057 biolink:ChemicalEntity vellosimine An indole alkaloid that is sarpagan in which the methyl group attached to position 16 has been oxidised to the corresponding aldehyde. cas:6874-98-2|kegg.compound:C11634|metacyc.compound:VELLOSIMINE|pdb-ccd:EVS|pubmed:10891229|pubmed:14510528|pubmed:20392128|reaxys:6894764 Graph (+)-vellosimine|Vellosimine|sarpagan-17-al|vellosimine sarpagan-17-al (+)-vellosimine|Vellosimine|sarpagan-17-al|vellosimine http://purl.obolibrary.org/obo/CHEBI_18057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18058 biolink:ChemicalEntity oxamic acid A dicarboxylic acid monoamide resulting from the formal condensation of one of the carboxy groups of oxalic acid with ammonia. cas:471-47-6|drugbank:DB03940|kegg.compound:C01444|lincs.smallmolecule:LSM-6631|pdb-ccd:OXM|pubmed:23560609|pubmed:24465604|reaxys:1743294 Graph Glycine, 2-oxo-|Oxalic monoamide|Oxamate|Oxamic acid|amino(oxo)acetic acid|oxamic acid Oxamate|Oxamic acid|oxamic acid Glycine, 2-oxo-|Oxalic monoamide|Oxamate|Oxamic acid|amino(oxo)acetic acid|oxamic acid http://purl.obolibrary.org/obo/CHEBI_18058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18059 biolink:ChemicalEntity lipid 'Lipids' is a loosely defined term for substances of biological origin that are soluble in nonpolar solvents. They consist of saponifiable lipids, such as glycerides (fats and oils) and phospholipids, as well as nonsaponifiable lipids, principally steroids. kegg.compound:C01356 Graph Lipid|lipids lipids Lipid|lipids http://purl.obolibrary.org/obo/CHEBI_18059 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18060 biolink:ChemicalEntity 1-haloalkane Any haloalkane where the halogen is located at position 1. kegg.compound:C01872 Graph 1-haloalkane|1-haloalkanes 1-haloalkane|1-haloalkanes http://purl.obolibrary.org/obo/CHEBI_18060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18062 biolink:ChemicalEntity 4-guanidinobutanamide A butanamide having a guanidino group at the 4-position. cas:4210-97-3|kegg.compound:C03078 Graph 4-(carbamimidamido)butanamide|4-Guanidinobutanamide|4-Guanidinobutyramide|4-guanidobutanamide|Tiformin 4-(carbamimidamido)butanamide 4-(carbamimidamido)butanamide|4-Guanidinobutanamide|4-Guanidinobutyramide|4-guanidobutanamide|Tiformin http://purl.obolibrary.org/obo/CHEBI_18062 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18063 biolink:ChemicalEntity 2-O-acyl-3-O-beta-D-galactosyl-sn-glycerol A 2-monoglyceride having a β-Dgalactosyl residue at the 3-position. kegg.compound:C04315 Graph (2R)-2-acyloxy-3-hydroxypropyl beta-D-galactopyranoside|Gal-beta1->3acyl1Gro|Galbeta1->3acyl1Gro|Mono-beta-D-galactosylacylglycerol|Monogalactosyl-monoacylglycerol|a 2-acyl-3-O-(beta-D-galactosyl)-sn-glycerol|sn-3-D-Galactosyl-sn-2-acylglycerol (2R)-2-acyloxy-3-hydroxypropyl beta-D-galactopyranoside (2R)-2-acyloxy-3-hydroxypropyl beta-D-galactopyranoside|Gal-beta1->3acyl1Gro|Galbeta1->3acyl1Gro|Mono-beta-D-galactosylacylglycerol|Monogalactosyl-monoacylglycerol|a 2-acyl-3-O-(beta-D-galactosyl)-sn-glycerol|sn-3-D-Galactosyl-sn-2-acylglycerol http://purl.obolibrary.org/obo/CHEBI_18063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180636 biolink:ChemicalEntity PS(O-20:0/22:4(7Z,10Z,13Z,16Z)) lipidmaps:LMGP03020068 Graph (2S)-2-amino-3-[[(2R)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid (2S)-2-amino-3-[[(2R)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid (2S)-2-amino-3-[[(2R)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid http://purl.obolibrary.org/obo/CHEBI_180636 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18064 biolink:ChemicalEntity 3-hydroxyisobutyric acid A 4-carbon, branched hydroxy fatty acid and intermediate in the metabolism of valine. beilstein:1745484|cas:2068-83-9|kegg.compound:C01188 Graph 2-methyl-3-hydroxypropanoic acid|3-Hydroxyisobutyric acid|3-hydroxy-2-methylpropanoic acid|HIBA 3-hydroxy-2-methylpropanoic acid 2-methyl-3-hydroxypropanoic acid|3-Hydroxyisobutyric acid|3-hydroxy-2-methylpropanoic acid|HIBA http://purl.obolibrary.org/obo/CHEBI_18064 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18065 biolink:ChemicalEntity deacetylcephalosporin C A 3-hydroxymethylcephalosporin having a (5-amino-5-carboxypentanoyl)amino group at the 7-position. cas:1476-46-6|kegg.compound:C03112 Graph (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|Deacetylcephalosporin C (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|Deacetylcephalosporin C http://purl.obolibrary.org/obo/CHEBI_18065 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180653 biolink:ChemicalEntity molnupiravir A nucleoside analogue that is N4-hydroxycytidine in which the 5'-hydroxy group is replaced by a (2-methylpropanoyl)oxy group. It is the prodrug of the active antiviral ribonucleoside analog N4-hydroxycytidine (EIDD-1931), has activity against a number of RNA viruses including SARS-CoV-2, MERS-CoV, and seasonal and pandemic influenza viruses. It is currently in phase III trials for the treatment of patients with COVID-19. cas:2349386-89-4|cas:2492423-29-5|chemspider:84400552|kegg.drug:D11943|pmc:PMC8461366|pubmed:31645453|pubmed:31910262|pubmed:31945316|pubmed:32253226|pubmed:32503814|pubmed:32714193|pubmed:33030468|pubmed:33273742|pubmed:33290476|pubmed:33561864|pubmed:33588727|pubmed:33649113|pubmed:33664631|pubmed:33863887|pubmed:33902254|pubmed:33961695|pubmed:33989635|pubmed:34056192|pubmed:34118236|pubmed:34244768|pubmed:34271264|pubmed:34337170|pubmed:34381216|pubmed:34425873|pubmed:34509661|pubmed:34518697|pubmed:34571361|wikipedia.en:Molnupiravir Graph EIDD 1931 5'-isopropylester|EIDD 2801|EIDD-2801|MK-4482|N(4)-hydroxycytidine 5'-isopropylester|N-hydroxy-5'-O-(2-methylpropanoyl)-3,4-dihydrocytidine|beta-D-N(4)-hydroxycytidine-5'-isopropyl ester|molnupiravir|molnupiravirum|{(2R,3S,4R,5R)-3,4-dihydroxy-5-[4-(hydroxyimino)-2-oxo-3,4-dihydropyrimidin-1(2H)-yl]tetrahydrofuran-2-yl}methyl 2-methylpropanoate N-hydroxy-5'-O-(2-methylpropanoyl)-3,4-dihydrocytidine EIDD 1931 5'-isopropylester|EIDD 2801|EIDD-2801|MK-4482|N(4)-hydroxycytidine 5'-isopropylester|N-hydroxy-5'-O-(2-methylpropanoyl)-3,4-dihydrocytidine|beta-D-N(4)-hydroxycytidine-5'-isopropyl ester|molnupiravir|molnupiravirum|{(2R,3S,4R,5R)-3,4-dihydroxy-5-[4-(hydroxyimino)-2-oxo-3,4-dihydropyrimidin-1(2H)-yl]tetrahydrofuran-2-yl}methyl 2-methylpropanoate http://purl.obolibrary.org/obo/CHEBI_180653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180654 biolink:ChemicalEntity N(4)-hydroxycytidine A nucleoside analogue that is cytidine which carries a hydroxy group at the N4-positon. It has broad-spectrum antiviral activity against influenza, SARS-CoV , SARS-CoV-2 and MERS-CoV. cas:3258-02-4|chemspider:170635|drugbank:DB15660|pubmed:31494195|pubmed:31578288|pubmed:31645453|pubmed:32253226|pubmed:33290476|pubmed:33327924|pubmed:33649113|pubmed:33807492|pubmed:33989635|pubmed:34186107|pubmed:34357881|pubmed:34381216|pubmed:34503974|pubmed:34509661 Graph 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(hydroxyimino)-3,4-dihydropyrimidin-2(1H)-one|4-N-hydroxycytidine|4-oxime uridine|EIDD 1931|EIDD-1931|N(4)-hydroxycytidine|N-hydroxy-3,4-dihydrocytidine|N-hydroxycytidine|NHC|beta-D-N(4)-hydroxycytidine N-hydroxy-3,4-dihydrocytidine 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(hydroxyimino)-3,4-dihydropyrimidin-2(1H)-one|4-N-hydroxycytidine|4-oxime uridine|EIDD 1931|EIDD-1931|N(4)-hydroxycytidine|N-hydroxy-3,4-dihydrocytidine|N-hydroxycytidine|NHC|beta-D-N(4)-hydroxycytidine http://purl.obolibrary.org/obo/CHEBI_180654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18066 biolink:ChemicalEntity UDP-D-glucose A UDP-sugar having D-glucose as the sugar component. cas:133-89-1|kegg.compound:C00029 Graph UDP-D-glucose|UDP-Glc|UDP-glucose|UDPglucose|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-glucopyranosyl ester|Uridine 5'-(trihydrogen diphosphate), mono-alpha-d-glucopyranosyl ester|Uridine diphosphate glucose|uridine 5'-[3-D-glucopyranosyl dihydrogen diphosphate]|uridinediphosphoglucose uridine 5'-[3-D-glucopyranosyl dihydrogen diphosphate] UDP-D-glucose|UDP-Glc|UDP-glucose|UDPglucose|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-glucopyranosyl ester|Uridine 5'-(trihydrogen diphosphate), mono-alpha-d-glucopyranosyl ester|Uridine diphosphate glucose|uridine 5'-[3-D-glucopyranosyl dihydrogen diphosphate]|uridinediphosphoglucose http://purl.obolibrary.org/obo/CHEBI_18066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18067 biolink:ChemicalEntity phylloquinone A member of the class of phylloquinones that consists of 1,4-naphthoquinone having methyl and phytyl groups at positions 2 and 3 respectively. The parent of the class of phylloquinones. cas:84-80-0|chemspider:4447652|drugbank:DB01022|drugcentral:2843|hmdb:HMDB0003555|kegg.compound:C02059|kegg.drug:D00148|knapsack:C00002868|lipidmaps:LMPR02030028|metacyc.compound:2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE|pdb-ccd:PQN|pmc:PMC6577341|pmc:PMC8180628|pubmed:1009028|pubmed:10701947|pubmed:10893417|pubmed:11003724|pubmed:15686525|pubmed:15773196|pubmed:19588895|pubmed:19996170|pubmed:21169510|pubmed:21645693|pubmed:21844348|pubmed:21914559|pubmed:27337968|pubmed:2851012|pubmed:30609653|pubmed:32090699|pubmed:32109957|pubmed:32221088|pubmed:32222983|pubmed:32445363|pubmed:33793953|pubmed:33968245|pubmed:34134516|pubmed:5511811|pubmed:7657478|reaxys:2568816|wikipedia.en:Phytomenadione Graph 2-Methyl-3-(3,7,11,15-tetramethyl-2-hexadecenyl)-1,4-naphthalenedione|2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecenyl]naphthoquinone|2-Methyl-3-phytyl-1,4-naphthochinon|2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-dione|2-methyl-3-phytyl-1,4-naphthoquinone|3-phytylmenadione|Mephyton|PHYLLOQUINONE|Phyllochinon|Phyllochinonum|Phylloquinone|Phytonadionum|Phytylmenadione|Vitamin K1|alpha-phylloquinone|fitomenadiona|fitomenadione|phylloquinone|phytomenadione|phytomenadionum|phytonadione|trans-Phylloquinone|vitamin K1|vitamin K1(20) 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-dione 2-Methyl-3-(3,7,11,15-tetramethyl-2-hexadecenyl)-1,4-naphthalenedione|2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecenyl]naphthoquinone|2-Methyl-3-phytyl-1,4-naphthochinon|2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-dione|2-methyl-3-phytyl-1,4-naphthoquinone|3-phytylmenadione|Mephyton|PHYLLOQUINONE|Phyllochinon|Phyllochinonum|Phylloquinone|Phytonadionum|Phytylmenadione|Vitamin K1|alpha-phylloquinone|fitomenadiona|fitomenadione|phylloquinone|phytomenadione|phytomenadionum|phytonadione|trans-Phylloquinone|vitamin K1|vitamin K1(20) http://purl.obolibrary.org/obo/CHEBI_18067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180684 biolink:ChemicalEntity 6-thioinosine-5'-monophosphate(2-) The ionised form of 6-Thioinosine-5'-monophosphate (Chebi:2332) Graph http://purl.obolibrary.org/obo/CHEBI_180684 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180685 biolink:ChemicalEntity 6-Thioxanthine 5'-monophosphate(2-) A drug intermediate in the formation of pharmacologically active metabolites of azathioprine. Based on Chebi:80612 Graph http://purl.obolibrary.org/obo/CHEBI_180685 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180686 biolink:ChemicalEntity 6-Thioguanosine monophosphate(2-) A drug intermediate in the formation of pharmacologically active metabolites of azathioprine. Based on Chebi:80613 Graph http://purl.obolibrary.org/obo/CHEBI_180686 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180687 biolink:ChemicalEntity 6-Thioguanosine diphosphate(3-) Graph http://purl.obolibrary.org/obo/CHEBI_180687 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180688 biolink:ChemicalEntity 6 thioguanosine triphosphate(4-) Graph 6TGTP 6TGTP http://purl.obolibrary.org/obo/CHEBI_180688 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180689 biolink:ChemicalEntity 6 thiodeoxyguanosine monophosphate (2-) Graph 6TdGMP 6TdGMP http://purl.obolibrary.org/obo/CHEBI_180689 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180690 biolink:ChemicalEntity 6 thiodeoxyguanosine diphosphate (3-) Graph 6TdGDP 6TdGDP http://purl.obolibrary.org/obo/CHEBI_180690 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180691 biolink:ChemicalEntity 6-thiodeoxyguanosine triphosphate (4-) Graph 6TdGTP 6TdGTP http://purl.obolibrary.org/obo/CHEBI_180691 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180692 biolink:ChemicalEntity EUK-134 cas:81065-76-1|chemspider:7998981|patent:CN101671268|pubmed:10968795|pubmed:33471830 Graph EUK 134|EUK134|ethylbisiminomethylguaiacol manganese chloride|manganese(3+) chloride 2,2'-{ethane-1,2-diylbis[azanylylidene(E)methanylylidene]}bis(6-methoxyphenolate) (1:1:1) manganese(3+) chloride 2,2'-{ethane-1,2-diylbis[azanylylidene(E)methanylylidene]}bis(6-methoxyphenolate) (1:1:1) EUK 134|EUK134|ethylbisiminomethylguaiacol manganese chloride|manganese(3+) chloride 2,2'-{ethane-1,2-diylbis[azanylylidene(E)methanylylidene]}bis(6-methoxyphenolate) (1:1:1) http://purl.obolibrary.org/obo/CHEBI_180692 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:180694 biolink:ChemicalEntity fasudil(1+) A secondary ammonium ion that is the conjugate acid of fasudil arising from the protonation of the diazepane ring; major species at pH 7.3. Graph 4-(isoquinolin-5-ylsulfonyl)-1,4-diazepan-1-ium|fasudil cation 4-(isoquinolin-5-ylsulfonyl)-1,4-diazepan-1-ium 4-(isoquinolin-5-ylsulfonyl)-1,4-diazepan-1-ium|fasudil cation http://purl.obolibrary.org/obo/CHEBI_180694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180696 biolink:ChemicalEntity 20beta-dihydroprednisolone A glucocorticoid that is prednisolone in which the oxo group at position 20 has been reduced to the corresponding β-hydroxy group. It is a metabolite of prednisolone. cas:2299-46-9|chemspider:27524368|pubmed:23510304|pubmed:25267433|pubmed:25800201|pubmed:28806969|pubmed:34081842|pubmed:898234|pubmed:9408088 Graph (11beta,20S)-11,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20S)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20S)-hydroxyprednisolone|20(S)-hydroxy prednisolone|20beta-dihydro-PRED|20beta-hydroxyprednisolone|prednisolone EP impurity G|prednisolone impurity G (20S)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one (11beta,20S)-11,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20S)-11beta,17,20,21-tetrahydroxypregna-1,4-dien-3-one|(20S)-hydroxyprednisolone|20(S)-hydroxy prednisolone|20beta-dihydro-PRED|20beta-hydroxyprednisolone|prednisolone EP impurity G|prednisolone impurity G http://purl.obolibrary.org/obo/CHEBI_180696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180697 biolink:ChemicalEntity 6beta-hydroxyprednisolone A glucocorticoid that is prednisolone carrying a hydroxy group at the 6β position. It is a metabolite of prednisolone found in human urine. cas:16355-29-6|pubmed:10975239|pubmed:25800201|pubmed:9551805 Graph (1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-1,2,3,3a,3b,4,5,9a,9b,10,11,11a-dodecahydro-7H-cyclopenta[a]phenanthren-7-one|6beta,11beta,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 6beta,11beta,17,21-tetrahydroxypregna-1,4-diene-3,20-dione (1R,3aS,3bS,5R,9aR,9bS,10S,11aS)-1,5,10-trihydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-1,2,3,3a,3b,4,5,9a,9b,10,11,11a-dodecahydro-7H-cyclopenta[a]phenanthren-7-one|6beta,11beta,17,21-tetrahydroxypregna-1,4-diene-3,20-dione http://purl.obolibrary.org/obo/CHEBI_180697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18070 biolink:ChemicalEntity cytochrome c cas:9007-43-6|kegg.compound:C00524|kegg.compound:C02416|kegg.drug:D00072 Graph Cytochrome C|Holocytochrome c|c-type cytochrome Cytochrome C|Holocytochrome c|c-type cytochrome http://purl.obolibrary.org/obo/CHEBI_18070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18071 biolink:ChemicalEntity (methylthio)acetate A monocarboxylic acid anion that is the conjugate base of (methylthio)acetic acid. beilstein:3661093|drugbank:DB03517|gmelin:323968|pdb-ccd:MTG|reaxys:3661093 Graph (methylsulfanyl)acetate|(methylthio)acetate anion|(methylthio)acetate(1-)|S-methylthioglycolate|S-methylthioglycollic acid anion|[METHYLTHIO]ACETATE (methylsulfanyl)acetate (methylsulfanyl)acetate|(methylthio)acetate anion|(methylthio)acetate(1-)|S-methylthioglycolate|S-methylthioglycollic acid anion|[METHYLTHIO]ACETATE http://purl.obolibrary.org/obo/CHEBI_18071 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18072 biolink:ChemicalEntity 5-hydroxyisouric acid An oxopurine that is 5,7-dihydro-1H-purine-2,6,8(9H)-trione in which the hydrogen at position 5 is substituted by a hydroxy group. beilstein:5949568|kegg.compound:C11821|knapsack:C00007531 Graph 5-Hydroxyisourate|5-hydroxy-5,7-dihydro-1H-purine-2,6,8(9H)-trione|5-hydroxyisourate 5-hydroxy-5,7-dihydro-1H-purine-2,6,8(9H)-trione 5-Hydroxyisourate|5-hydroxy-5,7-dihydro-1H-purine-2,6,8(9H)-trione|5-hydroxyisourate http://purl.obolibrary.org/obo/CHEBI_18072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18073 biolink:ChemicalEntity xanthoaphin The product from the treatment of protoaphin aglucone with protoaphin dehydratase (EC 4.2.1.73). beilstein:102020|cas:1674-44-8|kegg.compound:C01863 Graph (1R,3R,3aS,4aS,8R,10R,10aS,11aS)-4a,7,11a,14-tetrahydroxy-1,3,8,10-tetramethyl-1,3,3a,4a,5,8,10,10a,11a,12-decahydro-6H,13H-2,4,9,11-tetraoxadibenzo[bc,kl]coronene-6,13-dione|Xanthoaphin|xanthoaphin-fb (1R,3R,3aS,4aS,8R,10R,10aS,11aS)-4a,7,11a,14-tetrahydroxy-1,3,8,10-tetramethyl-1,3,3a,4a,5,8,10,10a,11a,12-decahydro-6H,13H-2,4,9,11-tetraoxadibenzo[bc,kl]coronene-6,13-dione (1R,3R,3aS,4aS,8R,10R,10aS,11aS)-4a,7,11a,14-tetrahydroxy-1,3,8,10-tetramethyl-1,3,3a,4a,5,8,10,10a,11a,12-decahydro-6H,13H-2,4,9,11-tetraoxadibenzo[bc,kl]coronene-6,13-dione|Xanthoaphin|xanthoaphin-fb http://purl.obolibrary.org/obo/CHEBI_18073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18075 biolink:ChemicalEntity dTDP A thymidine phosphate having a diphosphate group at the 5'-position. beilstein:64132|cas:491-97-4|drugbank:DB03103|hmdb:HMDB0001274|kegg.compound:C00363|knapsack:C00019696|metacyc.compound:TDP|pdb-ccd:TYD|pubmed:20065942|pubmed:23394555|wikipedia.en:Thymidine_diphosphate Graph 2'-deoxyribosylthymine 5'-(trihydrogen diphosphate)|Deoxythymidine 5'-diphosphate|THYMIDINE-5'- DIPHOSPHATE|dTDP|deoxy-TDP|thymidine 5'-(trihydrogen diphosphate)|thymidine 5'-diphosphate|thymidine 5'-pyrophosphate thymidine 5'-(trihydrogen diphosphate) 2'-deoxyribosylthymine 5'-(trihydrogen diphosphate)|Deoxythymidine 5'-diphosphate|THYMIDINE-5'- DIPHOSPHATE|dTDP|deoxy-TDP|thymidine 5'-(trihydrogen diphosphate)|thymidine 5'-diphosphate|thymidine 5'-pyrophosphate http://purl.obolibrary.org/obo/CHEBI_18075 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18077 biolink:ChemicalEntity dTTP A thymidine phosphate having a triphosphate group at the 5'-position. agr:IND43614414|beilstein:71453|cas:365-08-2|chemspider:58493|drugbank:DB02452|foodb.food:FDB030841|hmdb:HMDB0001342|kegg.compound:C00459|knapsack:C00019695|pdb-ccd:TTP|pubmed:11952643|pubmed:163227|pubmed:17062140|pubmed:18164314|pubmed:2232707|pubmed:26252214|pubmed:2628074|pubmed:26408413|pubmed:29083013|pubmed:30305373|pubmed:31377845|pubmed:33716755|pubmed:34102282|pubmed:34110794|pubmed:4556566|pubmed:7361458|pubmed:8294419|pubmed:89451|wikipedia.en:Thymidine_triphosphate Graph 2'-deoxythymidine 5'-triphosphate|2'-deoxythymidine triphosphate|5'-TTP|THYMIDINE-5'-TRIPHOSPHATE|TTP|dTTP|dThd5'PPP|deoxy-TTP|deoxythymidine 5'-triphosphate|deoxythymidine triphosphate|pppdT|thymidine 5'-(tetrahydrogen triphosphate)|thymidine 5'-triphosphate thymidine 5'-(tetrahydrogen triphosphate) 2'-deoxythymidine 5'-triphosphate|2'-deoxythymidine triphosphate|5'-TTP|THYMIDINE-5'-TRIPHOSPHATE|TTP|dTTP|dThd5'PPP|deoxy-TTP|deoxythymidine 5'-triphosphate|deoxythymidine triphosphate|pppdT|thymidine 5'-(tetrahydrogen triphosphate)|thymidine 5'-triphosphate http://purl.obolibrary.org/obo/CHEBI_18077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18078 biolink:ChemicalEntity 2-dehydro-3-deoxy-L-rhamnonic acid A ketoaldonic acid that is rhamnonic acid which is lacking the 3-hydroxy group, has a keto group at the 2-position and L-configuration. kegg.compound:C03979 Graph 2-Dehydro-3-deoxy-L-rhamnonate|2-dehydro-3,6-dideoxy-L-mannonate|3,6-dideoxy-L-arabino-hex-2-ulosonic acid 3,6-dideoxy-L-arabino-hex-2-ulosonic acid 2-Dehydro-3-deoxy-L-rhamnonate|2-dehydro-3,6-dideoxy-L-mannonate|3,6-dideoxy-L-arabino-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_18078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18080 biolink:ChemicalEntity 5-oxo-2,5-dihydro-2-furylacetic acid A 5-oxo-2-furylacetic acid having the C=C double bond at the 3,4-position. beilstein:114448|beilstein:81229|cas:6666-46-2|kegg.compound:C04105 Graph (5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2,5-Dihydro-5-oxofuran-2-acetate|2-Oxo-2,5-dihydrofuran-5-acetate|4-Carboxymethyl-4-hydroxyisocrotonolactone|5-Oxo-2,5-dihydrofuran-2-acetate|Muconolactone (5-oxo-2,5-dihydrofuran-2-yl)acetic acid (5-oxo-2,5-dihydrofuran-2-yl)acetic acid|2,5-Dihydro-5-oxofuran-2-acetate|2-Oxo-2,5-dihydrofuran-5-acetate|4-Carboxymethyl-4-hydroxyisocrotonolactone|5-Oxo-2,5-dihydrofuran-2-acetate|Muconolactone http://purl.obolibrary.org/obo/CHEBI_18080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18082 biolink:ChemicalEntity 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose A galloyl-β-D-glucose compound having five galloyl groups in the 1-, 2-, 3-, 4- and 6-positions. beilstein:79674|cas:14937-32-7|chemspider:58735|kegg.compound:C04576|knapsack:C00002933|metacyc.compound:12346-PENTAKIS-O-GALLOYL-BETA-D-GLUC|pubmed:14609132|pubmed:15105050|pubmed:16253226|pubmed:17015965|pubmed:17141590|pubmed:18386256|pubmed:18622905|pubmed:19374853|pubmed:19457098|pubmed:19576177|pubmed:20369791|pubmed:20606300|pubmed:21085110|pubmed:21173176|pubmed:24404334|pubmed:29472861|pubmed:30760754|pubmed:32957961 Graph 1,2,3,4,6-Pentakis-O-galloyl-beta-D-glucose|1,2,3,4,6-Pgg|1,2,3,4,6-penta-O-galloyl-beta-D-glucopyranose|1,2,3,4,6-penta-O-galloyl-beta-D-glucopyranoside|1,2,3,4,6-penta-O-galloyl-beta-D-glucose|1,2,3,4,6-penta-O-galloyl-beta-D-glucoside|1,2,3,4,6-pentagalloyl-beta-D-glucopyranose|1,2,3,4,6-pentagalloyl-beta-D-glucopyranoside|1,2,3,4,6-pentagalloyl-beta-D-glucose|1,2,3,4,6-pentakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|Pentagalloyl-beta-D-glucose|Pentagalloylglucose|beta-1,2,3,4,6-pentagalloylglucose|beta-D-glucopyranose pentakis(3,4,5-trihydroxybenzoate)|penta-O-galloyl-beta-D-glucopyranose|penta-O-galloyl-beta-D-glucose 1,2,3,4,6-pentakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose 1,2,3,4,6-Pentakis-O-galloyl-beta-D-glucose|1,2,3,4,6-Pgg|1,2,3,4,6-penta-O-galloyl-beta-D-glucopyranose|1,2,3,4,6-penta-O-galloyl-beta-D-glucopyranoside|1,2,3,4,6-penta-O-galloyl-beta-D-glucose|1,2,3,4,6-penta-O-galloyl-beta-D-glucoside|1,2,3,4,6-pentagalloyl-beta-D-glucopyranose|1,2,3,4,6-pentagalloyl-beta-D-glucopyranoside|1,2,3,4,6-pentagalloyl-beta-D-glucose|1,2,3,4,6-pentakis-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose|Pentagalloyl-beta-D-glucose|Pentagalloylglucose|beta-1,2,3,4,6-pentagalloylglucose|beta-D-glucopyranose pentakis(3,4,5-trihydroxybenzoate)|penta-O-galloyl-beta-D-glucopyranose|penta-O-galloyl-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_18082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18083 biolink:ChemicalEntity 1-methyladenine Adenine substituted with a methyl group at position N-1. cas:5142-22-3|hmdb:HMDB0011599|kegg.compound:C02216|metacyc.compound:1-METHYLADENINE|pubmed:10208753|pubmed:17396151|pubmed:22770225|reaxys:137917 Graph 1-Methyladenine|1-methyl-1H-purin-6-amine|1-methyladenine|N1-methyladenine 1-methyl-1H-purin-6-amine 1-Methyladenine|1-methyl-1H-purin-6-amine|1-methyladenine|N1-methyladenine http://purl.obolibrary.org/obo/CHEBI_18083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18084 biolink:ChemicalEntity testololactone beilstein:34272|cas:4416-57-3|kegg.compound:C04676|lipidmaps:LMST02020061 Graph (4aS,4bR,10aR,10bS,12aS)-10a,12a-dimethyl-3,4,4a,5,6,9,10,10a,10b,11,12,12a-dodecahydro-2H-naphtho[2,1-f]chromene-2,8(4bH)-dione|17a-oxa-D-homoandrost-4-ene-3,17-dione|3-Oxo-13,17-secoandrost-4-ene-17,13alpha-lactone|3-oxo-13,17-secoandrost-4-eno-17,13-alpha-lactone|3-oxo-13,17-secoandrost-4-eno-17,13alpha-lactone|D-homo-17a-oxaandrost-4-ene-3,17-dione|Testololactone|hydrotestolactone|testololactone 3-oxo-13,17-secoandrost-4-eno-17,13alpha-lactone (4aS,4bR,10aR,10bS,12aS)-10a,12a-dimethyl-3,4,4a,5,6,9,10,10a,10b,11,12,12a-dodecahydro-2H-naphtho[2,1-f]chromene-2,8(4bH)-dione|17a-oxa-D-homoandrost-4-ene-3,17-dione|3-Oxo-13,17-secoandrost-4-ene-17,13alpha-lactone|3-oxo-13,17-secoandrost-4-eno-17,13-alpha-lactone|3-oxo-13,17-secoandrost-4-eno-17,13alpha-lactone|D-homo-17a-oxaandrost-4-ene-3,17-dione|Testololactone|hydrotestolactone|testololactone http://purl.obolibrary.org/obo/CHEBI_18084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18085 biolink:ChemicalEntity glycosaminoglycan Any polysaccharide containing a substantial proportion of aminomonosaccharide residues. kegg.compound:C02545|wikipedia.en:Glycosaminoglycan Graph Glycosaminoglycan|Glykosaminoglykan|glicosaminoglicano|glycosaminoglycan|glycosaminoglycane|glycosaminoglycans Glycosaminoglycan|glycosaminoglycan Glycosaminoglycan|Glykosaminoglykan|glicosaminoglicano|glycosaminoglycan|glycosaminoglycane|glycosaminoglycans http://purl.obolibrary.org/obo/CHEBI_18085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18086 biolink:ChemicalEntity indol-3-ylacetaldehyde An indoleacetaldehyde that is acetaldehyde in which one of the methyl hydrogens are replaced by a indol-3-yl group. It is an intermediate metabolite in the metabolism of tryptophan. cas:2591-98-2|hmdb:HMDB0001190|kegg.compound:C00637|knapsack:C00000109|metacyc.compound:INDOLE_ACETALDEHYDE|pubmed:20217460|pubmed:22274708|pubmed:4015706|pubmed:4031860|pubmed:6862384|reaxys:121586 Graph 1H-Indole-3-acetaldehyde|1H-indol-3-ylacetaldehyde|2-(Indol-3-yl)acetaldehyde|Indole-3-acetaldehyde|Indoleacetaldehyde|indole-3-acetaldehyde 1H-indol-3-ylacetaldehyde 1H-Indole-3-acetaldehyde|1H-indol-3-ylacetaldehyde|2-(Indol-3-yl)acetaldehyde|Indole-3-acetaldehyde|Indoleacetaldehyde|indole-3-acetaldehyde http://purl.obolibrary.org/obo/CHEBI_18086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18087 biolink:ChemicalEntity myo-inositol polyphosphate kegg.compound:C11525 Graph myo-Inositol polyphosphate|myo-inositol polyphosphates myo-Inositol polyphosphate|myo-inositol polyphosphates http://purl.obolibrary.org/obo/CHEBI_18087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180876 biolink:ChemicalEntity Norfluoxetine cas:83891-03-6|chemspider:4382|hmdb:HMDB0060551 Graph 3-phenyl-3-[4-(triluoromethyl)phenoxy]propan-1-amine 3-phenyl-3-[4-(triluoromethyl)phenoxy]propan-1-amine 3-phenyl-3-[4-(triluoromethyl)phenoxy]propan-1-amine http://purl.obolibrary.org/obo/CHEBI_180876 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18088 biolink:ChemicalEntity formononetin A member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone substituted by a methoxy group at position 4'. beilstein:1288158|cas:485-72-3|hmdb:HMDB0005808|kegg.compound:C00858|knapsack:C00002525|lincs.smallmolecule:LSM-19000|lipidmaps:LMPK12050037|metacyc.compound:FORMONONETIN|pubmed:16108819|pubmed:24023812|reaxys:237979|wikipedia.en:Formononetin Graph 4'-O-methyldaidzein|7-Hydroxy-3-(4-methoxyphenyl)-4-benzopyrone|7-Hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|7-Hydroxy-4'-methoxyisoflavone|7-hydroxy-3-(4-methoxyphenyl)-4H-benzopyran-4-one|7-hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|Formononetin|biochanin B|formononetol 7-hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one 4'-O-methyldaidzein|7-Hydroxy-3-(4-methoxyphenyl)-4-benzopyrone|7-Hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|7-Hydroxy-4'-methoxyisoflavone|7-hydroxy-3-(4-methoxyphenyl)-4H-benzopyran-4-one|7-hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one|Formononetin|biochanin B|formononetol http://purl.obolibrary.org/obo/CHEBI_18088 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18089 biolink:ChemicalEntity N-benzoylglycine An N-acylglycine in which the acyl group is specified as benzoyl. cas:495-69-2|hmdb:HMDB0000714|kegg.compound:C01586|knapsack:C00030483|metacyc.compound:CPD-425|pubmed:14646363|pubmed:15879000|pubmed:16760132|pubmed:17190852|pubmed:19283696|pubmed:19891605|pubmed:20405919|pubmed:22770225|pubmed:7153346|pubmed:8734460|pubmed:9120876|pubmed:9609721|reaxys:1073987|wikipedia.en:Hippuric_acid Graph Benzamidoacetic acid|Benzamidoessigsaeure|Benzoylaminoacetic acid|Benzoylaminoessigsaeure|Hippurate|Hippuric acid|Hippursaeure|N-Benzoylglycine|N-benzoylglycine|Phenylcarbonylaminoacetic acid N-Benzoylglycine|N-benzoylglycine Benzamidoacetic acid|Benzamidoessigsaeure|Benzoylaminoacetic acid|Benzoylaminoessigsaeure|Hippurate|Hippuric acid|Hippursaeure|N-Benzoylglycine|N-benzoylglycine|Phenylcarbonylaminoacetic acid http://purl.obolibrary.org/obo/CHEBI_18089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18090 biolink:ChemicalEntity 3-aminopropanal A propanal having an amino substituent at the 3-position beilstein:1738024|cas:352-92-1|foodb.food:FDB030407|hmdb:HMDB0001106|kegg.compound:C05665|metacyc.compound:CPD-6082|pubmed:11943872|pubmed:12513695|pubmed:12969020|pubmed:15246852|pubmed:17362887|pubmed:26296314|pubmed:34767295|pubmed:36727473|pubmed:37959847|pubmed:9670045 Graph 3-Aminopropanal|3-Aminopropionaldehyde|3-aminopropanal|beta-Aminopropion aldehyde|beta-aminopropionaldehyde 3-Aminopropanal|3-aminopropanal 3-Aminopropanal|3-Aminopropionaldehyde|3-aminopropanal|beta-Aminopropion aldehyde|beta-aminopropionaldehyde http://purl.obolibrary.org/obo/CHEBI_18090 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180904 biolink:ChemicalEntity (R)-nicardipine The R-enantiomer of nicardipine. cas:76093-35-1|chemspider:5036254|pubmed:10204680|pubmed:11214770|pubmed:2432901|pubmed:2981533|pubmed:3023614|pubmed:3350056|pubmed:7503807|pubmed:8641321 Graph (-)-nicardipine|(R)-YC-93 free base|2-[benzyl(methyl)amino]ethyl methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|R-(-)-nicardipine 2-[benzyl(methyl)amino]ethyl methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate (-)-nicardipine|(R)-YC-93 free base|2-[benzyl(methyl)amino]ethyl methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|R-(-)-nicardipine http://purl.obolibrary.org/obo/CHEBI_180904 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180905 biolink:ChemicalEntity 2-[benzyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate A dihydropyridine that is 1,4-dihydropyridine substituted by a methyl, {2-[benzyl(methyl)amino]ethoxy}carbonyl, 3-nitrophenyl, methoxycarbonyl and methyl groups at positions 2, 3, 4, 5 and 6, respectively. Graph 2-(benzylmethylamino)ethyl methyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)pyridine-3,5-dicarboxylate|2-[benzyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate 2-[benzyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate 2-(benzylmethylamino)ethyl methyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)pyridine-3,5-dicarboxylate|2-[benzyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate http://purl.obolibrary.org/obo/CHEBI_180905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180906 biolink:ChemicalEntity terpenoid phytoalexin A class of terpenoids formed in plants in response to fungal infection, physical damage, chemical injury, or a pathogenic process. Graph terpenoid phytoalexins terpenoid phytoalexins http://purl.obolibrary.org/obo/CHEBI_180906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18091 biolink:ChemicalEntity asparagusic acid beilstein:112178|cas:2224-02-4|kegg.compound:C01892|knapsack:C00000304 Graph 1,2-dithiolane-4-carboxylic acid|Asparagusate|Asparagusic acid|asparagusic acid 1,2-dithiolane-4-carboxylic acid 1,2-dithiolane-4-carboxylic acid|Asparagusate|Asparagusic acid|asparagusic acid http://purl.obolibrary.org/obo/CHEBI_18091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180911 biolink:ChemicalEntity suramin(6-) An organosulfate oxoanion that is the hexanion of suramin resulting from the deprotonation of the six sulfo groups; major species at pH 7.3. Graph 8,8'-{carbonylbis[iminobenzene-3,1-diylcarbonylimino(4-methylbenzene-3,1-diyl)carbonylimino]}dinaphthalene-1,3,5-trisulfonate|suramin|suramin hexanion 8,8'-{carbonylbis[iminobenzene-3,1-diylcarbonylimino(4-methylbenzene-3,1-diyl)carbonylimino]}dinaphthalene-1,3,5-trisulfonate 8,8'-{carbonylbis[iminobenzene-3,1-diylcarbonylimino(4-methylbenzene-3,1-diyl)carbonylimino]}dinaphthalene-1,3,5-trisulfonate|suramin|suramin hexanion http://purl.obolibrary.org/obo/CHEBI_180911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18092 biolink:ChemicalEntity 8'-apo-beta-carotenol beilstein:2482406|kegg.compound:C06733 Graph 8'-apo-beta-Carotenol|8'-apo-beta-caroten-8'-ol|8'-apo-beta-carotenol 8'-apo-beta-caroten-8'-ol 8'-apo-beta-Carotenol|8'-apo-beta-caroten-8'-ol|8'-apo-beta-carotenol http://purl.obolibrary.org/obo/CHEBI_18092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180930 biolink:ChemicalEntity 6beta-hydroxyprednisone A glucocorticoid that is prednisone carrying a hydroxy group at the 6β position. It is a metabolite of prednisone found in human urine. pubmed:25800201 Graph (1R,3aS,3bS,5R,9aR,9bS,11aS)-1,5-dihydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|6beta,17,21-trihydroxypregna-1,4-diene-3,11,20-trione 6beta,17,21-trihydroxypregna-1,4-diene-3,11,20-trione (1R,3aS,3bS,5R,9aR,9bS,11aS)-1,5-dihydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|6beta,17,21-trihydroxypregna-1,4-diene-3,11,20-trione http://purl.obolibrary.org/obo/CHEBI_180930 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:180931 biolink:ChemicalEntity GS-nitroimidazole A by-product in the activation of azathioprine to 6-mercaptopurine Graph http://purl.obolibrary.org/obo/CHEBI_180931 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180932 biolink:ChemicalEntity 2-hydroxyatorvastatin lactone Graph 2-OH-ATVL 2-OH-ATVL http://purl.obolibrary.org/obo/CHEBI_180932 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:180934 biolink:ChemicalEntity 4-hydroxyatorvastatin lactone Graph 4-OH-ATVL 4-OH-ATVL http://purl.obolibrary.org/obo/CHEBI_180934 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18094 biolink:ChemicalEntity 1,4-dihydroxy-2-naphthoic acid A naphthoic acid that is 2-naphthoic acid substituted by hydroxy groups at positions 1 and 4. cas:31519-22-9|ecmdb:ECMDB04054|kegg.compound:C03657|knapsack:C00000736|pubmed:1091286|pubmed:23801651|reaxys:2111226 Graph 1,4-Dihydroxy-2-naphthalenecarboxylic acid|1,4-Dihydroxy-2-naphthoic acid|1,4-dihydroxynaphthalene-2-carboxylic acid 1,4-dihydroxynaphthalene-2-carboxylic acid 1,4-Dihydroxy-2-naphthalenecarboxylic acid|1,4-Dihydroxy-2-naphthoic acid|1,4-dihydroxynaphthalene-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18095 biolink:ChemicalEntity trans-4-hydroxy-L-proline An optically active form of 4-hydroxyproline having L-trans-configuration. cas:51-35-4|drugcentral:4272|hmdb:HMDB0000725|kegg.compound:C01157|knapsack:C00001370|metacyc.compound:4-HYDROXY-L-PROLINE|pdb-ccd:HYP|pdb-ccd:HYP_LEO2|pdb-ccd:HYP_LL|pdb-ccd:HYP_LSN3|pubmed:1117843|pubmed:1166829|pubmed:12148113|pubmed:14104082|pubmed:14995121|pubmed:15558350|pubmed:16096557|pubmed:16656634|pubmed:16662024|pubmed:16665943|pubmed:17021603|pubmed:19286848|pubmed:590925|pubmed:616023|pubmed:6616407|pubmed:6625779|pubmed:6783274|pubmed:7248905|pubmed:7283558|pubmed:7446210|pubmed:899882|pubmed:946341|reaxys:81441 Graph (2S,4R)-4-hydroxy-2-pyrrolidinecarboxylic acid|(2S,4R)-trans-4-hydroxyproline|(4R)-4-hydroxy-L-proline|Hydroxy-L-proline|Hydroxyproline|Hyp|Hypro|L-4-Hydroxyproline|L-threo-4-hydroxyproline|delta-hydroxyproline|trans-4-Hydroxy-L-proline|trans-4-hydroxy-L-proline|trans-Hydroxyproline|trans-L-Hydroxyproline (4R)-4-hydroxy-L-proline (2S,4R)-4-hydroxy-2-pyrrolidinecarboxylic acid|(2S,4R)-trans-4-hydroxyproline|(4R)-4-hydroxy-L-proline|Hydroxy-L-proline|Hydroxyproline|Hyp|Hypro|L-4-Hydroxyproline|L-threo-4-hydroxyproline|delta-hydroxyproline|trans-4-Hydroxy-L-proline|trans-4-hydroxy-L-proline|trans-Hydroxyproline|trans-L-Hydroxyproline http://purl.obolibrary.org/obo/CHEBI_18095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18096 biolink:ChemicalEntity N-acetylarylalkylamine A member of the class of acetamides that is acetamide in which one of the hydrogens attached to the nitrogen has been replaced by an aryl-substituted alkyl group. kegg.compound:C02998|metacyc.compound:N-Acetylarylalkylamines Graph N-Acetylaralkylamine|N-Acetylarylalkylamine|N-acetyl aralkylamine|N-acetyl aralkylamines|N-acetyl arylalkylamines|N-acetylarylalkylamines|an N-acetylarylalkylamine N-Acetylaralkylamine|N-Acetylarylalkylamine|N-acetyl aralkylamine|N-acetyl aralkylamines|N-acetyl arylalkylamines|N-acetylarylalkylamines|an N-acetylarylalkylamine http://purl.obolibrary.org/obo/CHEBI_18096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18097 biolink:ChemicalEntity ferricytochrome b5 cas:9035-39-6|kegg.compound:C00996 Graph Ferricytochrome b5 Ferricytochrome b5 http://purl.obolibrary.org/obo/CHEBI_18097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18098 biolink:ChemicalEntity CMP-N-glycoloyl-beta-neuraminic acid A CMP-N-acyl-β-neuraminic acid in which the N-acyl group is glycoloyl. beilstein:7789465|kegg.compound:C03691|pubmed:15556760|pubmed:27373998|reaxys:7789465 Graph CMP-N-glycoloylneuraminate|CMP-N-glycolylneuraminate|CMP-Neu5Gc|CMP-NeuNGc|CMP-beta-Neu5Gc|cytidine 5'-[3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate]|cytidine-5'-monophosphono-N-glycoloyllneuraminic acid cytidine 5'-[3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate] CMP-N-glycoloylneuraminate|CMP-N-glycolylneuraminate|CMP-Neu5Gc|CMP-NeuNGc|CMP-beta-Neu5Gc|cytidine 5'-[3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-beta-D-galacto-non-2-ulopyranosylonic acid monophosphate]|cytidine-5'-monophosphono-N-glycoloyllneuraminic acid http://purl.obolibrary.org/obo/CHEBI_18098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18099 biolink:ChemicalEntity cyclohexanol An alcohol that consists of cyclohexane bearing a single hydroxy substituent. The parent of the class of cyclohexanols. cas:108-93-0|drugbank:DB03703|kegg.compound:C00854|metacyc.compound:CYCLOHEXANOL|pdb-ccd:CXL|pubmed:11682644|pubmed:23825601|reaxys:906744|umbbd.compound:c0175|wikipedia.en:Cyclohexanol Graph 1-Cyclohexanol|Cyclohexan-1-ol|Cyclohexanol|Cyclohexyl alcohol|Hexahydrophenol|Hexalin|Hydrophenol|Hydroxycyclohexane|cyclohexanol Cyclohexanol|cyclohexanol 1-Cyclohexanol|Cyclohexan-1-ol|Cyclohexanol|Cyclohexyl alcohol|Hexahydrophenol|Hexalin|Hydrophenol|Hydroxycyclohexane|cyclohexanol http://purl.obolibrary.org/obo/CHEBI_18099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18100 biolink:ChemicalEntity multi-methyl-branched fatty acyl-CoA A branched-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any multi-methyl-branched fatty acid. kegg.compound:C04013|pubmed:3880746 Graph Multi-methyl-branched acyl-CoA|multi-methyl-branched fatty acyl-CoAs|multi-methyl-branched fatty acyl-coenzyme A|multi-methyl-branched fatty acyl-coenzyme As Multi-methyl-branched acyl-CoA|multi-methyl-branched fatty acyl-CoAs|multi-methyl-branched fatty acyl-coenzyme A|multi-methyl-branched fatty acyl-coenzyme As http://purl.obolibrary.org/obo/CHEBI_18100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18101 biolink:ChemicalEntity 4-hydroxyphenylacetic acid A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 4-hydroxyphenyl group. cas:156-38-7|hmdb:HMDB0000020|kegg.compound:C00642|metacyc.compound:4-HYDROXYPHENYLACETATE|pdb-ccd:4HP|pubmed:11339992|pubmed:21476434|pubmed:22296160|pubmed:24636068|pubmed:24831010|pubmed:7126379|pubmed:977696|reaxys:1448766|umbbd.compound:c0271|wikipedia.en:4-hydroxyphenylacetic_acid Graph (4-hydroxyphenyl)acetic acid|(p-hydroxyphenyl)acetic acid|4-Hydroxyphenylacetate|4-Hydroxyphenylacetic acid|4-carboxymethylphenol|4-hydroxybenzeneacetic acid|p-hydroxyphenylacetic acid (4-hydroxyphenyl)acetic acid (4-hydroxyphenyl)acetic acid|(p-hydroxyphenyl)acetic acid|4-Hydroxyphenylacetate|4-Hydroxyphenylacetic acid|4-carboxymethylphenol|4-hydroxybenzeneacetic acid|p-hydroxyphenylacetic acid http://purl.obolibrary.org/obo/CHEBI_18101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18102 biolink:ChemicalEntity O-octanoyl-L-carnitine The L-enantiomer of an O-octanoylcarnitine. cas:25243-95-2|hmdb:HMDB0000791|kegg.compound:C02838|lipidmaps:LMFA07070002|metacyc.compound:L-OCTANOYLCARNITINE|pdb-ccd:OCB|pubmed:22770225|pubmed:23078175|pubmed:6888266 Graph (3R)-3-octanoyloxy-4-(trimethylammonio)butanoate|L-Octanoylcarnitine|L-octanoyl-L-carnitine|O-octanoyl-(R)-carnitine|O-octanoyl-R-carnitine (3R)-3-octanoyloxy-4-(trimethylammonio)butanoate (3R)-3-octanoyloxy-4-(trimethylammonio)butanoate|L-Octanoylcarnitine|L-octanoyl-L-carnitine|O-octanoyl-(R)-carnitine|O-octanoyl-R-carnitine http://purl.obolibrary.org/obo/CHEBI_18102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18103 biolink:ChemicalEntity L-tyrosine methyl ester 4-sulfate An O-sulfoamino acid consisting of methyl L-tyrosinate in which the hydrogen of the phenolic hydroxy group has been replaced by a sulfo group. kegg.compound:C04201 Graph L-Tyrosine methyl ester 4-sulfate|methyl O-sulfo-L-tyrosinate methyl O-sulfo-L-tyrosinate L-Tyrosine methyl ester 4-sulfate|methyl O-sulfo-L-tyrosinate http://purl.obolibrary.org/obo/CHEBI_18103 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18104 biolink:ChemicalEntity 2-dehydro-3-deoxy-D-fuconic acid A ketoaldonic acid comprising D-fuconic acid lacking the 3-hydroxy substituent and having a keto group at the 2-position. kegg.compound:C06159 Graph 2-Dehydro-3-deoxy-D-fuconate|2-dehydro-3-deoxy-D-fuconic acid|3,6-dideoxy-D-threo-hex-2-ulosonic acid 3,6-dideoxy-D-threo-hex-2-ulosonic acid 2-Dehydro-3-deoxy-D-fuconate|2-dehydro-3-deoxy-D-fuconic acid|3,6-dideoxy-D-threo-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_18104 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:181043 biolink:ChemicalEntity Fraxinellone cas:28808-62-0|chemspider:110550 Graph (3R,3aR)-3-(uran-3-yl)-3a,7-dimethyl-3,4,5,6-tetrahydro-2-benzouran-1-one (3R,3aR)-3-(uran-3-yl)-3a,7-dimethyl-3,4,5,6-tetrahydro-2-benzouran-1-one (3R,3aR)-3-(uran-3-yl)-3a,7-dimethyl-3,4,5,6-tetrahydro-2-benzouran-1-one http://purl.obolibrary.org/obo/CHEBI_181043 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18105 biolink:ChemicalEntity keto-D-fructose 1-phosphate The open chain form of D-fructose 1-phosphate. cas:15978-08-2|hmdb:HMDB0060467|kegg.compound:C01094|pubmed:2078589|pubmed:2197090|pubmed:2996495|pubmed:5246925|reaxys:1728987 Graph 1-O-phosphono-D-fructose|D-Fructose 1-phosphate|D-fructose 1-(dihydrogen phosphate) D-fructose 1-(dihydrogen phosphate) 1-O-phosphono-D-fructose|D-Fructose 1-phosphate|D-fructose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18106 biolink:ChemicalEntity deacetylipecoside An isoquinoline alkaloid consisting of β-D-glucose having a (2S,3R,4S)-3-ethenyl-4-{[(1R)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolinium-1-yl]methyl}-5-(methoxycarbonyl)-3,4-dihydro-2H-pyran-2-yl group attached at the anomeric centre. kegg.compound:C07307 Graph Deacetylipecoside|methyl (2S,3R,4S)-3-ethenyl-4-{[(1R)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate methyl (2S,3R,4S)-3-ethenyl-4-{[(1R)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate Deacetylipecoside|methyl (2S,3R,4S)-3-ethenyl-4-{[(1R)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_18106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18107 biolink:ChemicalEntity xanthosine A purine nucleoside in which xanthine is attached to ribofuranose via a β-N9-glycosidic bond. cas:146-80-5|hmdb:HMDB0000299|kegg.compound:C01762|knapsack:C00007222|metacyc.compound:XANTHOSINE|pubmed:10879466|pubmed:19176874|pubmed:21071429|pubmed:22698263|pubmed:22731949|pubmed:22770225|pubmed:22932763|reaxys:625906|wikipedia.en:Xanthosine Graph 9-beta-D-Ribofuranosylxanthine|9-beta-D-ribofuranosyl-3,9-dihydro-1H-purine-2,6-dione|9-beta-D-ribofuranosylxanthine|Xanthine riboside|Xanthosine|xanthine 9-beta-D-ribofuranoside|xanthosine Xanthosine|xanthosine 9-beta-D-Ribofuranosylxanthine|9-beta-D-ribofuranosyl-3,9-dihydro-1H-purine-2,6-dione|9-beta-D-ribofuranosylxanthine|Xanthine riboside|Xanthosine|xanthine 9-beta-D-ribofuranoside|xanthosine http://purl.obolibrary.org/obo/CHEBI_18107 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18110 biolink:ChemicalEntity 3-phosphonatooxypyruvate(3-) A carboxyalkyl phosphate oxoanion resuting from deprotonation of the carboxy and phosphate groups of 3-phosphooxypyruvic acid. kegg.compound:C03232|metacyc.compound:3-P-HYDROXYPYRUVATE Graph 2-oxo-3-(phosphonatooxy)propanoate|3-Phosphohydroxypyruvate|3-Phosphonooxypyruvate|3-phosphooxypyruvate|phosphohydroxypyruvate 2-oxo-3-(phosphonatooxy)propanoate 2-oxo-3-(phosphonatooxy)propanoate|3-Phosphohydroxypyruvate|3-Phosphonooxypyruvate|3-phosphooxypyruvate|phosphohydroxypyruvate http://purl.obolibrary.org/obo/CHEBI_18110 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18111 biolink:ChemicalEntity ribosomal RNA RNA molecules which are essential structural and functional components of ribosomes, the subcellular units responsible for protein synthesis. kegg.compound:C00240 Graph Ribosomal RNA|rRNA|ribosomal RNA Ribosomal RNA|ribosomal RNA Ribosomal RNA|rRNA|ribosomal RNA http://purl.obolibrary.org/obo/CHEBI_18111 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18112 biolink:ChemicalEntity 2-aminophenol The aminophenol which has the single amino substituent located ortho to the phenolic -OH group. cas:95-55-6|drugbank:DB01726|gmelin:26978|gmelin:606075|kegg.compound:C01987|knapsack:C00007533|pdb-ccd:2AF|pubmed:11304127|pubmed:1395635|pubmed:24124510|pubmed:24571346|pubmed:9683650|reaxys:606075|umbbd.compound:c0316|wikipedia.en:2-Aminophenol Graph 2-AMINOPHENOL|2-Aminobenzenol|2-Aminophenol|2-Hydroxyaniline|2-aminophenol|o-Aminophenol|o-hydroxyaniline 2-AMINOPHENOL|2-Aminophenol|2-aminophenol 2-AMINOPHENOL|2-Aminobenzenol|2-Aminophenol|2-Hydroxyaniline|2-aminophenol|o-Aminophenol|o-hydroxyaniline http://purl.obolibrary.org/obo/CHEBI_18112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18115 biolink:ChemicalEntity 4-hydroxymandelonitrile A cyanohydrin that is obtained by the formal addition of hydrogen cyanide to the aldehyde group of 4-hydroxybenzaldehyde. cas:13093-65-7|kegg.compound:C00650|reaxys:1367224 Graph 2-hydroxy-2-(4-hydroxyphenyl)acetonitrile|4-Hydroxymandelonitrile|4-hydroxybenzaldehyde cyanonhydrin|4-hydroxymandelonitrile|alpha,4-dihydroxybenzeneacetonitrile|hydroxy(4-hydroxyphenyl)acetonitrile|p-hydroxymandelonitrile|para-hydroxymandelonitrile hydroxy(4-hydroxyphenyl)acetonitrile 2-hydroxy-2-(4-hydroxyphenyl)acetonitrile|4-Hydroxymandelonitrile|4-hydroxybenzaldehyde cyanonhydrin|4-hydroxymandelonitrile|alpha,4-dihydroxybenzeneacetonitrile|hydroxy(4-hydroxyphenyl)acetonitrile|p-hydroxymandelonitrile|para-hydroxymandelonitrile http://purl.obolibrary.org/obo/CHEBI_18115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18116 biolink:ChemicalEntity pseudouridine 5'-phosphate A C-nucleoside phosphate consisting of pseudouridine having a monophosphate group at the 5'-position. cas:1157-60-4|hmdb:HMDB0001271|kegg.compound:C01168|pdb-ccd:PSU Graph (1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-O-phosphono-D-ribitol|(1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol 5-(dihydrogen phosphate)|5-(5-O-phosphono-beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione|Pseudouridine 5'-phosphate (1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol 5-(dihydrogen phosphate) (1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-O-phosphono-D-ribitol|(1S)-1,4-anhydro-1-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-D-ribitol 5-(dihydrogen phosphate)|5-(5-O-phosphono-beta-D-ribofuranosyl)pyrimidine-2,4(1H,3H)-dione|Pseudouridine 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_18116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18117 biolink:ChemicalEntity 3-ADP-2-phosphoglyceric acid A 3-ADP-glyceric acid having a phosphate group at the 2-position of the glyceric acid moiety. kegg.compound:C03673 Graph 3-(ADP)-2-phosphoglycerate|3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-(phosphonooxy)propanoic acid 3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-(phosphonooxy)propanoic acid 3-(ADP)-2-phosphoglycerate|3-{[(adenosin-5'-yl)(hydroxy)phosphoryloxy](hydroxy)phosphoryloxy}-2-(phosphonooxy)propanoic acid http://purl.obolibrary.org/obo/CHEBI_18117 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18118 biolink:ChemicalEntity L-xylono-1,4-lactone kegg.compound:C02994 Graph (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|L-Xylono-1,4-lactone|L-xylono-1,4-lactone (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one (3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)dihydrofuran-2(3H)-one|L-Xylono-1,4-lactone|L-xylono-1,4-lactone http://purl.obolibrary.org/obo/CHEBI_18118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18119 biolink:ChemicalEntity ethyl 3-oxohexanoate cas:3249-68-1|kegg.compound:C02975 Graph Ethyl 3-oxohexanoate|Ethyl butyrylacetate|ethyl 3-oxohexanoate Ethyl 3-oxohexanoate|ethyl 3-oxohexanoate Ethyl 3-oxohexanoate|Ethyl butyrylacetate|ethyl 3-oxohexanoate http://purl.obolibrary.org/obo/CHEBI_18119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18120 biolink:ChemicalEntity 5-aminopentanamide A fatty amide consisting of pentanamide having an amino substituent at the 5-position. cas:13023-70-6|kegg.compound:C00990 Graph 5-Aminopentanamide|5-aminopentanamide|5-aminovaleramide|5-aminovaleric acid amide 5-Aminopentanamide|5-aminopentanamide 5-Aminopentanamide|5-aminopentanamide|5-aminovaleramide|5-aminovaleric acid amide http://purl.obolibrary.org/obo/CHEBI_18120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18123 biolink:ChemicalEntity N-methylnicotinate An iminium betaine that is the conjugate base of N-methylnicotinic acid, arising from deprotonation of the carboxy group. beilstein:3905114|cas:535-83-1|hmdb:HMDB0000875|kegg.compound:C01004|knapsack:C00001555|metacyc.compound:METHYLNICOTINATE|pubmed:13128691|pubmed:17190852|pubmed:185134|pubmed:22242555|pubmed:22312719|pubmed:22393699|pubmed:22559314|pubmed:24047691|reaxys:3905114 Graph 1-Methyl-3-pyridiniumcarboxylate|1-Methylpyridinio-3-carboxylate|1-methylnicotinate|1-methylpyridinium-3-carboxylate|3-Carboxy-1-methylpyridinium hydroxide inner salt|Betain nicotinate|Betaine nicotinate|Caffearin|Caffearine|Coffearin|Gynesine|N'-Methylnicotinate|N-Methylnicotinate|N-methyl-nicotinate|N-methylnicotinate|Nicotinic acid N-methylbetaine|Trigenelline|Trigonellin|Trigonelline 1-methylpyridinium-3-carboxylate 1-Methyl-3-pyridiniumcarboxylate|1-Methylpyridinio-3-carboxylate|1-methylnicotinate|1-methylpyridinium-3-carboxylate|3-Carboxy-1-methylpyridinium hydroxide inner salt|Betain nicotinate|Betaine nicotinate|Caffearin|Caffearine|Coffearin|Gynesine|N'-Methylnicotinate|N-Methylnicotinate|N-methyl-nicotinate|N-methylnicotinate|Nicotinic acid N-methylbetaine|Trigenelline|Trigonellin|Trigonelline http://purl.obolibrary.org/obo/CHEBI_18123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18124 biolink:ChemicalEntity phosphonoacetaldehyde A phosphonic acid consisting of acetaldehyde with the phospho group at the 2-position. drugbank:DB03174|kegg.compound:C03167|knapsack:C00000799 Graph (2-oxoethyl)phosphonic acid|2-Oxoethylphosphonate|2-Phosphonoacetaldehyde|Phosphonoacetaldehyde (2-oxoethyl)phosphonic acid (2-oxoethyl)phosphonic acid|2-Oxoethylphosphonate|2-Phosphonoacetaldehyde|Phosphonoacetaldehyde http://purl.obolibrary.org/obo/CHEBI_18124 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18125 biolink:ChemicalEntity trans-2-coumaric acid The trans-isomer of 2-coumaric acid. cas:583-17-5|cas:614-60-8|drugbank:DB01650|gmelin:1319861|hmdb:HMDB0002641|kegg.compound:C01772|pdb-ccd:2HC|pubmed:23293469|reaxys:1100900|wikipedia.en:O-Coumaric_acid Graph (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID|(2E)-3-(2-hydroxyphenyl)-2-propenoic acid|(2E)-3-(2-hydroxyphenyl)prop-2-enoic acid|(E)-2-hydroxycinnamic acid|(E)-3-(2-hydroxy-phenyl)-acrylic acid|(E)-3-(2-hydroxyphenyl)-2-propenoic acid|(E)-o-hydroxycinnamic acid|2-Coumarate|2-Coumaric acid|2-Hydroxycinnamate|o-Coumaric acid|o-hydroxy-trans-cinnamic acid|trans-2-Hydroxycinnamate|trans-2-Hydroxycinnamic acid|trans-o-hydroxycinnamic acid (2E)-3-(2-hydroxyphenyl)prop-2-enoic acid (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID|(2E)-3-(2-hydroxyphenyl)-2-propenoic acid|(2E)-3-(2-hydroxyphenyl)prop-2-enoic acid|(E)-2-hydroxycinnamic acid|(E)-3-(2-hydroxy-phenyl)-acrylic acid|(E)-3-(2-hydroxyphenyl)-2-propenoic acid|(E)-o-hydroxycinnamic acid|2-Coumarate|2-Coumaric acid|2-Hydroxycinnamate|o-Coumaric acid|o-hydroxy-trans-cinnamic acid|trans-2-Hydroxycinnamate|trans-2-Hydroxycinnamic acid|trans-o-hydroxycinnamic acid http://purl.obolibrary.org/obo/CHEBI_18125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:181259 biolink:ChemicalEntity Destruxin B chemspider:378942|chemspider:9299946 Graph (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone|16-butan-2-yl-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone|16-butan-2-yl-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone (3R,10S,13S,16S,19S)-16-[(2S)-butan-2-yl]-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone|16-butan-2-yl-10,11,14-trimethyl-3-(2-methylpropyl)-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone http://purl.obolibrary.org/obo/CHEBI_181259 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18126 biolink:ChemicalEntity S-acylglutathione Any glutathione carrying an S-acyl substituent. kegg.compound:C02589 Graph S-Acylglutathione|S-acylglutathiones S-Acylglutathione|S-acylglutathiones http://purl.obolibrary.org/obo/CHEBI_18126 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18127 biolink:ChemicalEntity cadaverine An alkane-α,ω-diamine comprising a straight-chain pentane core with amino substitutents at positions 1 and 5. A colourless syrupy liquid diamine with a distinctive unpleasant odour, it is a homologue of putresceine and is formed by the bacterial decarboxylation of lysine that occurs during protein hydrolysis during putrefaction of animal tissue. It is also found in plants such as soyabean. cas:462-94-2|drugbank:DB03854|gmelin:2310|hmdb:HMDB0002322|kegg.compound:C01672|knapsack:C00001403|metacyc.compound:CADAVERINE|pdb-ccd:N2P|pubmed:10930630|pubmed:11397445|pubmed:11517436|pubmed:16346523|pubmed:16668466|pubmed:17439666|pubmed:23561112|pubmed:23794626|pubmed:23811038|pubmed:23887488|reaxys:1697256|wikipedia.en:Cadaverine Graph 1,5-Diaminopentane|1,5-Pentanediamine|1,5-pentamethylenediamine|Cadaverine|DAPE|PENTANE-1,5-DIAMINE|Pentamethylenediamine|pentane-1,5-diamine PENTANE-1,5-DIAMINE|pentane-1,5-diamine 1,5-Diaminopentane|1,5-Pentanediamine|1,5-pentamethylenediamine|Cadaverine|DAPE|PENTANE-1,5-DIAMINE|Pentamethylenediamine|pentane-1,5-diamine http://purl.obolibrary.org/obo/CHEBI_18127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18128 biolink:ChemicalEntity luteolin 7-O-beta-D-glucosiduronic acid A luteolin glucosiduronic acid consisting of luteolin having a β-D-glucosiduronic acid residue attached at the 7-position. cas:29741-10-4|kegg.compound:C03515|lipidmaps:LMPK12110644|metacyc.compound:LUTEOLIN-7-O-BETA-D-GLUCURONIDE|pubmed:12088434|pubmed:1620743|pubmed:7766058|reaxys:5785426 Graph 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranosiduronic acid|Cyanidenon-7-O-beta-D-glucuronic acid|Luteolin 7-O-beta-D-glucuronopyranoside|Luteolin 7-O-glucuronide|Luteolin 7-glucuronide 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranosiduronic acid 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranosiduronic acid|Cyanidenon-7-O-beta-D-glucuronic acid|Luteolin 7-O-beta-D-glucuronopyranoside|Luteolin 7-O-glucuronide|Luteolin 7-glucuronide http://purl.obolibrary.org/obo/CHEBI_18128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18129 biolink:ChemicalEntity (S)-2-hydroxyoctadecanoic acid An optically active form of 2-hydroxyoctadecanoic acid having (S)-configuration. kegg.compound:C03045|lipidmaps:LMFA01050286 Graph (2S)-2-hydroxyoctadecanoic acid|(S)-2-hydroxystearic acid (2S)-2-hydroxyoctadecanoic acid (2S)-2-hydroxyoctadecanoic acid|(S)-2-hydroxystearic acid http://purl.obolibrary.org/obo/CHEBI_18129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18130 biolink:ChemicalEntity (-)-5-oxo-1,2-campholide An optically active 5-oxo-1,2-campholide having (−)-(1R,5R)-configuration. kegg.compound:C02952|lipidmaps:LMPR0102120042 Graph (1R,4R)-5-oxo-1,2-campholide|(1R,5R)-1,8,8-trimethyl-2-oxabicyclo[3.2.1]octane-3,6-dione|5-Oxo-1,2-campholide (1R,5R)-1,8,8-trimethyl-2-oxabicyclo[3.2.1]octane-3,6-dione (1R,4R)-5-oxo-1,2-campholide|(1R,5R)-1,8,8-trimethyl-2-oxabicyclo[3.2.1]octane-3,6-dione|5-Oxo-1,2-campholide http://purl.obolibrary.org/obo/CHEBI_18130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18131 biolink:ChemicalEntity licodione A β-diketone that is acetylacetone in which a 4-hydroxyphenyl group and a 2,4-dihydroxyphenyl group replace the two methyl groups. cas:61153-76-2|kegg.compound:C01592|knapsack:C00006994|lipidmaps:LMPK12120396|metacyc.compound:LICODIONE|pubmed:10540749|pubmed:9055445|reaxys:2700999 Graph 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione|Licodione 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propane-1,3-dione|Licodione http://purl.obolibrary.org/obo/CHEBI_18131 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18132 biolink:ChemicalEntity phosphocholine The phosphate of choline; and the parent compound of the phosphocholine family. cas:107-73-3|drugbank:DB03945|gmelin:2594827|hmdb:HMDB0001565|kegg.compound:C00588|knapsack:C00007299|pdb-ccd:PC|pubmed:10456913|pubmed:10596404|pubmed:10811914|pubmed:11437497|pubmed:11908950|pubmed:15267227|pubmed:15583011|pubmed:18684852|pubmed:19369878|pubmed:19748321|pubmed:19758165|pubmed:23572077|pubmed:24012478|pubmed:6420466|pubmed:6790611|pubmed:7450902|reaxys:1784889 Graph ChoP|Choline phosphate|N,N,N-trimethyl-2-(phosphonooxy)ethanaminium|N-Trimethyl-2-aminoethylphosphonate|O-Phosphocholine|O-phosphocholine|PHOSPHOCHOLINE|Phosphocholine|Phosphoryl-choline|Phosphorylcholine|Trimethyl(2-(phosphonooxy)ethyl)ammonium N,N,N-trimethyl-2-(phosphonooxy)ethanaminium ChoP|Choline phosphate|N,N,N-trimethyl-2-(phosphonooxy)ethanaminium|N-Trimethyl-2-aminoethylphosphonate|O-Phosphocholine|O-phosphocholine|PHOSPHOCHOLINE|Phosphocholine|Phosphoryl-choline|Phosphorylcholine|Trimethyl(2-(phosphonooxy)ethyl)ammonium http://purl.obolibrary.org/obo/CHEBI_18132 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18133 biolink:ChemicalEntity hexose Any six-carbon monosaccharide which in its linear form contains either an aldehyde group at position 1 (aldohexose) or a ketone group at position 2 (ketohexose). glygen:G70994MS|glytoucan:G70994MS|kegg.compound:C00738 Graph Hexose|hexoses Hexose|hexoses http://purl.obolibrary.org/obo/CHEBI_18133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18134 biolink:ChemicalEntity 3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylic acid A steroid acid consisting of 3β-hydroxy-4β-methyl-5α-cholest-7-ene having a carboxy group at the 4-position. kegg.compound:C04840 Graph 3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate|3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylic acid 3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate|3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylic acid 3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate|3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18135 biolink:ChemicalEntity catechol A benzenediol comprising of a benzene core carrying two hydroxy substituents ortho to each other. cas:120-80-9|cas:12385-08-9|drugbank:DB02232|gmelin:2936|hmdb:HMDB0000957|kegg.compound:C00090|kegg.compound:C01785|kegg.compound:C15571|knapsack:C00002644|metacyc.compound:CATECHOL|pdb-ccd:CAQ|pubmed:10651166|pubmed:11470755|pubmed:15951152|pubmed:16610220|reaxys:471401|umbbd.compound:c0097|wikipedia.en:Catechol Graph 1,2-Benzenediol|1,2-Dihydroxybenzene|2-hydroxyphenol|Brenzcatechin|Catechol|Pyrocatechol|alpha-hydroxyphenol|benzene-1,2-diol|catechol|o-Benzenediol|o-hydroxyphenol|pyrocatechin benzene-1,2-diol 1,2-Benzenediol|1,2-Dihydroxybenzene|2-hydroxyphenol|Brenzcatechin|Catechol|Pyrocatechol|alpha-hydroxyphenol|benzene-1,2-diol|catechol|o-Benzenediol|o-hydroxyphenol|pyrocatechin http://purl.obolibrary.org/obo/CHEBI_18135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18136 biolink:ChemicalEntity 3-(2,3-dihydroxyphenyl)propanoic acid A monocarboxylic acid that is propionic acid carrying a 2,3-dihydroxyphenyl substituent at C-3; a microbial metabolite of quinoline. beilstein:2938830|cas:3714-73-6|kegg.compound:C04044 Graph 2,3-DHP|2,3-Dhppa|2,3-Dihydroxyphenylpropionic acid|2,3-dihydroxy-beta-phenylpropionic acid|2,3-dihyrroxybenzenepropanoic acid|3,4-dihydroxyhydrocinnamic acid|3-(2,3-dihydroxyphenyl)propanoic acid|3-(2,3-dihydroxyphenyl)propionic acid|hydrocaffeic acid 3-(2,3-dihydroxyphenyl)propanoic acid 2,3-DHP|2,3-Dhppa|2,3-Dihydroxyphenylpropionic acid|2,3-dihydroxy-beta-phenylpropionic acid|2,3-dihyrroxybenzenepropanoic acid|3,4-dihydroxyhydrocinnamic acid|3-(2,3-dihydroxyphenyl)propanoic acid|3-(2,3-dihydroxyphenyl)propionic acid|hydrocaffeic acid http://purl.obolibrary.org/obo/CHEBI_18136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18137 biolink:ChemicalEntity heparan sulfate alpha-D-glucosaminide A heparan sulfate having an α-D-glucosaminyl residue at the non-reducing end. The heparan sulfate part consists of a variably sulfated repeating disaccharide unit. kegg.compound:C04384|kegg.compound:C17141 Graph Heparan sulfate alpha-D-glucosaminide Heparan sulfate alpha-D-glucosaminide http://purl.obolibrary.org/obo/CHEBI_18137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18138 biolink:ChemicalEntity biuret A member of the class of condensed ureas that is the compound formed by the condensation of two molecules of urea; the parent compound of the biuret group of compounds. Used as a non-protein nitrogen source in ruminant feed. cas:108-19-0|gmelin:49702|kegg.compound:C06555|metacyc.compound:CPD-809|pubmed:24575873|pubmed:5391979|reaxys:1703510|umbbd.compound:c0164|wikipedia.en:Biuret Graph (aminocarbonyl)urea|2-imidodicarbonic diamide|Biuret|allophanamide|biuret|carbamoylurea|dicarbonimidic diamide|imidodicarbonic diamide|ureidoformamide 2-imidodicarbonic diamide (aminocarbonyl)urea|2-imidodicarbonic diamide|Biuret|allophanamide|biuret|carbamoylurea|dicarbonimidic diamide|imidodicarbonic diamide|ureidoformamide http://purl.obolibrary.org/obo/CHEBI_18138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18139 biolink:ChemicalEntity trimethylamine A tertiary amine that is ammonia in which each hydrogen atom is substituted by an methyl group. cas:75-50-3|gmelin:1309|hmdb:HMDB0000906|kegg.compound:C00565|knapsack:C00001433|metacyc.compound:TRIMETHYLAMINE|pdb-ccd:KEN|pubmed:14047118|pubmed:15304308|pubmed:15752091|pubmed:17190852|pubmed:1801314|pubmed:24591617|pubmed:2501587|pubmed:5161463|reaxys:956566|wikipedia.en:Trimethylamine Graph (CH3)3N|N(CH3)3|N,N,N-trimethylamine|N,N-Dimethylmethanamine|N,N-dimethylmethanamine|NMe3|TMA|Trimethylamin|Trimethylamine|tridimethylaminomethane N,N-Dimethylmethanamine|N,N-dimethylmethanamine (CH3)3N|N(CH3)3|N,N,N-trimethylamine|N,N-Dimethylmethanamine|N,N-dimethylmethanamine|NMe3|TMA|Trimethylamin|Trimethylamine|tridimethylaminomethane http://purl.obolibrary.org/obo/CHEBI_18139 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18140 biolink:ChemicalEntity hydrogen halide Graph hydrogen halide|hydrogen halides hydrogen halides hydrogen halide|hydrogen halides http://purl.obolibrary.org/obo/CHEBI_18140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18142 biolink:ChemicalEntity N(6')-acetylkanamycin B An N6'-acetylkanamycin derived from kanamycin B. kegg.compound:C03154 Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 6-acetamido-2-amino-2,6-dideoxy-alpha-D-glucopyranoside|N6'-Acetylkanamycin-B (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 6-acetamido-2-amino-2,6-dideoxy-alpha-D-glucopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 6-acetamido-2-amino-2,6-dideoxy-alpha-D-glucopyranoside|N6'-Acetylkanamycin-B http://purl.obolibrary.org/obo/CHEBI_18142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18144 biolink:ChemicalEntity all-trans-nonaprenyl diphosphate A nonaprenyl diphosphate where all C=C double bonds have (E)-configuration. cas:60037-55-0|kegg.compound:C04145|knapsack:C00007289 Graph (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl trihydrogen diphosphate|Diphosphoric acid, mono(3,7,11,15,19,23,27,31,35-nonamethyl-2,6,10,14,18,22,26,30,34-hexatriacontanonaenyl) ester, (all-E)-|Solanesyl diphosphate|Solanesyl pyrophosphate|all-trans-Nonaprenyl diphosphate (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl trihydrogen diphosphate (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl trihydrogen diphosphate|Diphosphoric acid, mono(3,7,11,15,19,23,27,31,35-nonamethyl-2,6,10,14,18,22,26,30,34-hexatriacontanonaenyl) ester, (all-E)-|Solanesyl diphosphate|Solanesyl pyrophosphate|all-trans-Nonaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_18144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18145 biolink:ChemicalEntity (R,R,R)-alpha-tocopherol An α-tocopherol that has R,R,R configuration. The naturally occurring stereoisomer of α-tocopherol, it is found particularly in sunflower and olive oils. beilstein:5300493|cas:59-02-9|chemspider:14265|drugbank:DB00163|drugcentral:4280|foodb.food:FDB000565|hmdb:HMDB0001893|kegg.compound:C02477|knapsack:C00007366|lipidmaps:LMPR02020001|metacyc.compound:ALPHA-TOCOPHEROL|pdb-ccd:VIV|pubmed:11427352|pubmed:12899840|pubmed:14657365|pubmed:16512933|pubmed:17031012|pubmed:17310859|pubmed:19389964|pubmed:19663978|pubmed:20209471|pubmed:21591326|pubmed:23599266|pubmed:28694484|pubmed:31013594|pubmed:33197771|reaxys:94012|wikipedia.en:Alpha-Tocopherol Graph (+)-alpha-tocopherol|(2R)-2,5,7,8-TETRAMETHYL-2-[(4R,8R)-4,8,12-TRIMETHYLTRIDECYL]CHROMAN-6-OL|(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol|(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol|(2R,4'R,8'R)-alpha-tocopherol|(R,R,R)-alpha-tocopherol|(all-R)-alpha-tocopherol|5,7,8-trimethyltocol|RRR-alpha-tocopherol|Vitamin E|alpha-Tocopherol|d-alpha-tocopherol (2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol (+)-alpha-tocopherol|(2R)-2,5,7,8-TETRAMETHYL-2-[(4R,8R)-4,8,12-TRIMETHYLTRIDECYL]CHROMAN-6-OL|(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol|(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol|(2R,4'R,8'R)-alpha-tocopherol|(R,R,R)-alpha-tocopherol|(all-R)-alpha-tocopherol|5,7,8-trimethyltocol|RRR-alpha-tocopherol|Vitamin E|alpha-Tocopherol|d-alpha-tocopherol http://purl.obolibrary.org/obo/CHEBI_18145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18146 biolink:ChemicalEntity (R)-canadine A canadine which has R configuration. beilstein:96685|kegg.compound:C11818 Graph (13aR)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|(R)-Canadine|(R)-canadine (13aR)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline (13aR)-9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|(R)-Canadine|(R)-canadine http://purl.obolibrary.org/obo/CHEBI_18146 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18147 biolink:ChemicalEntity beta-maltose A maltose that has β-configuration at the reducing end anomeric centre. beilstein:5758727|cas:133-99-3|cas:69-79-4|drugcentral:1628|gmelin:1617409|kegg.compound:C01971|metacyc.compound:MALTOSE|patent:CN101484460|patent:EP2045255|patent:KR20090026341|patent:US2009292116|pubmed:10923783|pubmed:15665241|pubmed:17439666|pubmed:1839610|pubmed:19443021|pubmed:20477758|pubmed:20480118|pubmed:31537530|pubmed:7796915|pubmed:8495446|reaxys:90844|wikipedia.en:Maltose Graph 4-(alpha-D-Glucopyranosido)-alpha-glucopyranose|4-O-alpha-D-Glucopyranosyl-D-glucose|4-O-alpha-D-glucopyranosyl-beta-D-glucopyranose|Beta-maltose|D-Maltose|Glca1-4Glcb|Glcalpha1-4Glcbeta|Maltobiose|alpha-D-Glcp-(1->4)-beta-D-Glcp|alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranose|beta-D-glucopyranose, 4-O-alpha-D-glucopyranosyl-|beta-Maltose alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranose 4-(alpha-D-Glucopyranosido)-alpha-glucopyranose|4-O-alpha-D-Glucopyranosyl-D-glucose|4-O-alpha-D-glucopyranosyl-beta-D-glucopyranose|Beta-maltose|D-Maltose|Glca1-4Glcb|Glcalpha1-4Glcbeta|Maltobiose|alpha-D-Glcp-(1->4)-beta-D-Glcp|alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranose|beta-D-glucopyranose, 4-O-alpha-D-glucopyranosyl-|beta-Maltose http://purl.obolibrary.org/obo/CHEBI_18147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18148 biolink:ChemicalEntity alpha-D-glucose 1,6-bisphosphate A D-glucose 1,6-bisphosphate in which both phosphate groups are monophosphates. cas:10139-18-1|drugbank:DB02835|foodb.food:FDB023185|hmdb:HMDB0003514|kegg.compound:C01231|metacyc.compound:ALPHA-GLUCOSE-16-BISPHOSPHATE|pdb-ccd:G16|pubmed:125609|pubmed:1449560|pubmed:1533182|pubmed:1825156|pubmed:20153838|pubmed:2140696|pubmed:31356|pubmed:37556117|pubmed:8418857|reaxys:94613 Graph 1,6-di-O-phosphono-alpha-D-glucopyranose|D-Glucose 1,6-biphosphate|alpha-D-Glucose 1,6-biphosphate|alpha-D-glucopyranose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-alpha-D-glucopyranose|alpha-D-glucopyranose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-alpha-D-glucopyranose|D-Glucose 1,6-biphosphate|alpha-D-Glucose 1,6-biphosphate|alpha-D-glucopyranose 1,6-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18150 biolink:ChemicalEntity 7-phospho-2-dehydro-3-deoxy-D-arabino-heptonic acid A ketoaldonic acid phosphate consisting of 2-dehydro-3-deoxy-D-arabino-heptonic acid having a phospho group at the 7-position. beilstein:9347056|cas:2627-73-8|kegg.compound:C04691|knapsack:C00007497 Graph 2-Dahp|2-Dehydro-3-deoxy-D-arabino-heptonate 7-phosphate|3-Deoxy-D-arabino-hept-2-ulosonate 7-phosphate|3-Deoxy-D-arabino-heptulosonic acid 7-phosphate|3-Deoxy-arabino-heptulonate 7-phosphate|3-deoxy-7-O-phosphono-D-arabino-hept-2-ulosonic acid|3-deoxy-D-arabino-2-heptulosonic acid 7-(dihydrogen phosphate)|3-deoxy-D-arabino-heptulosonate-7-phosphate|DAHP 3-deoxy-7-O-phosphono-D-arabino-hept-2-ulosonic acid 2-Dahp|2-Dehydro-3-deoxy-D-arabino-heptonate 7-phosphate|3-Deoxy-D-arabino-hept-2-ulosonate 7-phosphate|3-Deoxy-D-arabino-heptulosonic acid 7-phosphate|3-Deoxy-arabino-heptulonate 7-phosphate|3-deoxy-7-O-phosphono-D-arabino-hept-2-ulosonic acid|3-deoxy-D-arabino-2-heptulosonic acid 7-(dihydrogen phosphate)|3-deoxy-D-arabino-heptulosonate-7-phosphate|DAHP http://purl.obolibrary.org/obo/CHEBI_18150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18151 biolink:ChemicalEntity menaquinol Any polyprenylhydroquinone having a polyprenyl moiety at position 2 and a methyl group at position 3.. kegg.compound:C05819 Graph Menaquinol|Reduced menaquinone|Reduced vitamin K2|Vitamin K2 hydroquinone|a menaquinol Menaquinol|Reduced menaquinone|Reduced vitamin K2|Vitamin K2 hydroquinone|a menaquinol http://purl.obolibrary.org/obo/CHEBI_18151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18152 biolink:ChemicalEntity myricetin A hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 3', 4', 5, 5' and 7. It has been isolated from the leaves of Myrica rubra and other plants. cas:529-44-2|drugbank:DB02375|hmdb:HMDB0002755|kegg.compound:C10107|knapsack:C00001071|lincs.smallmolecule:LSM-2957|lipidmaps:LMPK12110001|metacyc.compound:MYRICETIN|pdb-ccd:MYC|pubmed:19407970|pubmed:19778600|pubmed:22482362|pubmed:23099505|pubmed:23232835|pubmed:23265454|pubmed:23736695|reaxys:332331|wikipedia.en:Myricetin Graph 3,3',4',5,5',7-Hexahydroxyflavone|3,5,7,3',4',5'-Hexahydroxyflavone|3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one|Cannabiscetin|Myricetin|Myricetol 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one 3,3',4',5,5',7-Hexahydroxyflavone|3,5,7,3',4',5'-Hexahydroxyflavone|3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one|Cannabiscetin|Myricetin|Myricetol http://purl.obolibrary.org/obo/CHEBI_18152 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18153 biolink:ChemicalEntity ethene beilstein:1730731|bpdb:2009|cas:74-85-1|gmelin:214|kegg.compound:C06547|knapsack:C00000175|umbbd.compound:c0359 Graph Aethen|Aethylen|CH2=CH2|Ethylene|H2C=CH2|R-1150|ethene Ethylene|ethene Aethen|Aethylen|CH2=CH2|Ethylene|H2C=CH2|R-1150|ethene http://purl.obolibrary.org/obo/CHEBI_18153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18154 biolink:ChemicalEntity polysaccharide A biomacromolecule consisting of large numbers of monosaccharide residues linked glycosidically. This term is commonly used only for those containing more than ten monosaccharide residues. kegg.compound:C00420 Graph Glycan|Glycane|Glykan|Glykane|Polysaccharide|glycans|polisacarido|polisacaridos|polysaccharides polysaccharides Glycan|Glycane|Glykan|Glykane|Polysaccharide|glycans|polisacarido|polisacaridos|polysaccharides http://purl.obolibrary.org/obo/CHEBI_18154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18157 biolink:ChemicalEntity aerobactin cas:26198-65-2|foodb.food:FDB023292|hmdb:HMDB0004051|kegg.compound:C05554|metacyc.compound:AEROBACTIN|pubmed:17600077|pubmed:22716772|pubmed:23460907|pubmed:24664504|pubmed:26056379|pubmed:28654175|pubmed:28736222|pubmed:29618511|pubmed:29991301|pubmed:31032610|pubmed:31328596|pubmed:31847813|pubmed:32432457|pubmed:6456229|wikipedia.en:Aerobactin Graph (8S,16S)-3,12,21-trihydroxy-2,10,14,22-tetraoxo-3,9,15,21-tetraazatricosane-8,12,16-tricarboxylic acid|Aerobactin|N(2),N(2)'-(3-carboxy-3-hydroxypentanedioyl)bis(N(6)-acetyl-N(6)-hydroxy-L-lysine) N(2),N(2)'-(3-carboxy-3-hydroxypentanedioyl)bis(N(6)-acetyl-N(6)-hydroxy-L-lysine) (8S,16S)-3,12,21-trihydroxy-2,10,14,22-tetraoxo-3,9,15,21-tetraazatricosane-8,12,16-tricarboxylic acid|Aerobactin|N(2),N(2)'-(3-carboxy-3-hydroxypentanedioyl)bis(N(6)-acetyl-N(6)-hydroxy-L-lysine) http://purl.obolibrary.org/obo/CHEBI_18157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18163 biolink:ChemicalEntity alpha-NeuNAc-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-NeuNAc-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer A sialotetraosylceramide consisting of a branched hexasaccharide made up from two sialyl residues, two galactose residues, one N-acetylgalactosamine residue and a glucose residue at the reducing end attached to the ceramide portion via a β-linkage. kegg.compound:C04927|kegg.glycan:G00111|pubmed:15546874|pubmed:1567198|pubmed:1724444|pubmed:17855742|pubmed:19221437|pubmed:19726417|pubmed:2303428|pubmed:2448252|pubmed:24841627|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:28416698|pubmed:6204642|pubmed:7534889|pubmed:7553668|pubmed:7691279|pubmed:7693874 Graph (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD1a|N-Acetylneuraminyl-D-galactosyl-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosylceramide|NeuAc(alpha2-3)Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|NeuAcalpha2->3Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->3)Galbeta1->4Glcbeta1-1Cer|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine|alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphing-4-enine|alpha-NeupNAc-(2->3)-beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-NeupNAc-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GD1a (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-acylamino-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD1a|N-Acetylneuraminyl-D-galactosyl-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosylceramide|NeuAc(alpha2-3)Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|NeuAcalpha2->3Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->3)Galbeta1->4Glcbeta1-1Cer|alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine|alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphing-4-enine|alpha-NeupNAc-(2->3)-beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-NeupNAc-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GD1a http://purl.obolibrary.org/obo/CHEBI_18163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18164 biolink:ChemicalEntity (2S)-2-hydroxyphytanic acid A 20-carbon, methyl-branched hydroxy fatty acid and intermediate in phytanic acid degradation; accumulates in patients with peroxisimal disorders. kegg.compound:C02982|pubmed:1385561 Graph (2S)-2-hydroxy-3,7,11,15-tetramethylhexadecanoic acid|L-2-hydroxyphytanic acid (2S)-2-hydroxy-3,7,11,15-tetramethylhexadecanoic acid (2S)-2-hydroxy-3,7,11,15-tetramethylhexadecanoic acid|L-2-hydroxyphytanic acid http://purl.obolibrary.org/obo/CHEBI_18164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18165 biolink:ChemicalEntity isopenicillin N beilstein:5311821|drugbank:DB03550|kegg.compound:C05557|knapsack:C00000778|pdb-ccd:IP1 Graph (2S,5R,6R)-6-[(5S)-5-amino-5-carboxypentanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6beta-[(5S)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid|ISOPENICILLIN N|Isopenicillin N 6beta-[(5S)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid (2S,5R,6R)-6-[(5S)-5-amino-5-carboxypentanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6beta-[(5S)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid|ISOPENICILLIN N|Isopenicillin N http://purl.obolibrary.org/obo/CHEBI_18165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:181662 biolink:ChemicalEntity Meranzin hydrate chemspider:4247554 Graph 8-(2,3-dihydroxy-3-methylbutyl)-7-methoxychromen-2-one 8-(2,3-dihydroxy-3-methylbutyl)-7-methoxychromen-2-one 8-(2,3-dihydroxy-3-methylbutyl)-7-methoxychromen-2-one http://purl.obolibrary.org/obo/CHEBI_181662 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18167 biolink:ChemicalEntity alpha-maltose A maltose that has α-configuration at the reducing end anomeric centre. cas:4482-75-1|gmelin:1485260|hmdb:HMDB0000163|kegg.compound:C00897|metacyc.compound:ALPHA-MALTOSE|pdb-ccd:MAL|pubmed:17669381|pubmed:19443021|pubmed:25568069|pubmed:31537530|reaxys:1292753|wikipedia.en:Maltose Graph 4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranose|Alpha-maltose|Glca1-4Glca|Glcalpha1-4Glca|Glcalpha1-4Glcalpha|MALTOSE|alpha-D-Glcp-(1->4)-alpha-D-Glcp|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose|alpha-Malt sugar|alpha-Maltose alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose 4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranose|Alpha-maltose|Glca1-4Glca|Glcalpha1-4Glca|Glcalpha1-4Glcalpha|MALTOSE|alpha-D-Glcp-(1->4)-alpha-D-Glcp|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose|alpha-Malt sugar|alpha-Maltose http://purl.obolibrary.org/obo/CHEBI_18167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18168 biolink:ChemicalEntity 2-oxophytanic acid kegg.compound:C02117 Graph 2-Oxophytanate|2-Oxophytanic acid|3,7,11,15-tetramethyl-2-oxohexadecanoic acid 3,7,11,15-tetramethyl-2-oxohexadecanoic acid 2-Oxophytanate|2-Oxophytanic acid|3,7,11,15-tetramethyl-2-oxohexadecanoic acid http://purl.obolibrary.org/obo/CHEBI_18168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18169 biolink:ChemicalEntity 1D-myo-inositol 3-phosphate beilstein:2622083|cas:2831-74-5|kegg.compound:C04006|pdb-ccd:LIP Graph 1D-myo-Inositol 3-monophosphate|1D-myo-Inositol 3-phosphate|1L-myo-Inositol 1-phosphate|1L-myo-inositol 1-(dihydrogen phosphate)|D-myo-Inositol 3-monophosphate|D-myo-Inositol 3-phosphate|Inositol 3-phosphate|L-myo-Inositol 1-phosphate|Myoinositol 3-phosphate 1L-myo-inositol 1-(dihydrogen phosphate) 1D-myo-Inositol 3-monophosphate|1D-myo-Inositol 3-phosphate|1L-myo-Inositol 1-phosphate|1L-myo-inositol 1-(dihydrogen phosphate)|D-myo-Inositol 3-monophosphate|D-myo-Inositol 3-phosphate|Inositol 3-phosphate|L-myo-Inositol 1-phosphate|Myoinositol 3-phosphate http://purl.obolibrary.org/obo/CHEBI_18169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18170 biolink:ChemicalEntity selenic acid cas:7783-08-6|kegg.compound:C05697|pdb-ccd:SE4 Graph H2SeO4|Selenic acid|[SeO2(OH)2]|dihydroxidodioxidoselenium|selenic acid Selenic acid|dihydroxidodioxidoselenium|selenic acid H2SeO4|Selenic acid|[SeO2(OH)2]|dihydroxidodioxidoselenium|selenic acid http://purl.obolibrary.org/obo/CHEBI_18170 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18171 biolink:ChemicalEntity 8-O-methylsterigmatocystin cas:17878-69-2|kegg.compound:C03686|knapsack:C00023634|lipidmaps:LMPK10000003 Graph (3aR,12cS)-6,8-dimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|7-O-Methylsterigmatocystin|8-O-methylsterigmatocystin|O-Methyl sterigmatocystin|O-Methylsterigmatocystin (3aR,12cS)-6,8-dimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one (3aR,12cS)-6,8-dimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|7-O-Methylsterigmatocystin|8-O-methylsterigmatocystin|O-Methyl sterigmatocystin|O-Methylsterigmatocystin http://purl.obolibrary.org/obo/CHEBI_18171 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18172 biolink:ChemicalEntity fluoroacetate A haloacetate(1−) resulting from the deprotonation of the carboxy group of fluoroacetic acid. cas:513-62-2|gmelin:323482|kegg.compound:C06108|reaxys:3536125|umbbd.compound:c0801 Graph FCH2CO2 anion|fluoroacetate|fluoroacetic acid, ion(1-) fluoroacetate FCH2CO2 anion|fluoroacetate|fluoroacetic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_18172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18176 biolink:ChemicalEntity 2-coumaric acid A monohydroxycinnamic acid in which the hydroxy substituent is located at C-2 of the phenyl ring. agr:IND43878326|agr:IND44077244|cas:583-17-5|pubmed:24248866|pubmed:24868863|reaxys:2207352 Graph 2-Hydroxycinnamate|2-hydroxycinnamic acid|3-(2-hydroxyphenyl)acrylic acid|3-(2-hydroxyphenyl)prop-2-enoic acid 3-(2-hydroxyphenyl)prop-2-enoic acid 2-Hydroxycinnamate|2-hydroxycinnamic acid|3-(2-hydroxyphenyl)acrylic acid|3-(2-hydroxyphenyl)prop-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_18176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18177 biolink:ChemicalEntity N-acetylphenylethylamine beilstein:2208721|cas:877-95-2|kegg.compound:C06746 Graph N-(2-Phenylethyl)-acetamide|N-(2-phenylethyl)acetamide|N-Acetylphenylethylamine|N-acetylphenethylamine|N-beta-phenylethylacetamide|N-phenethylacetamide N-(2-phenylethyl)acetamide N-(2-Phenylethyl)-acetamide|N-(2-phenylethyl)acetamide|N-Acetylphenylethylamine|N-acetylphenethylamine|N-beta-phenylethylacetamide|N-phenethylacetamide http://purl.obolibrary.org/obo/CHEBI_18177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18179 biolink:ChemicalEntity phosphoinositide Any phosphatidylinositol that is phosphorylated at one or more of the hydroxy groups of inositol. pubmed:10782093|pubmed:15269334|pubmed:17035995|pubmed:19154715 Graph http://purl.obolibrary.org/obo/CHEBI_18179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18183 biolink:ChemicalEntity 5-oxo-L-proline An optically active form of 5-oxoproline having L-configuration. beilstein:5251861|cas:98-79-3|drugbank:DB03088|gmelin:1125330|hmdb:HMDB0000267|kegg.compound:C01879|knapsack:C00007403|metacyc.compound:5-OXOPROLINE|pdb-ccd:PCA|pubmed:17439666|pubmed:22560249|pubmed:22619187|reaxys:82132|wikipedia.en:Pyroglutamic_acid|ymdb:YMDB00107 Graph (-)-2-pyrrolidone-5-carboxylic acid|(2S)-5-oxopyrrolidine-2-carboxylic acid|(S)-(-)-2-pyrrolidone-5-carboxylic acid|(S)-pyroglutamic acid|5-Oxo-L-proline|5-Pyrrolidone-2-carboxylic acid|5-oxo-L-proline|L-5-Pyrrolidone-2-carboxylic acid|L-Pyroglutamic acid|PYROGLUTAMIC ACID|Pyroglutamate|Pyroglutamic acid|pidolic acid (2S)-5-oxopyrrolidine-2-carboxylic acid|5-Oxo-L-proline|5-oxo-L-proline (-)-2-pyrrolidone-5-carboxylic acid|(2S)-5-oxopyrrolidine-2-carboxylic acid|(S)-(-)-2-pyrrolidone-5-carboxylic acid|(S)-pyroglutamic acid|5-Oxo-L-proline|5-Pyrrolidone-2-carboxylic acid|5-oxo-L-proline|L-5-Pyrrolidone-2-carboxylic acid|L-Pyroglutamic acid|PYROGLUTAMIC ACID|Pyroglutamate|Pyroglutamic acid|pidolic acid http://purl.obolibrary.org/obo/CHEBI_18183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18184 biolink:ChemicalEntity 3,5,3'-triiodothyropyruvic acid kegg.compound:C03832 Graph 3,5,3'-triiodophenylpyruvic acid|3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate|3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoic acid 3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate|3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoic acid 3,5,3'-triiodophenylpyruvic acid|3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate|3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoic acid http://purl.obolibrary.org/obo/CHEBI_18184 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18185 biolink:ChemicalEntity gamma-tocopherol A tocopherol in which the chroman-6-ol core is substituted by methyl groups at positions 7 and 8. It is found particularly in maize (corn) oil and soya bean (soybean) oils. agr:IND605428769|agr:IND607289207|cas:54-28-4|chemspider:83708|drugbank:DB15394|foodb.food:FDB002431|hmdb:HMDB0001492|kegg.compound:C02483|knapsack:C00007365|lipidmaps:LMPR02020065|metacyc.compound:GAMA-TOCOPHEROL|pubmed:10875465|pubmed:1146729|pubmed:11811542|pubmed:14871472|pubmed:14988604|pubmed:15189696|pubmed:15190048|pubmed:15213374|pubmed:15256801|pubmed:15493460|pubmed:15753151|pubmed:15932790|pubmed:16115338|pubmed:16336861|pubmed:16384840|pubmed:16400056|pubmed:16481153|pubmed:16875031|pubmed:17823432|pubmed:18582912|pubmed:19838939|pubmed:22411374|pubmed:22513202|pubmed:22607470|pubmed:22888664|pubmed:23429409|pubmed:2388136|pubmed:23993952|pubmed:25501796|pubmed:25916693|pubmed:28211759|pubmed:28506847|pubmed:28629117|pubmed:30361021|pubmed:31136626|pubmed:31583056|pubmed:31957471|pubmed:32065446|pubmed:32197490|pubmed:32488024|pubmed:33352218|pubmed:33549947|pubmed:6618108|pubmed:6875389|pubmed:6959572|pubmed:8514270|pubmed:9537614|pubmed:9808643|reaxys:93072|wikipedia.en:Gamma-Tocopherol Graph (+)-gamma-tocopherol|(2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol|(2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol|(2R)-3,4-dihydro-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol|(2R,4'R,8'R)-gamma-tocopherol|(R,R,R)-gamma-tocopherol|7,8-dimethyltocol|D-gamma-tocopherol|E308|Gamma-tocopherol|RRR-gamma-tocopherol|gamma-Tocopherol (2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol (+)-gamma-tocopherol|(2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-ol|(2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol|(2R)-3,4-dihydro-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol|(2R,4'R,8'R)-gamma-tocopherol|(R,R,R)-gamma-tocopherol|7,8-dimethyltocol|D-gamma-tocopherol|E308|Gamma-tocopherol|RRR-gamma-tocopherol|gamma-Tocopherol http://purl.obolibrary.org/obo/CHEBI_18185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18186 biolink:ChemicalEntity tyrosine An α-amino acid that is phenylalanine bearing a hydroxy substituent at position 4 on the phenyl ring. cas:55520-40-6|cas:556-03-6|gmelin:27744|kegg.compound:C01536|knapsack:C00001397|pubmed:17190852|reaxys:515881 Graph 2-Amino-3-(p-hydroxyphenyl)propionic acid|2-amino-3-(4-hydroxyphenyl)propanoic acid|3-(p-Hydroxyphenyl)alanine|Tyr|Tyrosin|Tyrosine|Y|tirosina|tyrosine Tyrosine|tyrosine 2-Amino-3-(p-hydroxyphenyl)propionic acid|2-amino-3-(4-hydroxyphenyl)propanoic acid|3-(p-Hydroxyphenyl)alanine|Tyr|Tyrosin|Tyrosine|Y|tirosina|tyrosine http://purl.obolibrary.org/obo/CHEBI_18186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18187 biolink:ChemicalEntity (E)-3,7,11,15-tetramethylhexadec-2-en-1-yl diphosphate hmdb:HMDB0011116 Graph (2E)-3,7,11,15-tetramethylhexadec-2-en-1-yl trihydrogen diphosphate (2E)-3,7,11,15-tetramethylhexadec-2-en-1-yl trihydrogen diphosphate (2E)-3,7,11,15-tetramethylhexadec-2-en-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_18187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18188 biolink:ChemicalEntity (S)-3-aminoisobutyrate kegg.compound:C03284|pdb-ccd:BIB Graph (2S)-3-amino-2-methylpropanoate|(S)-3-Amino-2-methylpropanoate|(S)-3-Amino-isobutanoate|(S)-3-Amino-isobutyrate|(S)-beta-aminoisobutyrate|BETA-AMINO ISOBUTYRATE|L-3-Amino-isobutanoate|L-3-Amino-isobutyrate|L-3-aminoisobutyrate (2S)-3-amino-2-methylpropanoate (2S)-3-amino-2-methylpropanoate|(S)-3-Amino-2-methylpropanoate|(S)-3-Amino-isobutanoate|(S)-3-Amino-isobutyrate|(S)-beta-aminoisobutyrate|BETA-AMINO ISOBUTYRATE|L-3-Amino-isobutanoate|L-3-Amino-isobutyrate|L-3-aminoisobutyrate http://purl.obolibrary.org/obo/CHEBI_18188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18191 biolink:ChemicalEntity thioredoxin disulfide A protein disulfide that is the oxidised form of a thioredoxin, in which two cysteine residues are joined by formation of a disulfide bridge. kegg.compound:C00343|pubmed:23121505 Graph Oxidized thioredoxin|Thioredoxin disulfide|Thioredoxin sulfide Oxidized thioredoxin|Thioredoxin disulfide|Thioredoxin sulfide http://purl.obolibrary.org/obo/CHEBI_18191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18193 biolink:ChemicalEntity 10-deacetylbaccatin III cas:32981-86-5|kegg.compound:C11700 Graph 10-Deacetylbaccatin III|10-deacetylbaccatin III|5beta,20-epoxy-1,7beta,10beta,13alpha-tetrahydroxy-9-oxotax-11-ene-2alpha,4alpha-diyl 4-acetate 2-benzoate 5beta,20-epoxy-1,7beta,10beta,13alpha-tetrahydroxy-9-oxotax-11-ene-2alpha,4alpha-diyl 4-acetate 2-benzoate 10-Deacetylbaccatin III|10-deacetylbaccatin III|5beta,20-epoxy-1,7beta,10beta,13alpha-tetrahydroxy-9-oxotax-11-ene-2alpha,4alpha-diyl 4-acetate 2-benzoate http://purl.obolibrary.org/obo/CHEBI_18193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18195 biolink:ChemicalEntity alpha,alpha'-trehalose 6,6'-bismycolate A trehalose mycolate compound consisting of two mycolate groups attached to the 6- and 6'-positions of α,α'-trehalose. kegg.compound:C04465|lipidmaps:LMFA01160002|pubmed:16341241 Graph 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranoside|Alpha,alpha'-trehalose 6,6'-bismycolate|alpha,alpha'-Trehalose 6,6'-bismycolate 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranoside 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranoside|Alpha,alpha'-trehalose 6,6'-bismycolate|alpha,alpha'-Trehalose 6,6'-bismycolate http://purl.obolibrary.org/obo/CHEBI_18195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18197 biolink:ChemicalEntity ditrans,polycis-undecaprenyl diphosphate An undecaprenyl diphosphate in which the eight double bonds closest to the phosphate group have Z configuration, while the next two double bonds have E configuration. kegg.compound:C04574 Graph (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl trihydrogen diphosphate|Bactoprenyl diphosphate|Undecaprenyl diphosphate|di-trans,poly-cis-Undecaprenyl diphosphate|di-trans,poly-cis-undecaprenyl diphosphate|ditrans,polycis-undecaprenyl diphosphate (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl trihydrogen diphosphate (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl trihydrogen diphosphate|Bactoprenyl diphosphate|Undecaprenyl diphosphate|di-trans,poly-cis-Undecaprenyl diphosphate|di-trans,poly-cis-undecaprenyl diphosphate|ditrans,polycis-undecaprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_18197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18198 biolink:ChemicalEntity 4-amino-4-deoxychorismic acid A dicarboxylic acid comprising chorismic acid having its 4-hydroxy group replaced by an amino group. kegg.compound:C11355|knapsack:C00000730|reaxys:4317064 Graph (3R,4R)-4-amino-3-[(1-carboxyethenyl)oxy]cyclohexa-1,5-diene-1-carboxylic acid|ADC (3R,4R)-4-amino-3-[(1-carboxyethenyl)oxy]cyclohexa-1,5-diene-1-carboxylic acid (3R,4R)-4-amino-3-[(1-carboxyethenyl)oxy]cyclohexa-1,5-diene-1-carboxylic acid|ADC http://purl.obolibrary.org/obo/CHEBI_18198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18199 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine UDP-glycopeptide having N-acetylmuramoyl as the glyco portion and L-alanyl-γ-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine as the peptide portion (attached via an amide bond between the amino terminus and the muramoyl carboxy group). kegg.compound:C04882|reaxys:10760092 Graph UDP-Mur2Ac-L-Ala-gamma-D-Glu-A2pm-D-Ala-D-Ala|UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine|UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine|UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine UDP-Mur2Ac-L-Ala-gamma-D-Glu-A2pm-D-Ala-D-Ala|UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine|UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine|UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_18199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18200 biolink:ChemicalEntity isoscoparin A C-glycosyl compound that consists of chrysoeriol substituted by a 1,5-anhydro-D-glucitol moiety at position 6. cas:20013-23-4|cba:464459|kegg.compound:C05990|knapsack:C00001058|lipidmaps:LMPK12110738|metacyc.compound:ISOSCOPARIN|pubmed:17655145|pubmed:18215689|pubmed:22529049|pubmed:32900444|pubmed:33164372|pubmed:35318616|pubmed:35638105|pubmed:36072835|pubmed:36845481|pubmed:4622942|reaxys:1444632 Graph (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol|6-beta-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one|C-glucosyl-6 chrysoeriol|chrysoeriol 6-C-glucoside|isoorientin 3'-O-methyl ether|isoorientin 3'-methyl ether|isoscoparin|isoscoparine (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol|6-beta-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one|C-glucosyl-6 chrysoeriol|chrysoeriol 6-C-glucoside|isoorientin 3'-O-methyl ether|isoorientin 3'-methyl ether|isoscoparin|isoscoparine http://purl.obolibrary.org/obo/CHEBI_18200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18202 biolink:ChemicalEntity L-iditol The L-enantiomer of iditol. cas:488-45-9|hmdb:HMDB0011632|kegg.compound:C01507|metacyc.compound:CPD-369|pubmed:13766585|pubmed:16346404|reaxys:1721900 Graph (2S,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol|L-Idit|L-Iditol|L-iditol L-Iditol|L-iditol (2S,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol|L-Idit|L-Iditol|L-iditol http://purl.obolibrary.org/obo/CHEBI_18202 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18203 biolink:ChemicalEntity penicillin N beilstein:56934|cas:525-94-0|drugcentral:3421|kegg.compound:C06564|knapsack:C00000780 Graph (2S,5R,6R)-6-[(5R)-5-amino-5-carboxypentanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6beta-[(5R)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid|Penicillin N|adicillin|cephalosporin N 6beta-[(5R)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid (2S,5R,6R)-6-[(5R)-5-amino-5-carboxypentanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6beta-[(5R)-5-amino-5-carboxypentanamido]-2,2-dimethylpenam-3alpha-carboxylic acid|Penicillin N|adicillin|cephalosporin N http://purl.obolibrary.org/obo/CHEBI_18203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18204 biolink:ChemicalEntity 16,17-didehydroprogesterone beilstein:1017308|cas:1096-38-4|kegg.compound:C03207 Graph 16,17-Didehydroprogesterone|16,17-didehydroprogesterone|16-Dehydroprogesterone|3,20-dioxopregna-4,16-diene|Delta(4,16)-pregnadiene-3,20-dione|pregna-4,16-diene-3,20-dione pregna-4,16-diene-3,20-dione 16,17-Didehydroprogesterone|16,17-didehydroprogesterone|16-Dehydroprogesterone|3,20-dioxopregna-4,16-diene|Delta(4,16)-pregnadiene-3,20-dione|pregna-4,16-diene-3,20-dione http://purl.obolibrary.org/obo/CHEBI_18204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18205 biolink:ChemicalEntity alpha-D-mannose 1-phosphate A D-mannose 1-phosphate with an α-configuration at the anomeric position. cas:15978-07-1|drugbank:DB17678|kegg.compound:C00636|knapsack:C00007389|metacyc.compound:MANNOSE-1P|pdb-ccd:M1P|pubmed:16540464|pubmed:9451026|reaxys:87855 Graph 1-O-phosphono-alpha-D-mannopyranose|alpha-D-Mannose 1-phosphate|alpha-D-mannopyranose 1-(dihydrogen phosphate)|alpha-D-mannose 1-phosphate alpha-D-mannopyranose 1-(dihydrogen phosphate) 1-O-phosphono-alpha-D-mannopyranose|alpha-D-Mannose 1-phosphate|alpha-D-mannopyranose 1-(dihydrogen phosphate)|alpha-D-mannose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_18205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18207 biolink:ChemicalEntity N-acetyl-D-galactosamine 6-phosphate A galactosamine phosphate that is N-acetyl-D-galactosamine substituted at position 1 by a monophosphate group. kegg.compound:C06376|metacyc.compound:N-ACETYL-D-GALACTOSAMINE-6-PHOSPHATE Graph 2-acetamido-2-deoxy-6-O-phosphono-D-galactose|N-Acetyl-D-galactosamine 6-phosphate 2-acetamido-2-deoxy-6-O-phosphono-D-galactose 2-acetamido-2-deoxy-6-O-phosphono-D-galactose|N-Acetyl-D-galactosamine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_18207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18208 biolink:ChemicalEntity benzylpenicillin A penicillin in which the substituent at position 6 of the penam ring is a phenylacetamido group. cas:61-33-6|drugbank:DB01053|drugcentral:2082|gmelin:781913|hmdb:HMDB0015186|kegg.compound:C05551|kegg.drug:D02336|lincs.smallmolecule:LSM-3229|patent:US3024169|pdb-ccd:PNN|pubmed:10930630|pubmed:11431418|pubmed:11906332|pubmed:12569987|pubmed:12850488|pubmed:1384868|pubmed:16033609|pubmed:1709917|pubmed:2083978|pubmed:24485692|pubmed:24631718|pubmed:25998949|pubmed:27731424|pubmed:29017833|pubmed:29355985|pubmed:6161899|pubmed:7602118|pubmed:7716788|reaxys:44740|wikipedia.en:Benzylpenicillin Graph (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylic acid|6-(2-phenylacetamido)penicillanic acid|Benzylpenicillin|PCG|PENICILLIN G|PG|Penicillin G|bencilpenicilina|bensylpenicillin|benzyl benicillin|benzylpenicillin|benzylpenicilline|benzylpenicillinic acid|benzylpenicillinum|free penicillin II 2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylic acid (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylic acid|6-(2-phenylacetamido)penicillanic acid|Benzylpenicillin|PCG|PENICILLIN G|PG|Penicillin G|bencilpenicilina|bensylpenicillin|benzyl benicillin|benzylpenicillin|benzylpenicilline|benzylpenicillinic acid|benzylpenicillinum|free penicillin II http://purl.obolibrary.org/obo/CHEBI_18208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18209 biolink:ChemicalEntity CoM-S-S-CoB kegg.compound:C04832|pdb-ccd:SHT Graph CoM-S-S-CoB|Coenzyme M 7-mercaptoheptanoylthreonine-phosphate heterodisulfide|Coenzyme M-HTP heterodisulfide|N-{7-[(2-Sulfoethyl)dithio]heptanoyl}-3-O-phospho-L-threonine|O-PHOSPHONO-N-{(2E)-7-[(2-SULFOETHYL)DITHIO]HEPT-2-ENOYL}-L-THREONINE|O-phosphono-N-{7-[(2-sulfoethyl)disulfanyl]heptanoyl}-L-threonine O-phosphono-N-{7-[(2-sulfoethyl)disulfanyl]heptanoyl}-L-threonine CoM-S-S-CoB|Coenzyme M 7-mercaptoheptanoylthreonine-phosphate heterodisulfide|Coenzyme M-HTP heterodisulfide|N-{7-[(2-Sulfoethyl)dithio]heptanoyl}-3-O-phospho-L-threonine|O-PHOSPHONO-N-{(2E)-7-[(2-SULFOETHYL)DITHIO]HEPT-2-ENOYL}-L-THREONINE|O-phosphono-N-{7-[(2-sulfoethyl)disulfanyl]heptanoyl}-L-threonine http://purl.obolibrary.org/obo/CHEBI_18209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18210 biolink:ChemicalEntity hyponitrite(2-) gmelin:130273|kegg.compound:C01818 Graph 2,3-diazy-1,4-dioxy-[4]catenate(2-)|Hyponitrite|[N2O2](2-)|[ON=NO](2-)|bis(oxidonitrate)(N--N)(2-)|diazenediolate|dioxido-1kappaO,2kappaO-dinitrate(N--N)(2-) 2,3-diazy-1,4-dioxy-[4]catenate(2-)|bis(oxidonitrate)(N--N)(2-)|diazenediolate|dioxido-1kappaO,2kappaO-dinitrate(N--N)(2-) 2,3-diazy-1,4-dioxy-[4]catenate(2-)|Hyponitrite|[N2O2](2-)|[ON=NO](2-)|bis(oxidonitrate)(N--N)(2-)|diazenediolate|dioxido-1kappaO,2kappaO-dinitrate(N--N)(2-) http://purl.obolibrary.org/obo/CHEBI_18210 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18211 biolink:ChemicalEntity citrulline The parent compound of the citrulline class consisting of ornithine having a carbamoyl group at the N5-position. beilstein:2328251|cas:627-77-0|pubmed:11094453|pubmed:11113071|pubmed:11696417|pubmed:1378088|pubmed:16082501|pubmed:16708633|pubmed:17005970|pubmed:17513438|pubmed:17558653|pubmed:17693747|pubmed:18437289|pubmed:18440672|pubmed:18989563|pubmed:19144577|pubmed:21129371|pubmed:21482070|reaxys:1725417|wikipedia.en:Citrulline Graph 2-Amino-5-uredovaleric acid|2-amino-5-(carbamoylamino)pentanoic acid|Cit|Citrullin|Citrulline|DL-2-amino-5-ureidovaleric acid|N(5)-(aminocarbonyl)-DL-ornithine|N(5)-(aminocarbonyl)ornithine|N(5)-carbamoyl-DL-ornithine|N(5)-carbamoylornithine|citrulina|citrulline|dl-citrulline 2-amino-5-(carbamoylamino)pentanoic acid|Citrulline|N(5)-carbamoylornithine|citrulline 2-Amino-5-uredovaleric acid|2-amino-5-(carbamoylamino)pentanoic acid|Cit|Citrullin|Citrulline|DL-2-amino-5-ureidovaleric acid|N(5)-(aminocarbonyl)-DL-ornithine|N(5)-(aminocarbonyl)ornithine|N(5)-carbamoyl-DL-ornithine|N(5)-carbamoylornithine|citrulina|citrulline|dl-citrulline http://purl.obolibrary.org/obo/CHEBI_18211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18212 biolink:ChemicalEntity selenite(2-) cas:14124-67-5|gmelin:100833|kegg.compound:C05684|umbbd.compound:c0741 Graph Selenit|Selenite|[SeO3](2-)|selenite|trioxidoselenate(2-)|trioxoselenate(2-)|trioxoselenate(IV) Selenite|selenite|trioxidoselenate(2-)|trioxoselenate(2-)|trioxoselenate(IV) Selenit|Selenite|[SeO3](2-)|selenite|trioxidoselenate(2-)|trioxoselenate(2-)|trioxoselenate(IV) http://purl.obolibrary.org/obo/CHEBI_18212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18215 biolink:ChemicalEntity syringetin A dimethoxyflavone that is myricetin in which the hydroxy groups at positions 3' and 5' have been replaced by methoxy groups. cas:4423-37-4|kegg.compound:C11620|knapsack:C00004767|lipidmaps:LMPK12112498|metacyc.compound:SYRINGETIN|pubmed:19784998|pubmed:21745360|pubmed:22980782|reaxys:344330|wikipedia.en:Syringetin Graph 3',5'-O-Dimethylmyricetin|3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavone|3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-chromen-4-one|Syringetin 3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-chromen-4-one 3',5'-O-Dimethylmyricetin|3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavone|3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-chromen-4-one|Syringetin http://purl.obolibrary.org/obo/CHEBI_18215 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182159 biolink:ChemicalEntity Cannabidivarin cas:24274-48-4|chemspider:9776426|drugbank:DB14050|kegg.compound:C20217 Graph 2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-propylbenzene-1,3-diol 2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-propylbenzene-1,3-diol 2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-propylbenzene-1,3-diol http://purl.obolibrary.org/obo/CHEBI_182159 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18216 biolink:ChemicalEntity alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine kegg.compound:C04911|kegg.glycan:G00110|pubmed:1371229|pubmed:1379980|pubmed:15546874|pubmed:16341241|pubmed:16758576|pubmed:19726417|pubmed:2457654|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:26405107|pubmed:28188832|pubmed:28416698|pubmed:6204642|pubmed:7693874|pubmed:8857725|wikipedia.en:GM1 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)1 (Cer)1|D-Galactosyl-1,3-beta-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosyl-N-acylsphingosine|D-Galactosyl-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosylceramide|GM1|GM1a|Gal(beta1-3)GalNAc(beta1-4)[Neu5Ac(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1Cer|alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')--N-acylsphing-4-enine|beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GM1|monosialo GM1|monosialoganglioside-GM1 (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)1 (Cer)1|D-Galactosyl-1,3-beta-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosyl-N-acylsphingosine|D-Galactosyl-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D-glucosylceramide|GM1|GM1a|Gal(beta1-3)GalNAc(beta1-4)[Neu5Ac(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1Cer|alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')--N-acylsphing-4-enine|beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GM1|monosialo GM1|monosialoganglioside-GM1 http://purl.obolibrary.org/obo/CHEBI_18216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18217 biolink:ChemicalEntity alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-D-GlcNAc An amino trisaccharide consisting of two D-galactose residues, linked α(1→3), and an N-acetyl-D-glucosamine residue, linked β(1→4), at the reducing end. beilstein:5322979|glygen:G27798EJ|glytoucan:G27798EJ|kegg.compound:C04847|kegg.glycan:G00304|pubmed:10096519|pubmed:10355731|pubmed:11549456|pubmed:12009948|pubmed:12544864|pubmed:16442513|pubmed:17991151|pubmed:19913595|pubmed:27261450|pubmed:28472163|pubmed:9741457|reaxys:5322979 Graph (Gal)2 (GlcNAc)1|Alpha-D-galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine|Galalpha1-3Galbeta1-4GlcNAc|alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine|alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-D-GlcNAc|alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-D-GlcpNAc|alpha-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|alpha-gal|alpha-gal trisaccharide|alphaGal1-3betaGal1-4GlcNAc|gal-alpha-1,3-gal-beta-1,4-GlcNAc alpha-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose (Gal)2 (GlcNAc)1|Alpha-D-galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine|Galalpha1-3Galbeta1-4GlcNAc|alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine|alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-D-GlcNAc|alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-D-GlcpNAc|alpha-D-galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose|alpha-gal|alpha-gal trisaccharide|alphaGal1-3betaGal1-4GlcNAc|gal-alpha-1,3-gal-beta-1,4-GlcNAc http://purl.obolibrary.org/obo/CHEBI_18217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18218 biolink:ChemicalEntity 2'-hydroxybiphenyl-2-sulfinate beilstein:8843408|umbbd.compound:c0060 Graph 2'-hydroxy-[1,1'-biphenyl]-2-sulfinate|2'-hydroxybiphenyl-2-sulfinate 2'-hydroxy-[1,1'-biphenyl]-2-sulfinate 2'-hydroxy-[1,1'-biphenyl]-2-sulfinate|2'-hydroxybiphenyl-2-sulfinate http://purl.obolibrary.org/obo/CHEBI_18218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18219 biolink:ChemicalEntity ammonium hydroxide A solution of ammonia in water. agr:IND44476209|agr:IND44570233|cas:1336-21-6|kegg.compound:C01358|kegg.drug:D04594|metacyc.compound:NH4OH|ppdb:34|pubmed:21145665|pubmed:21375888|pubmed:21450410|pubmed:21535717|pubmed:21535721|pubmed:21939976|pubmed:22532436|wikipedia.en:Ammonium_hydroxide Graph Ammonium hydroxide|Ammoniumhydroxid|E527|NH4OH|agua de amoniaco|ammonia aqueous|ammonia solution|ammonia water|ammoniaque|ammonium hydroxide|hidroxido de amonio|hydroxyde d'ammonium Ammonium hydroxide|ammonium hydroxide Ammonium hydroxide|Ammoniumhydroxid|E527|NH4OH|agua de amoniaco|ammonia aqueous|ammonia solution|ammonia water|ammoniaque|ammonium hydroxide|hidroxido de amonio|hydroxyde d'ammonium http://purl.obolibrary.org/obo/CHEBI_18219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18220 biolink:ChemicalEntity isoflavone A simplest member of the class of isoflavones that is 4H-chromen-4-one in which the hydrogen at position 3 is replaced by a phenyl group. cas:574-12-9|gmelin:1224833|kegg.compound:C00799|lipidmaps:LMPK12050000|reaxys:157731 Graph 3-Phenylchromone|3-phenyl-4H-1-benzopyran-4-one|3-phenyl-4H-chromen-4-one|Isoflavon|Isoflavone 3-phenyl-4H-chromen-4-one 3-Phenylchromone|3-phenyl-4H-1-benzopyran-4-one|3-phenyl-4H-chromen-4-one|Isoflavon|Isoflavone http://purl.obolibrary.org/obo/CHEBI_18220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18222 biolink:ChemicalEntity xylose An aldopentose, found in the embryos of most edible plants and used in medicine to test for malabsorption by administration in water to the patient. kegg.compound:C01394|wikipedia.en:Xylose Graph DL-xylose|Xyl|Xylose|xylo-pentose|xylose Xylose|xylo-pentose|xylose DL-xylose|Xyl|Xylose|xylo-pentose|xylose http://purl.obolibrary.org/obo/CHEBI_18222 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18224 biolink:ChemicalEntity isoeugenol A phenylpropanoid that is an isomer of eugenol in which the allyl substituent is replaced by a prop-1-enyl group. cas:97-54-1|gmelin:2235523|kegg.compound:C10469|pubmed:11033063|pubmed:17573874|pubmed:17698059|pubmed:18416757|pubmed:21969073|pubmed:21989800|pubmed:22613214|pubmed:22671430|pubmed:22686307|pubmed:22827268|pubmed:23047101|pubmed:23161090|pubmed:23281757|pubmed:23286982|pubmed:23306890|pubmed:23391906|pubmed:23627552|pubmed:29079364|pubmed:9084914|reaxys:1909602|wikipedia.en:Isoeugenol Graph 1-Hydroxy-2-methoxy-4-propen-1-ylbenzene|1-Hydroxy-2-methoxy-4-propenylbenzene|2-Methoxy-4-propenylphenol|2-methoxy-4-(prop-1-en-1-yl)phenol|3-Methoxy-4-hydroxypropenylbenzene|4-Hydroxy-3-methoxypropenylbenzene|4-Propenylguaiacol|Isoeugenol|Propenylguaiacol|isoeugenol 2-methoxy-4-(prop-1-en-1-yl)phenol 1-Hydroxy-2-methoxy-4-propen-1-ylbenzene|1-Hydroxy-2-methoxy-4-propenylbenzene|2-Methoxy-4-propenylphenol|2-methoxy-4-(prop-1-en-1-yl)phenol|3-Methoxy-4-hydroxypropenylbenzene|4-Hydroxy-3-methoxypropenylbenzene|4-Propenylguaiacol|Isoeugenol|Propenylguaiacol|isoeugenol http://purl.obolibrary.org/obo/CHEBI_18224 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18225 biolink:ChemicalEntity myo-inositol 1,3-bisphosphate cas:103597-56-4|drugbank:DB02942|kegg.compound:C04062|pdb-ccd:ITP Graph 1D-myo-Inositol 1,3-bisphosphate|D-myo-Inositol 1,3-bisphosphate|Inositol 1,3-bisphosphate|PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-5-PHOSPHONOOXY-CYCLOHEXYL) ESTER|myo-Inositol 1,3-bisphosphate|myo-inositol 1,3-bis(dihydrogen phosphate) myo-inositol 1,3-bis(dihydrogen phosphate) 1D-myo-Inositol 1,3-bisphosphate|D-myo-Inositol 1,3-bisphosphate|Inositol 1,3-bisphosphate|PHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-5-PHOSPHONOOXY-CYCLOHEXYL) ESTER|myo-Inositol 1,3-bisphosphate|myo-inositol 1,3-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18226 biolink:ChemicalEntity (R)-6-hydroxynicotine kegg.compound:C03043|umbbd.compound:c0470 Graph (R)-5-(1-methyl-pyrrolidin-2-yl)-1H-pyridin-2-one|(R)-5-(1-methyl-pyrrolidin-2-yl)-pyridin-2-ol|(R)-6-Hydroxynicotine|5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol|d-6-hydroxynicotine 5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol (R)-5-(1-methyl-pyrrolidin-2-yl)-1H-pyridin-2-one|(R)-5-(1-methyl-pyrrolidin-2-yl)-pyridin-2-ol|(R)-6-Hydroxynicotine|5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol|d-6-hydroxynicotine http://purl.obolibrary.org/obo/CHEBI_18226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18227 biolink:ChemicalEntity sterigmatocystin An organic heteropentacyclic compound whose skeleton comprises a xanthene ring system ortho-fused to a dihydrofuranofuran moiety. The parent of the class of sterigmatocystins. cas:10048-13-2|kegg.compound:C00961|knapsack:C00000563|lipidmaps:LMPK10000001|pubmed:11727790|pubmed:12739707|pubmed:15283159|pubmed:15968996|pubmed:17540384|pubmed:19998385|pubmed:20929267|pubmed:21119680|pubmed:21431817|pubmed:21530923|pubmed:21688557|reaxys:1299458|wikipedia.en:Sterigmatocystin Graph (3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|Sterigmatocystin|sterigmatocystin (3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one (3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|Sterigmatocystin|sterigmatocystin http://purl.obolibrary.org/obo/CHEBI_18227 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18228 biolink:ChemicalEntity 1D-myo-inositol 1,3,4-trisphosphate kegg.compound:C01243|pdb-ccd:I3S Graph (1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-INOSITOL|1D-myo-Inositol 1,3,4-trisphosphate|1D-myo-inositol 1,3,4-tris(dihydrogen phosphate)|1D-myo-inositol 1,3,4-trisphosphate|D-myo-Inositol 1,3,4-trisphosphate|Inositol 1,3,4-trisphosphate 1D-myo-inositol 1,3,4-tris(dihydrogen phosphate) (1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-INOSITOL|1D-myo-Inositol 1,3,4-trisphosphate|1D-myo-inositol 1,3,4-tris(dihydrogen phosphate)|1D-myo-inositol 1,3,4-trisphosphate|D-myo-Inositol 1,3,4-trisphosphate|Inositol 1,3,4-trisphosphate http://purl.obolibrary.org/obo/CHEBI_18228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18229 biolink:ChemicalEntity deacetoxycephalosporin C cas:26924-74-3|drugbank:DB03938|kegg.compound:C06565|pdb-ccd:P1C Graph (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|DAOC|De(acetyloxy)cephalosporin C|Deacetoxycephalosporin C|Desacetoxycephalosphorin C (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-7-{[(5R)-5-amino-5-carboxypentanoyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|DAOC|De(acetyloxy)cephalosporin C|Deacetoxycephalosporin C|Desacetoxycephalosphorin C http://purl.obolibrary.org/obo/CHEBI_18229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18230 biolink:ChemicalEntity chlorophyll a beilstein:1208847|beilstein:4651978|cas:479-61-8|drugbank:DB02133|gmelin:475109|kegg.compound:C05306|knapsack:C00001528|pdb-ccd:CLA Graph (SP-4-2)-((2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecenyl (3S,4S,21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(2-)-kappaN(23),kappaN(24),kappaN(25),kappaN(26))-magnesium|CHLOROPHYLL A|Chlorophyll|Chlorophyll a|[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl (2(2)R,17S,18S)-7-ethyl-2(1),2(2),17,18-tetrahydro-2(2)-(methoxycarbonyl)-3,8,13,17-tetramethyl-2(1)-oxo-12-ethenylcyclopenta[at]porphyrin-18-propanoato(2-)]magnesium [(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl (2(2)R,17S,18S)-7-ethyl-2(1),2(2),17,18-tetrahydro-2(2)-(methoxycarbonyl)-3,8,13,17-tetramethyl-2(1)-oxo-12-ethenylcyclopenta[at]porphyrin-18-propanoato(2-)]magnesium (SP-4-2)-((2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecenyl (3S,4S,21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(2-)-kappaN(23),kappaN(24),kappaN(25),kappaN(26))-magnesium|CHLOROPHYLL A|Chlorophyll|Chlorophyll a|[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl (2(2)R,17S,18S)-7-ethyl-2(1),2(2),17,18-tetrahydro-2(2)-(methoxycarbonyl)-3,8,13,17-tetramethyl-2(1)-oxo-12-ethenylcyclopenta[at]porphyrin-18-propanoato(2-)]magnesium http://purl.obolibrary.org/obo/CHEBI_18230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18231 biolink:ChemicalEntity arsenic acid An arsenic oxoacid comprising one oxo group and three hydroxy groups attached to a central arsenic atom. cas:7778-39-4|gmelin:2294|kegg.compound:C01478|ppdb:2913 Graph Arsenic acid|H3AsO4|Orthoarsenic acid|[AsO(OH)3]|arsenic acid|arsoric acid|tetraoxoarsenic acid|trihydrogen tetraoxoarsenate|trihydroxidooxidoarsenic tetraoxoarsenic acid|trihydrogen tetraoxoarsenate|trihydroxidooxidoarsenic Arsenic acid|H3AsO4|Orthoarsenic acid|[AsO(OH)3]|arsenic acid|arsoric acid|tetraoxoarsenic acid|trihydrogen tetraoxoarsenate|trihydroxidooxidoarsenic http://purl.obolibrary.org/obo/CHEBI_18231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18232 biolink:ChemicalEntity D-galactosamine 6-phosphate kegg.compound:C06377|metacyc.compound:D-GALACTOSAMINE-6-PHOSPHATE|pubmed:15133084|pubmed:16630633|pubmed:3102459|pubmed:8054717|reaxys:4143677 Graph 2-amino-2-deoxy-6-O-phosphono-D-galactopyranose|2-amino-2-deoxy-D-galactopyranose 6-(dihydrogen phosphate)|D-Galactosamine 6-phosphate 2-amino-2-deoxy-6-O-phosphono-D-galactopyranose|2-amino-2-deoxy-D-galactopyranose 6-(dihydrogen phosphate) 2-amino-2-deoxy-6-O-phosphono-D-galactopyranose|2-amino-2-deoxy-D-galactopyranose 6-(dihydrogen phosphate)|D-Galactosamine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_18232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18233 biolink:ChemicalEntity xyloglucan A glucan that consists of a backbone of α-(1→4)-linked glucose residues, most of which are substituted with (1→6)-linked xylose side-chains. kegg.compound:C00807|wikipedia.en:Xyloglucan Graph Xyloglucan|xyloglucan Xyloglucan|xyloglucan http://purl.obolibrary.org/obo/CHEBI_18233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18234 biolink:ChemicalEntity alpha,alpha'-trehalose 6-mycolate A trehalose monomycolate comprising α,α'-trehalose having the mycolate group attached to the 6-position. kegg.compound:C04218|lipidmaps:LMFA01160001 Graph 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside|Alpha,alpha'-trehalose 6-mycolate|alpha,alpha'-Trehalose 6-mycolate 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside 6-O-[(11E)-3-hydroxy-2-tetradecyloctadec-11-enoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside|Alpha,alpha'-trehalose 6-mycolate|alpha,alpha'-Trehalose 6-mycolate http://purl.obolibrary.org/obo/CHEBI_18234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18236 biolink:ChemicalEntity 6-demethylsterigmatocystin cas:30461-65-5|kegg.compound:C03683|lipidmaps:LMPK10000002 Graph (3aR,12cS)-6,8-dihydroxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|6-Demethylsterigmatocystin|6-demethylsterigmatocystin|demethylsterigmatocystin (3aR,12cS)-6,8-dihydroxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one (3aR,12cS)-6,8-dihydroxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|6-Demethylsterigmatocystin|6-demethylsterigmatocystin|demethylsterigmatocystin http://purl.obolibrary.org/obo/CHEBI_18236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18237 biolink:ChemicalEntity glutamic acid An α-amino acid that is glutaric acid bearing a single amino substituent at position 2. cas:617-65-2|gmelin:101971|kegg.compound:C00302|kegg.drug:D04341|knapsack:C00001358|knapsack:C00019577|pubmed:15739367|pubmed:17190852|pubmed:24616376|pubmed:24984001|reaxys:1723799|wikipedia.en:Glutamic_acid Graph 2-Aminoglutaric acid|2-aminopentanedioic acid|DL-Glutamic acid|DL-Glutaminic acid|E|Glu|Glutamate|Glutamic acid|Glutaminic acid|Glutaminsaeure|glutamic acid 2-aminopentanedioic acid|glutamic acid 2-Aminoglutaric acid|2-aminopentanedioic acid|DL-Glutamic acid|DL-Glutaminic acid|E|Glu|Glutamate|Glutamic acid|Glutaminic acid|Glutaminsaeure|glutamic acid http://purl.obolibrary.org/obo/CHEBI_18237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18240 biolink:ChemicalEntity 4-hydroxy-L-proline The L-stereoisomer of 4-hydroxyproline. cas:51-35-4|hmdb:HMDB0006055|kegg.compound:C01015|knapsack:C00001370|reaxys:81441|wikipedia.en:4-hydroxy-L-proline Graph (2S)-4-hydroxypyrrolidine-2-carboxylic acid|4-Hydroxy-L-proline|4-hydroxy-L-proline|L-Hydroxyproline|cis-4-Hydroxy-L-Proline|hydroxy-L-proline 4-Hydroxy-L-proline|4-hydroxy-L-proline (2S)-4-hydroxypyrrolidine-2-carboxylic acid|4-Hydroxy-L-proline|4-hydroxy-L-proline|L-Hydroxyproline|cis-4-Hydroxy-L-Proline|hydroxy-L-proline http://purl.obolibrary.org/obo/CHEBI_18240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18241 biolink:ChemicalEntity 2'-deoxynucleoside 5'-phosphate A 2'-deoxyribonucleoside monophosphate compound with the phosphate group in the 5'-position. kegg.compound:C00676|kegg.compound:C03607 Graph 2'-Deoxynucleoside 5'-monophosphate|2'-Deoxynucleoside 5'-phosphate|2'-deoxyribonucleoside 5'-monophosphates|Deoxynucleoside 5'-phosphate|Deoxynucleoside phosphate 2'-Deoxynucleoside 5'-monophosphate|2'-Deoxynucleoside 5'-phosphate|2'-deoxyribonucleoside 5'-monophosphates|Deoxynucleoside 5'-phosphate|Deoxynucleoside phosphate http://purl.obolibrary.org/obo/CHEBI_18241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18242 biolink:ChemicalEntity cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid kegg.compound:C06579|umbbd.compound:c0379 Graph (2S,3R)-2,3-dihydroxy-2,3-dihydro-p-cumate|cis-2,3-Dihydroxy-2,3-dihydro-p-cumate|cis-5,6-Dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate|rel-(5R,6S)-5,6-dihydroxy-4-(propan-2-yl)cyclohexa-1,3-diene-1-carboxylic acid rel-(5R,6S)-5,6-dihydroxy-4-(propan-2-yl)cyclohexa-1,3-diene-1-carboxylic acid (2S,3R)-2,3-dihydroxy-2,3-dihydro-p-cumate|cis-2,3-Dihydroxy-2,3-dihydro-p-cumate|cis-5,6-Dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate|rel-(5R,6S)-5,6-dihydroxy-4-(propan-2-yl)cyclohexa-1,3-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18242 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182421 biolink:ChemicalEntity 4-Aminobenzamide cas:2835-68-9|chemspider:68568 Graph 4-aminobenzamide 4-aminobenzamide 4-aminobenzamide http://purl.obolibrary.org/obo/CHEBI_182421 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18243 biolink:ChemicalEntity dopamine Catechol in which the hydrogen at position 4 is substituted by a 2-aminoethyl group. cas:51-61-6|drugbank:DB00988|drugcentral:947|hmdb:HMDB0000073|kegg.compound:C03758|kegg.drug:D07870|knapsack:C00001408|lincs.smallmolecule:LSM-4630|metacyc.compound:DOPAMINE|pubmed:10629745|pubmed:11149432|pubmed:9422813|reaxys:1072822|wikipedia.en:Dopamine Graph 2-(3,4-Dihydroxyphenyl)ethylamine|2-(3,4-dihydroxyphenyl)ethylamine|3,4-Dihydroxyphenethylamine|3-Hydroxytyramine|4-(2-Aminoethyl)-1,2-benzenediol|4-(2-Aminoethyl)benzene-1,2-diol|4-(2-aminoethyl)-1,2-benzenediol|4-(2-aminoethyl)benzene-1,2-diol|4-(2-aminoethyl)catechol|4-(2-aminoethyl)pyrocatechol|Deoxyepinephrine|Dopamine|Hydroxytyramin|dopamina|dopamine|dopaminum 4-(2-Aminoethyl)benzene-1,2-diol|4-(2-aminoethyl)benzene-1,2-diol 2-(3,4-Dihydroxyphenyl)ethylamine|2-(3,4-dihydroxyphenyl)ethylamine|3,4-Dihydroxyphenethylamine|3-Hydroxytyramine|4-(2-Aminoethyl)-1,2-benzenediol|4-(2-Aminoethyl)benzene-1,2-diol|4-(2-aminoethyl)-1,2-benzenediol|4-(2-aminoethyl)benzene-1,2-diol|4-(2-aminoethyl)catechol|4-(2-aminoethyl)pyrocatechol|Deoxyepinephrine|Dopamine|Hydroxytyramin|dopamina|dopamine|dopaminum http://purl.obolibrary.org/obo/CHEBI_18243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18244 biolink:ChemicalEntity 1-alkyl-sn-glycero-3-phosphoethanolamine A glycerophosphoethanolamine that is sn-glycero-3-phosphoethanolamine carrying any alkyl substituent at position 1. kegg.compound:C04476 Graph 1-Alkyl-2-lyso-sn-glycero-3-phosphoethanolamine|1-alkyl-sn-glycero-3-phosphoethanolamines|1-alkylglycerophosphoethanolamine|1-alkylglycerophosphoethanolamines 1-Alkyl-2-lyso-sn-glycero-3-phosphoethanolamine|1-alkyl-sn-glycero-3-phosphoethanolamines|1-alkylglycerophosphoethanolamine|1-alkylglycerophosphoethanolamines http://purl.obolibrary.org/obo/CHEBI_18244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18246 biolink:ChemicalEntity (1->4)-beta-D-glucan A β-D-glucan in which the glucose units are connected by (1→4) linkages. cas:9004-34-6|hmdb:HMDB0006944|kegg.compound:C00760|kegg.drug:D00093|kegg.glycan:G10481 Graph (1,4-beta-D-Glucosyl)n|(1,4-beta-D-Glucosyl)n+1|(1,4-beta-D-Glucosyl)n-1|(1,4-beta-D-glucosyl)(n)|(1,4-beta-D-glucosyl)n|(1->4)-beta-D-glucopyranan|1,4-beta-D-Glucan|Cellulose (1->4)-beta-D-glucopyranan (1,4-beta-D-Glucosyl)n|(1,4-beta-D-Glucosyl)n+1|(1,4-beta-D-Glucosyl)n-1|(1,4-beta-D-glucosyl)(n)|(1,4-beta-D-glucosyl)n|(1->4)-beta-D-glucopyranan|1,4-beta-D-Glucan|Cellulose http://purl.obolibrary.org/obo/CHEBI_18246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18247 biolink:ChemicalEntity 5-amino-6-(5-phospho-D-ribitylamino)uracil 5-O-Phosphono-D-ribitol in which the hydroxy group at position 1 is substituted by the 6-amino group of 5,6-diaminopyrimidine-2,4(1H,3H)-dione. beilstein:6445473|kegg.compound:C04454 Graph 1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-5-O-phosphono-D-ribitol|1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-D-ribitol 5-(dihydrogen phosphate)|1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-5-O-phosphono-D-ribitol|5-Amino-2,6-dioxy-4-(5'-phospho-D-ribitylamino)pyrimidine|5-Amino-2,6-dioxy-4-(5'-phosphoribitylamino)pyrimidine|5-Amino-6-(5'-phosphoribitylamino)uracil|5-Amino-6-(5-phospho-D-ribitylamino)uracil|5-Amino-6-(5-phosphoribitylamino)uracil 1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-5-O-phosphono-D-ribitol|1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-D-ribitol 5-(dihydrogen phosphate)|1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-5-O-phosphono-D-ribitol 1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-5-O-phosphono-D-ribitol|1-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-ylamino)-1-deoxy-D-ribitol 5-(dihydrogen phosphate)|1-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-1-deoxy-5-O-phosphono-D-ribitol|5-Amino-2,6-dioxy-4-(5'-phospho-D-ribitylamino)pyrimidine|5-Amino-2,6-dioxy-4-(5'-phosphoribitylamino)pyrimidine|5-Amino-6-(5'-phosphoribitylamino)uracil|5-Amino-6-(5-phospho-D-ribitylamino)uracil|5-Amino-6-(5-phosphoribitylamino)uracil http://purl.obolibrary.org/obo/CHEBI_18247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18248 biolink:ChemicalEntity iron atom An iron group element atom that has atomic number 26. cas:7439-89-6|drugbank:DB01592|hmdb:HMDB0015531|kegg.compound:C00023|reaxys:4122945|webelements:Fe Graph 26Fe|Eisen|Fe|Iron|fer|ferrum|hierro|iron Iron|iron 26Fe|Eisen|Fe|Iron|fer|ferrum|hierro|iron http://purl.obolibrary.org/obo/CHEBI_18248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182489 biolink:ChemicalEntity 2,3-Bis(3-hydroxybenzyl)butane-1,4-diol cas:76543-16-3|chemspider:110294 Graph 2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol 2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol 2,3-bis[(3-hydroxyphenyl)methyl]butane-1,4-diol http://purl.obolibrary.org/obo/CHEBI_182489 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18249 biolink:ChemicalEntity ergosta-5,7,22,24(28)-tetraen-3beta-ol A 3β-sterol having double bonds in the 5-, 7- and 22-positions and a methylene group at position 24. beilstein:2397531|kegg.compound:C05440 Graph (22E)-24-methylcholesta-5,7,22,24(24(1))-tetraen-3beta-ol|(22E)-ergosta-5,7,22,24(28)-tetraen-3beta-ol|5,7,22,24(28)-Ergostatetraenol|Ergosta-5,7,22,24(24(1))-tetraen-3beta-ol|Ergosta-5,7,22,24(241)-tetraen-3beta-ol|Ergosta-5,7,22,24(28)-tetraen-3beta-ol|ergosta-5,7,22,24(28)-tetraen-3-beta-ol (22E)-ergosta-5,7,22,24(28)-tetraen-3beta-ol (22E)-24-methylcholesta-5,7,22,24(24(1))-tetraen-3beta-ol|(22E)-ergosta-5,7,22,24(28)-tetraen-3beta-ol|5,7,22,24(28)-Ergostatetraenol|Ergosta-5,7,22,24(24(1))-tetraen-3beta-ol|Ergosta-5,7,22,24(241)-tetraen-3beta-ol|Ergosta-5,7,22,24(28)-tetraen-3beta-ol|ergosta-5,7,22,24(28)-tetraen-3-beta-ol http://purl.obolibrary.org/obo/CHEBI_18249 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18250 biolink:ChemicalEntity chondroitin 4'-sulfate A chondroitin sulfate in which the site of sulfation is carbon 4 of the N-acetylgalactosamine (GalNAc) sugar. cas:24967-93-9|kegg.compound:C00634|kegg.drug:D00080|metacyc.compound:Chondroitin-Sulfate-A|pubmed:7538297|reaxys:8611783 Graph Chondroitin 4'-sulfate|Chondroitin 4-sulfate|Chondroitin sulfate A|chondroitin 4-(hydrogen sulfate)|chondroitin A sulfate|chondroitin sulfate type A Chondroitin 4'-sulfate|Chondroitin 4-sulfate|Chondroitin sulfate A|chondroitin 4-(hydrogen sulfate)|chondroitin A sulfate|chondroitin sulfate type A http://purl.obolibrary.org/obo/CHEBI_18250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18251 biolink:ChemicalEntity UDP-D-galactofuranose Graph uridine 5'-[3-(D-galactofuranosyl) dihydrogen diphosphate] uridine 5'-[3-(D-galactofuranosyl) dihydrogen diphosphate] uridine 5'-[3-(D-galactofuranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_18251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18252 biolink:ChemicalEntity zymosterol beilstein:2568614|cas:128-33-6|kegg.compound:C05437|knapsack:C00023749|lipidmaps:LMST01010066 Graph 5alpha-Cholesta-8,24-dien-3beta-ol|5alpha-cholesta-8,24-dien-3beta-ol|Zymosterol|delta8,24-Cholestadien-3beta-ol|zymosterol|zymostrol 5alpha-Cholesta-8,24-dien-3beta-ol|5alpha-cholesta-8,24-dien-3beta-ol 5alpha-Cholesta-8,24-dien-3beta-ol|5alpha-cholesta-8,24-dien-3beta-ol|Zymosterol|delta8,24-Cholestadien-3beta-ol|zymosterol|zymostrol http://purl.obolibrary.org/obo/CHEBI_18252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18253 biolink:ChemicalEntity 5-guanidino-2-oxopentanoate kegg.compound:C03771 Graph 2-oxo-5-guanidino-pentanoate|2-oxo-5-guanidinopentanoate|5-carbamimidamido-2-oxopentanoate|5-guanidino-2-oxopentanoate 5-carbamimidamido-2-oxopentanoate 2-oxo-5-guanidino-pentanoate|2-oxo-5-guanidinopentanoate|5-carbamimidamido-2-oxopentanoate|5-guanidino-2-oxopentanoate http://purl.obolibrary.org/obo/CHEBI_18253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182530 biolink:ChemicalEntity 6-O-Methyl-N-deacetylisoipecoside aglycon kegg.compound:C21583 Graph methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3,4-dihydro-2H-pyran-5-carboxylate methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3,4-dihydro-2H-pyran-5-carboxylate methyl (2R,3R,4S)-3-ethenyl-2-hydroxy-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3,4-dihydro-2H-pyran-5-carboxylate http://purl.obolibrary.org/obo/CHEBI_182530 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18254 biolink:ChemicalEntity ribonucleoside Any nucleoside where the sugar component is D-ribose. kegg.compound:C00911 Graph Ribonucleoside|a ribonucleoside|ribonucleosides Ribonucleoside|a ribonucleoside|ribonucleosides http://purl.obolibrary.org/obo/CHEBI_18254 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18256 biolink:ChemicalEntity 4-formylbenzenesulfonic acid beilstein:2718823|cas:5363-54-2|kegg.compound:C06679 Graph 4-Formylbenzenesulfonate|4-Sulfobenzaldehyde|4-formylbenzenesulfonic acid|p-formylbenzenesulphonic acid 4-Formylbenzenesulfonate|4-formylbenzenesulfonic acid 4-Formylbenzenesulfonate|4-Sulfobenzaldehyde|4-formylbenzenesulfonic acid|p-formylbenzenesulphonic acid http://purl.obolibrary.org/obo/CHEBI_18256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18257 biolink:ChemicalEntity ornithine An α-amino acid that is pentanoic acid bearing two amino substituents at positions 2 and 5. cas:616-07-9|gmelin:847696|kegg.compound:C01602|knapsack:C00001384|pubmed:15449570|pubmed:17190852|pubmed:22264337|reaxys:1722296 Graph 2,5-Diaminopentanoic acid|2,5-Diaminovaleric acid|2,5-diaminopentanoic acid|DL-Ornithine|Orn|Ornithine|ornithine 2,5-Diaminopentanoic acid|2,5-diaminopentanoic acid|Ornithine|ornithine 2,5-Diaminopentanoic acid|2,5-Diaminovaleric acid|2,5-diaminopentanoic acid|DL-Ornithine|Orn|Ornithine|ornithine http://purl.obolibrary.org/obo/CHEBI_18257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18258 biolink:ChemicalEntity 3,3',5-triiodo-L-thyronine An iodothyronine compound having iodo substituents at the 3-, 3'- and 5-positions. Although some is produced in the thyroid, most of the 3,3',5-triiodo-L-thyronine in the body is generated by mono-deiodination of L-thyroxine in the peripheral tissues. Its metabolic activity is about 3 to 5 times that of L-thyroxine. The sodium salt is used in the treatment of hypothyroidism. cas:6893-02-3|drugbank:DB00279|drugcentral:1585|hmdb:HMDB0000265|kegg.compound:C02465|kegg.drug:D08128|lincs.smallmolecule:LSM-3991|pdb-ccd:T3|pubmed:11738632|pubmed:15206581|pubmed:19339791|reaxys:2710227|wikipedia.en:Triiodothyronine Graph 3,3',5-triiodo-L-thyronine|3,5,3'-Triiodo-L-thyronine|3,5,3'-Triiodothyronine|3,5,3'TRIIODOTHYRONINE|4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-L-phenylalanine|L-3,3',5-triiodothyronine|L-3,5,3'-Triiodothyronine|L-T3|L-triiodothyronine|Liothyronine|O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-L-tyrosine|T3|Tertroxin|Tresitope|Triiodothyronine|liothyronine|liothyroninum|liotironina 3,3',5-triiodo-L-thyronine 3,3',5-triiodo-L-thyronine|3,5,3'-Triiodo-L-thyronine|3,5,3'-Triiodothyronine|3,5,3'TRIIODOTHYRONINE|4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-L-phenylalanine|L-3,3',5-triiodothyronine|L-3,5,3'-Triiodothyronine|L-T3|L-triiodothyronine|Liothyronine|O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-L-tyrosine|T3|Tertroxin|Tresitope|Triiodothyronine|liothyronine|liothyroninum|liotironina http://purl.obolibrary.org/obo/CHEBI_18258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18259 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide A glycotetraosylceramide having N-acetyl-β-D-galactosaminyl-(1→3)-α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucose as the tetrasaccharide component. cas:11034-93-8|kegg.compound:C03272|kegg.glycan:G00094|pubmed:1528196|pubmed:15495792|pubmed:15661151|pubmed:1601891|pubmed:1724444|pubmed:21252262|pubmed:21376640|pubmed:2448252|pubmed:2456994|pubmed:3220436|pubmed:4026313|pubmed:7287743|pubmed:7690848|pubmed:7691279|pubmed:8161226 Graph (Gal)2 (GalNAc)1 (Glc)1 (Cer)1|CTH/Gb4|GalNAc-1->3-Gal-1->4-Gal-1->4-Glc-Cer|GalNAcbeta1-3-Galalpha1-4Galbeta1-4Glcbeta1-1Cer|Gb4 Globoside|Gb4 Globotetraosyl ceramide|Gb4Cer|GbOse4Cer|Gbose4Cer|Globoside GL-4|Globoside I|Globotetraosyl ceramide|N-Acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-Acetyl-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-D-galactosaminyl-(1->3)-D-galactosyl-(1->4)-D-galactosyl-(1->4)-D-glucosylceramides|Slt-iiv receptor|VT2vp1 Receptor|a globoside Gb4Cer (d18:1(4E))|beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide (Gal)2 (GalNAc)1 (Glc)1 (Cer)1|CTH/Gb4|GalNAc-1->3-Gal-1->4-Gal-1->4-Glc-Cer|GalNAcbeta1-3-Galalpha1-4Galbeta1-4Glcbeta1-1Cer|Gb4 Globoside|Gb4 Globotetraosyl ceramide|Gb4Cer|GbOse4Cer|Gbose4Cer|Globoside GL-4|Globoside I|Globotetraosyl ceramide|N-Acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-Acetyl-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-D-galactosaminyl-(1->3)-D-galactosyl-(1->4)-D-galactosyl-(1->4)-D-glucosylceramides|Slt-iiv receptor|VT2vp1 Receptor|a globoside Gb4Cer (d18:1(4E))|beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer http://purl.obolibrary.org/obo/CHEBI_18259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18261 biolink:ChemicalEntity N-carbamoyl-beta-alanine A β-alanine derivative that is propionic acid bearing a ureido group at position 3. cas:462-88-4|gmelin:675230|hmdb:HMDB0000026|kegg.compound:C02642|metacyc.compound:3-UREIDO-PROPIONATE|pdb-ccd:URP|pubmed:1536562|pubmed:17190852|pubmed:22770225|reaxys:1705263|wikipedia.en:3-Ureidopropionic_acid Graph 3-(carbamoylamino)propanoic acid|3-Ureidopropanoate|3-Ureidopropionate|3-Ureidopropionic acid|3-[(aminocarbonyl)amino]propanoic acid|3-ureidopropanoic acid|N-(AMINOCARBONYL)-BETA-ALANINE|N-(aminocarbonyl)-beta-alanine|N-Carbamoyl-beta-alanine|N-carbamoyl-beta-alanine|Ureidopropanoic acid|Ureidopropionic acid|beta-Ureidopropionic acid 3-(carbamoylamino)propanoic acid|N-Carbamoyl-beta-alanine|N-carbamoyl-beta-alanine 3-(carbamoylamino)propanoic acid|3-Ureidopropanoate|3-Ureidopropionate|3-Ureidopropionic acid|3-[(aminocarbonyl)amino]propanoic acid|3-ureidopropanoic acid|N-(AMINOCARBONYL)-BETA-ALANINE|N-(aminocarbonyl)-beta-alanine|N-Carbamoyl-beta-alanine|N-carbamoyl-beta-alanine|Ureidopropanoic acid|Ureidopropionic acid|beta-Ureidopropionic acid http://purl.obolibrary.org/obo/CHEBI_18261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18262 biolink:ChemicalEntity dodecanoate A medium-chain fatty acid anion that is the conjugate base of dodecanoic acid (lauric acid); major species at pH 7.3. gmelin:333430|kegg.compound:C02679|metacyc.compound:DODECANOATE|reaxys:3588839 Graph 1-undecanecarboxylate|C12 fatty acid anion|CH3-[CH2]10-COO(-)|dodecanoate|dodecoate|dodecylate|duodecyclate|duodecylate|laurate|laurostearate|n-dodecanoate|undecane-1-carboxylate|vulvate dodecanoate 1-undecanecarboxylate|C12 fatty acid anion|CH3-[CH2]10-COO(-)|dodecanoate|dodecoate|dodecylate|duodecyclate|duodecylate|laurate|laurostearate|n-dodecanoate|undecane-1-carboxylate|vulvate http://purl.obolibrary.org/obo/CHEBI_18262 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18263 biolink:ChemicalEntity 1-(5-phospho-D-ribosyl)-ATP Graph 1-(5-phospho-D-ribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate) 1-(5-phospho-D-ribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate) 1-(5-phospho-D-ribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate) http://purl.obolibrary.org/obo/CHEBI_18263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18266 biolink:ChemicalEntity 1D-4-O-methyl-myo-inositol A member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2S,3S,4S,5S,6S-isomer). hmdb:HMDB0029915|kegg.compound:C06352|knapsack:C00001166|pubmed:16668324|pubmed:22079289|pubmed:24253552 Graph (1R,2S,3S,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-4-O-Methyl-myo-inositol|1D-4-O-methyl-myo-inositol|4-O-Methyl-myo-inositol|D-Ononitol|Ononitol 1D-4-O-Methyl-myo-inositol|1D-4-O-methyl-myo-inositol (1R,2S,3S,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-4-O-Methyl-myo-inositol|1D-4-O-methyl-myo-inositol|4-O-Methyl-myo-inositol|D-Ononitol|Ononitol http://purl.obolibrary.org/obo/CHEBI_18266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18267 biolink:ChemicalEntity 5-oxo-4,5-dihydro-2-furylacetic acid The 4,5-dihydro- derivative of 5-oxo-2-furylacetic acid. kegg.compound:C03586|knapsack:C00007489|metacyc.compound:3-OXOADIPATE-ENOL-LACTONE|pubmed:7684040|pubmed:9495744|reaxys:120576 Graph (5-oxo-4,5-dihydrofuran-2-yl)acetic acid|2-Oxo-2,3-dihydrofuran-5-acetate|3-Oxoadipate enol-lactone|3-oxoadipate enol-lactone|4,5-Dihydro-5-oxofuran-2-acetate|5-Oxo-4,5-dihydrofuran-2-acetate|5-oxo-4,5-dihydrofuran-2-acetate (5-oxo-4,5-dihydrofuran-2-yl)acetic acid (5-oxo-4,5-dihydrofuran-2-yl)acetic acid|2-Oxo-2,3-dihydrofuran-5-acetate|3-Oxoadipate enol-lactone|3-oxoadipate enol-lactone|4,5-Dihydro-5-oxofuran-2-acetate|5-Oxo-4,5-dihydrofuran-2-acetate|5-oxo-4,5-dihydrofuran-2-acetate http://purl.obolibrary.org/obo/CHEBI_18267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18268 biolink:ChemicalEntity D-glucurono-6,3-lactone cas:32449-92-6|drugcentral:3266|kegg.compound:C02670|kegg.drug:D01800 Graph D-Glucofuranuronic acid, gamma-lactone|D-Glucurone|D-Glucuronic acid lactone|D-Glucurono-3,6-lactone|D-Glucuronolactone|D-glucurono-3,6-lactone|D-glucurono-6,3-lactone|Glucofuranurono-6,3-lactone|Glucurolactone|Glucurone D-glucurono-6,3-lactone D-Glucofuranuronic acid, gamma-lactone|D-Glucurone|D-Glucuronic acid lactone|D-Glucurono-3,6-lactone|D-Glucuronolactone|D-glucurono-3,6-lactone|D-glucurono-6,3-lactone|Glucofuranurono-6,3-lactone|Glucurolactone|Glucurone http://purl.obolibrary.org/obo/CHEBI_18268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18269 biolink:ChemicalEntity (1->6)-alpha-D-glucan An α-D-glucan in which the glucose units are connected by (1→6) linkages. kegg.compound:C00372 Graph (1,6-alpha-D-Glucosyl)n|(1,6-alpha-D-glucosyl)(n)|(1,6-alpha-D-glucosyl)n|1,6-alpha-D-Glucan (1,6-alpha-D-Glucosyl)n|(1,6-alpha-D-glucosyl)(n)|(1,6-alpha-D-glucosyl)n|1,6-alpha-D-Glucan http://purl.obolibrary.org/obo/CHEBI_18269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18271 biolink:ChemicalEntity 2',3'-cyclic nucleotide kegg.compound:C01240 Graph 2',3'-Cyclic nucleotide|2',3'-cyclic nucleotides|Nucleoside 2',3'-cyclic phosphate 2',3'-Cyclic nucleotide|2',3'-cyclic nucleotides|Nucleoside 2',3'-cyclic phosphate http://purl.obolibrary.org/obo/CHEBI_18271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18272 biolink:ChemicalEntity N(2)-formyl-N(1)-(5-phospho-D-ribosyl)glycinamide A glycinamide ribonucleotide having a phosphate group at the 5-position and a formyl group on the glycine nitrogen. kegg.compound:C04376 Graph 5'-Phosphoribosyl-N-formylglycinamide|N-(N-formylglycyl)-5-O-phosphono-D-ribofuranosylamine|N-Formyl-GAR|N-Formylglycinamide ribonucleotide|N2-Formyl-N1-(5-phospho-D-ribosyl)glycinamide N-(N-formylglycyl)-5-O-phosphono-D-ribofuranosylamine 5'-Phosphoribosyl-N-formylglycinamide|N-(N-formylglycyl)-5-O-phosphono-D-ribofuranosylamine|N-Formyl-GAR|N-Formylglycinamide ribonucleotide|N2-Formyl-N1-(5-phospho-D-ribosyl)glycinamide http://purl.obolibrary.org/obo/CHEBI_18272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18274 biolink:ChemicalEntity 2'-deoxyribonucleoside kegg.compound:C02269|kegg.compound:C03216 Graph 2'-Deoxynucleoside|2'-deoxyribonucleosides|2-Deoxy-D-ribosyl-base|Deoxynucleoside|a 2'-deoxyribonucleoside 2'-Deoxynucleoside|2'-deoxyribonucleosides|2-Deoxy-D-ribosyl-base|Deoxynucleoside|a 2'-deoxyribonucleoside http://purl.obolibrary.org/obo/CHEBI_18274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18276 biolink:ChemicalEntity dihydrogen An elemental molecule consisting of two hydrogens joined by a single bond. cas:1333-74-0|gmelin:3|hmdb:HMDB0001362|kegg.compound:C00282|metacyc.compound:HYDROGEN-MOLECULE|molbase:748|pubmed:15303745|pubmed:16517646|pubmed:18706888|pubmed:19905000|pubmed:19908827|pubmed:20568549|pubmed:24171421|reaxys:3587189|wikipedia.en:Hydrogen Graph E 949|E-949|E949|H(2)|H2|Hydrogen|dihydrogen|molecular hydrogen Hydrogen|dihydrogen E 949|E-949|E949|H(2)|H2|Hydrogen|dihydrogen|molecular hydrogen http://purl.obolibrary.org/obo/CHEBI_18276 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18277 biolink:ChemicalEntity N-(5-phosphonato-beta-D-ribosyl)anthranilate An organophosphate oxoanion resulting from deprotonation of the phosphate and carboxy groups of N-(5-phospho-β-D-ribosyl)anthranilic acid. kegg.compound:C04302 Graph N-(2-carboxylatophenyl)-5-O-phosphonato-beta-D-ribofuranosylamine|N-(2-carboxylatophenyl)-beta-D-ribofuranosylamine 5-phosphate|N-(5'-Phosphoribosyl)anthranilate|N-(5-Phospho-D-ribosyl)anthranilate|N-(5-Phospho-beta-D-ribosyl)anthranilate|N-(5-phospho-beta-D-ribosyl)anthranilate N-(2-carboxylatophenyl)-beta-D-ribofuranosylamine 5-phosphate N-(2-carboxylatophenyl)-5-O-phosphonato-beta-D-ribofuranosylamine|N-(2-carboxylatophenyl)-beta-D-ribofuranosylamine 5-phosphate|N-(5'-Phosphoribosyl)anthranilate|N-(5-Phospho-D-ribosyl)anthranilate|N-(5-Phospho-beta-D-ribosyl)anthranilate|N-(5-phospho-beta-D-ribosyl)anthranilate http://purl.obolibrary.org/obo/CHEBI_18277 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18278 biolink:ChemicalEntity N-acetyl-D-glucosaminyldiphosphodolichol kegg.compound:C04500|kegg.glycan:G00001 Graph N-Acetyl-D-glucosaminyl-diphosphodolichol|N-Acetyl-D-glucosaminyldiphosphodolichol N-Acetyl-D-glucosaminyl-diphosphodolichol|N-Acetyl-D-glucosaminyldiphosphodolichol http://purl.obolibrary.org/obo/CHEBI_18278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18280 biolink:ChemicalEntity phenylglyoxylic acid A 2-oxo monocarboxylic acid that is glyoxylic acid in which the aldehyde hydrogen is substituted by a phenyl group. cas:611-73-4|drugbank:DB02279|gmelin:102031|hmdb:HMDB0001587|kegg.compound:C02137|metacyc.compound:PHENYLGLYOXYLATE|pdb-ccd:173|pubmed:14598013|pubmed:20931367|pubmed:22750350|pubmed:7066236|reaxys:606718|wikipedia.en:Phenylglyoxylic_acid Graph 2-Oxo-2-phenylacetate|2-oxo-2-phenylacetic acid|2-phenylethanoic acid|BENZOYL-FORMIC ACID|Benzoylformate|Benzoylformic acid|Phenylglyoxylate|Phenylglyoxylic acid|alpha-Oxo-benzeneacetic acid|alpha-ketophenylacetic acid|benzeneglyoxylic acid|oxo(phenyl)acetic acid oxo(phenyl)acetic acid 2-Oxo-2-phenylacetate|2-oxo-2-phenylacetic acid|2-phenylethanoic acid|BENZOYL-FORMIC ACID|Benzoylformate|Benzoylformic acid|Phenylglyoxylate|Phenylglyoxylic acid|alpha-Oxo-benzeneacetic acid|alpha-ketophenylacetic acid|benzeneglyoxylic acid|oxo(phenyl)acetic acid http://purl.obolibrary.org/obo/CHEBI_18280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18281 biolink:ChemicalEntity 2,5-didehydro-D-gluconic acid cas:2595-33-7|kegg.compound:C02780 Graph 2,5-Diketogluconic acid|2,5-Dioxo-D-gluconic acid|2,5-diketo-D-gluconic acid|D-threo-2,5-Hexodiulosonic acid|D-threo-hexo-2,5-diulosonic acid D-threo-hexo-2,5-diulosonic acid 2,5-Diketogluconic acid|2,5-Dioxo-D-gluconic acid|2,5-diketo-D-gluconic acid|D-threo-2,5-Hexodiulosonic acid|D-threo-hexo-2,5-diulosonic acid http://purl.obolibrary.org/obo/CHEBI_18281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18282 biolink:ChemicalEntity nucleobase That part of DNA or RNA that may be involved in pairing. kegg.compound:C00701|wikipedia.en:Nucleobase Graph Base|nucleobases Base Base|nucleobases http://purl.obolibrary.org/obo/CHEBI_18282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18283 biolink:ChemicalEntity alpha,alpha-trehalose 6-phosphate beilstein:59815|cas:4484-88-2|drugbank:DB02430|kegg.compound:C00689|kegg.glycan:G09795|knapsack:C00007451 Graph Trehalose 6-phosphate|alpha,alpha'-Trehalose 6-phosphate|alpha-D-glucopyranosyl 6-O-phosphono-alpha-D-glucopyranoside|alpha-D-glucopyranosyl alpha-D-glucopyranoside 6-(dihydrogen phosphate) alpha-D-glucopyranosyl 6-O-phosphono-alpha-D-glucopyranoside Trehalose 6-phosphate|alpha,alpha'-Trehalose 6-phosphate|alpha-D-glucopyranosyl 6-O-phosphono-alpha-D-glucopyranoside|alpha-D-glucopyranosyl alpha-D-glucopyranoside 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18284 biolink:ChemicalEntity thiamine(1+) triphosphate(1-) An ammonium betaine that is the conjugate base of thiamine(1+) triphosphate arising from the deptoronation of one of the hydroxy groups of the terminal phosphate group. beilstein:3812917|cas:3475-65-8|chemspider:17927 Graph 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl trihydrogen triphosphate|5-(2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethoxy)-1,3,5-trihydroxytriphosphoxan-1-olate 1,3,5-trioxide|TTP|thiamin triphosphate|thiamine triphosphate 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl trihydrogen triphosphate 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl trihydrogen triphosphate|5-(2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethoxy)-1,3,5-trihydroxytriphosphoxan-1-olate 1,3,5-trioxide|TTP|thiamin triphosphate|thiamine triphosphate http://purl.obolibrary.org/obo/CHEBI_18284 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18285 biolink:ChemicalEntity (S)-stylopine A berberine alkaloid isolated from the plants of the family papaveraceae. cas:84-39-9|kegg.compound:C05175|knapsack:C00026095|pubmed:22029392|reaxys:96606 Graph (12bS)-6,7,12b,13-tetrahydro-2H,4H,10H-[1,3]dioxolo[4,5-g][1,3]dioxolo[4',5':7,8]isoquino[3,2-a]isoquinoline|(S)-Stylopine|(S)-stylopine|6,7,12b,13e-Tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizine|6,7,12b,13e-tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizine|Stylopine|l-Tetrahydrocoptisine (12bS)-6,7,12b,13-tetrahydro-2H,4H,10H-[1,3]dioxolo[4,5-g][1,3]dioxolo[4',5':7,8]isoquino[3,2-a]isoquinoline (12bS)-6,7,12b,13-tetrahydro-2H,4H,10H-[1,3]dioxolo[4,5-g][1,3]dioxolo[4',5':7,8]isoquino[3,2-a]isoquinoline|(S)-Stylopine|(S)-stylopine|6,7,12b,13e-Tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizine|6,7,12b,13e-tetrahydro-4H-bis[1,3]benzodioxolo[5,6-a:4',5'-g]quinolizine|Stylopine|l-Tetrahydrocoptisine http://purl.obolibrary.org/obo/CHEBI_18285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18287 biolink:ChemicalEntity L-fucose Any form of fucose having L configuration. cas:2438-80-4|pubmed:20877283 Graph (-)-L-fucose|(-)-fucose|6-deoxy-L-galactose|L-(-)-fucose|L-Fuc|L-fucose|L-galactomethylose 6-deoxy-L-galactose|L-fucose (-)-L-fucose|(-)-fucose|6-deoxy-L-galactose|L-(-)-fucose|L-Fuc|L-fucose|L-galactomethylose http://purl.obolibrary.org/obo/CHEBI_18287 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18288 biolink:ChemicalEntity (S)-2-hydroxypropyl-CoM kegg.compound:C11498|umbbd.compound:c0785 Graph (S)-2-Hydroxypropyl-CoM|(S)-2-hydroxypropyl-CoM|2-(S)-Hydroxypropyl-CoM|2-{[(2S)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid 2-{[(2S)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid (S)-2-Hydroxypropyl-CoM|(S)-2-hydroxypropyl-CoM|2-(S)-Hydroxypropyl-CoM|2-{[(2S)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid http://purl.obolibrary.org/obo/CHEBI_18288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18289 biolink:ChemicalEntity quinolin-2(1H)-one A quinolone that is 1,2-dihydroquinoline substituted by an oxo group at position 2. cas:59-31-4|kegg.compound:C06415|pdb-ccd:OCH|pubmed:23689721|reaxys:2855 Graph 2(1H)-Quinolinone|2-quinolone|Carbostyril|QUINOLIN-2(1H)-ONE|Quinolin-2(1H)-one|alpha-Quinolone|o-Aminocinnamic acid lactam|quinolin-2(1H)-one QUINOLIN-2(1H)-ONE|Quinolin-2(1H)-one|quinolin-2(1H)-one 2(1H)-Quinolinone|2-quinolone|Carbostyril|QUINOLIN-2(1H)-ONE|Quinolin-2(1H)-one|alpha-Quinolone|o-Aminocinnamic acid lactam|quinolin-2(1H)-one http://purl.obolibrary.org/obo/CHEBI_18289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18291 biolink:ChemicalEntity manganese atom cas:7439-96-5|kegg.compound:C00034|webelements:Mn Graph 25Mn|Mangan|Manganese|Mn|manganese|manganeso|manganum Manganese|manganese 25Mn|Mangan|Manganese|Mn|manganese|manganeso|manganum http://purl.obolibrary.org/obo/CHEBI_18291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18292 biolink:ChemicalEntity jasmonic acid bpdb:2440|cas:6894-38-8|chemspider:4444606|foodb.food:FDB015493|hmdb:HMDB0032797|kegg.compound:C08491|knapsack:C00000218|lipidmaps:LMFA02020001|pdb-ccd:JAA|pubmed:17470145|pubmed:19704561|pubmed:28223489|pubmed:33516967|reaxys:2692609|wikipedia.en:Jasmonic_acid Graph (-)-Jasmonic acid|(-)-jasmonic acid|(1R,2R)-3-oxo-2-(2Z)-2-penten-ylcyclopentanacetic acid|(1R,2R)-3-oxo-2-(pent-2Z-enyl)-cyclopentaneacetic acid|2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetate|Jasmonate|Jasmonic acid|{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid {(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid (-)-Jasmonic acid|(-)-jasmonic acid|(1R,2R)-3-oxo-2-(2Z)-2-penten-ylcyclopentanacetic acid|(1R,2R)-3-oxo-2-(pent-2Z-enyl)-cyclopentaneacetic acid|2-{(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl}acetate|Jasmonate|Jasmonic acid|{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid http://purl.obolibrary.org/obo/CHEBI_18292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18295 biolink:ChemicalEntity histamine A member of the class of imidazoles that is 1H-imidazole substituted at position C-4 by a 2-aminoethyl group. cas:51-45-6|drugcentral:1375|gmelin:2968|hmdb:HMDB0000870|kegg.compound:C00388|kegg.drug:D08040|knapsack:C00001414|metacyc.compound:HISTAMINE|pdb-ccd:HSM|pubmed:16399866|pubmed:19547708|pubmed:19843401|pubmed:22770225|pubmed:24101735|reaxys:2012|wikipedia.en:Histamine Graph 1H-Imidazole-4-ethanamine|2-(1H-imidazol-4-yl)ethanamine|2-(4-Imidazolyl)ethylamine|HISTAMINE|Histamine 2-(1H-imidazol-4-yl)ethanamine 1H-Imidazole-4-ethanamine|2-(1H-imidazol-4-yl)ethanamine|2-(4-Imidazolyl)ethylamine|HISTAMINE|Histamine http://purl.obolibrary.org/obo/CHEBI_18295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18296 biolink:ChemicalEntity chondroitin 6'-sulfate A chondroitin sulfate in which the site of sulfation is carbon 6 of the N-acetylgalactosamine (GalNAc) sugar. cas:25322-46-7|kegg.compound:C00635|metacyc.compound:Chondroitin-Sulfate-C|pubmed:7538297|pubmed:8686873|reaxys:11312765|reaxys:9896922 Graph Chondroitin 6'-sulfate|Chondroitin 6-sulfate|Chondroitin sulfate C|chondroitin 6'-sulfate|chondroitin 6-(hydrogen sulfate) Chondroitin 6'-sulfate|Chondroitin 6-sulfate|Chondroitin sulfate C|chondroitin 6'-sulfate|chondroitin 6-(hydrogen sulfate) http://purl.obolibrary.org/obo/CHEBI_18296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182969 biolink:ChemicalEntity 20alpha-dihydroprednisone cas:600-92-0|pubmed:25800201 Graph (1R,3aS,3bS,9aR,9bS,11aS)-1-[(1R)-1,2-dihydroxyethyl]-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|(20R)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione|(20R)-hydroxyprednisone|20alpha-dihydro-prednisone (20R)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione (1R,3aS,3bS,9aR,9bS,11aS)-1-[(1R)-1,2-dihydroxyethyl]-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|(20R)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione|(20R)-hydroxyprednisone|20alpha-dihydro-prednisone http://purl.obolibrary.org/obo/CHEBI_182969 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18297 biolink:ChemicalEntity 1D-myo-inositol 1-phosphate An inositol having myo- configuration substituted at position 1 by a phosphate group. cas:15421-51-9|drugbank:DB03542|hmdb:HMDB0000213|kegg.compound:C01177|knapsack:C00007483|metacyc.compound:D-MYO-INOSITOL-1-MONOPHOSPHATE|pdb-ccd:IPD|pubmed:17439666|reaxys:2056776 Graph (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl dihydrogen phosphate|1D-myo-Inositol 1-monophosphate|1D-myo-Inositol 1-phosphate|D-myo-Inositol 1-phosphate|I1P|Inositol 1-phosphate|Ins(1)P|Ins1P|Myoinositol 1-phosphate (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl dihydrogen phosphate|1D-myo-Inositol 1-phosphate (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl dihydrogen phosphate|1D-myo-Inositol 1-monophosphate|1D-myo-Inositol 1-phosphate|D-myo-Inositol 1-phosphate|I1P|Inositol 1-phosphate|Ins(1)P|Ins1P|Myoinositol 1-phosphate http://purl.obolibrary.org/obo/CHEBI_18297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:182970 biolink:ChemicalEntity 20beta-dihydroprednisone cas:600-93-1|pubmed:25800201 Graph (1R,3aS,3bS,9aR,9bS,11aS)-1-[(1S)-1,2-dihydroxyethyl]-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|(20S)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione|(20S)-hydroxyprednisone|20beta-dihydro-prednisone (20S)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione (1R,3aS,3bS,9aR,9bS,11aS)-1-[(1S)-1,2-dihydroxyethyl]-1-hydroxy-9a,11a-dimethyl-2,3,3a,3b,4,5,9a,9b,11,11a-decahydro-1H-cyclopenta[a]phenanthrene-7,10-dione|(20S)-17,20,21-trihydroxypregna-1,4-diene-3,11-dione|(20S)-hydroxyprednisone|20beta-dihydro-prednisone http://purl.obolibrary.org/obo/CHEBI_182970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18298 biolink:ChemicalEntity 3-hydroxy-2-methyl-3-phytyl-2,3-dihydro-1,4-naphthoquinone kegg.compound:C02785 Graph 2-hydroxy-3-methyl-2-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-2,3-dihydro-1,4-naphthoquinone|3-Hydroxy-2-methyl-3-phytyl-2,3-dihydronaphthoquinone|3-Hydroxy-vitamin K|3-hydroxy-2-methyl-3-phytyl-2,3-dihydro-1,4-naphthoquinone 2-hydroxy-3-methyl-2-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-2,3-dihydro-1,4-naphthoquinone 2-hydroxy-3-methyl-2-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]-2,3-dihydro-1,4-naphthoquinone|3-Hydroxy-2-methyl-3-phytyl-2,3-dihydronaphthoquinone|3-Hydroxy-vitamin K|3-hydroxy-2-methyl-3-phytyl-2,3-dihydro-1,4-naphthoquinone http://purl.obolibrary.org/obo/CHEBI_18298 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18299 biolink:ChemicalEntity 1-C-(indol-3-yl)glycerol 3-phosphate beilstein:289763|cas:4220-97-7|kegg.compound:C03506 Graph (3-Indolyl)-glycerol phosphate|1-(Indol-3-yl)glycerol 3-phosphate|2,3-dihydroxy-3-(1H-indol-3-yl)propyl dihydrogen phosphate|C1-(3-Indolyl)-glycerol 3-phosphate|IGPS|Indole-3-glycerophosphate|Indoleglycerol phosphate 2,3-dihydroxy-3-(1H-indol-3-yl)propyl dihydrogen phosphate (3-Indolyl)-glycerol phosphate|1-(Indol-3-yl)glycerol 3-phosphate|2,3-dihydroxy-3-(1H-indol-3-yl)propyl dihydrogen phosphate|C1-(3-Indolyl)-glycerol 3-phosphate|IGPS|Indole-3-glycerophosphate|Indoleglycerol phosphate http://purl.obolibrary.org/obo/CHEBI_18299 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18300 biolink:ChemicalEntity maleic acid A butenedioic acid in which the double bond has cis- (Z)-configuration. beilstein:1903639|cas:110-16-7|drugbank:DB04299|gmelin:49854|hmdb:HMDB0000176|kegg.compound:C01384|knapsack:C00007417|metacyc.compound:MALEATE|pdb-ccd:MAE|pubmed:10952545|pubmed:11386868|pubmed:22770225|pubmed:9591280|reaxys:605762|wikipedia.en:Maleic_acid Graph (2Z)-but-2-enedioic acid|(Z)-2-butenedioic acid|(Z)-butenedioic acid|H2male|MALEIC ACID|Maleic acid|cis-1,2-ethylenedicarboxylic acid|cis-Butenedioic acid|cis-but-2-enedioic acid|cis-ethene-1,2-dioic acid|toxilic acid (2Z)-but-2-enedioic acid (2Z)-but-2-enedioic acid|(Z)-2-butenedioic acid|(Z)-butenedioic acid|H2male|MALEIC ACID|Maleic acid|cis-1,2-ethylenedicarboxylic acid|cis-Butenedioic acid|cis-but-2-enedioic acid|cis-ethene-1,2-dioic acid|toxilic acid http://purl.obolibrary.org/obo/CHEBI_18300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18301 biolink:ChemicalEntity (2Z,4E)-4-hydroxymuconic semialdehyde kegg.compound:C06603|umbbd.compound:c0262 Graph (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid|cis,cis-4-hydroxymuconic semialdehyde (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid|cis,cis-4-hydroxymuconic semialdehyde http://purl.obolibrary.org/obo/CHEBI_18301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18302 biolink:ChemicalEntity 1-(5-phospho-beta-D-ribosyl)-5-[(5-phospho-beta-D-ribosylamino)methylideneamino]imidazole-4-carboxamide A 1-(phosphoribosyl)imidazolecarboxamide that is the 5-(5-phospho-β-D-ribosylamino)methylidene derivative of 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide. kegg.compound:C04896|pubmed:8990314|reaxys:874842 Graph 1-(5-O-phosphono-beta-D-ribofuranosyl)-5-[(5-O-phosphono-beta-D-ribofuranosylamino)methylideneamino]-1H-imidazole-4-carboxamide|1-(5-Phosphoribosyl)-5-[(5-phosphoribosylamino)methylideneamino]imidazole-4-carboxamide|5'-ProFAR|5-(5-Phospho-D-ribosylaminoformimino)-1-(5-phosphoribosyl)-imidazole-4-carboxamide|N-(5'-Phospho-D-ribosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4-imidazolecarboxamide|N-(5'-Phosphoribosylformimino)-5-amino-1-(5''-phosphoribosyl)-4-imidazolecarboxamide|Phosphoribosyl-formimino-AICAR-phosphate 1-(5-O-phosphono-beta-D-ribofuranosyl)-5-[(5-O-phosphono-beta-D-ribofuranosylamino)methylideneamino]-1H-imidazole-4-carboxamide 1-(5-O-phosphono-beta-D-ribofuranosyl)-5-[(5-O-phosphono-beta-D-ribofuranosylamino)methylideneamino]-1H-imidazole-4-carboxamide|1-(5-Phosphoribosyl)-5-[(5-phosphoribosylamino)methylideneamino]imidazole-4-carboxamide|5'-ProFAR|5-(5-Phospho-D-ribosylaminoformimino)-1-(5-phosphoribosyl)-imidazole-4-carboxamide|N-(5'-Phospho-D-ribosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4-imidazolecarboxamide|N-(5'-Phosphoribosylformimino)-5-amino-1-(5''-phosphoribosyl)-4-imidazolecarboxamide|Phosphoribosyl-formimino-AICAR-phosphate http://purl.obolibrary.org/obo/CHEBI_18302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18303 biolink:ChemicalEntity phosphatidyl-L-serine A class of aminophospholipids in which a phosphatidyl group is esterified to the hydroxy group of serine. drugbank:DB00144|hmdb:HMDB0014291|kegg.compound:C02737|metacyc.compound:L-1-PHOSPHATIDYL-SERINE|patent:EP2322184|patent:HK1046237|patent:US2011098249|pubmed:10540156|pubmed:15533308|pubmed:19687511|pubmed:23543734|pubmed:3106116|pubmed:3196084|pubmed:4153523|pubmed:8204602|pubmed:8626656|pubmed:9677350|wikipedia.en:Phosphatidylserine Graph PS|Phosphatidylserine|Ptd-L-Ser|phosphatidyl-L-serines PS|Phosphatidylserine|Ptd-L-Ser|phosphatidyl-L-serines http://purl.obolibrary.org/obo/CHEBI_18303 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18304 biolink:ChemicalEntity deamido-NAD(+) cas:6450-77-7|drugbank:DB04099|foodb.food:FDB031057|hmdb:HMDB0001179|kegg.compound:C00857|pdb-ccd:NXX Graph Deamido-NAD|Deamido-NAD+|Deamino-NAD+|NAAD|NaAD|adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|desamido NAD|nicotinic acid adenine dinucleotide|nicotinic acid-adenine dinucleotide adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate} Deamido-NAD|Deamido-NAD+|Deamino-NAD+|NAAD|NaAD|adenosine 5'-{3-[1-(3-carboxypyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}|desamido NAD|nicotinic acid adenine dinucleotide|nicotinic acid-adenine dinucleotide http://purl.obolibrary.org/obo/CHEBI_18304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18305 biolink:ChemicalEntity hydroquinone O-beta-D-glucopyranoside A monosaccharide derivative that is hydroquinone attached to a β-D-glucopyranosyl residue at position 4 via a glycosidic linkage. cas:497-76-7|drugcentral:4267|hmdb:HMDB0029943|kegg.compound:C06186|knapsack:C00002638|lincs.smallmolecule:LSM-5255|metacyc.compound:HYDROQUINONE-O-BETA-D-GLUCOPYRANOSIDE|pubmed:15287073|pubmed:9518563|reaxys:89673|wikipedia.en:Arbutin Graph 4-hydroxyphenyl beta-D-glucopyranoside|Arbutin|Hydroquinone-O-beta-D-glucopyranoside|Ursin|Uvasol|hydroquinone O-beta-D-glucopyranoside|p-hydroxyphenyl beta-D-glucopyranoside|p-hydroxyphenyl beta-D-glucoside 4-hydroxyphenyl beta-D-glucopyranoside 4-hydroxyphenyl beta-D-glucopyranoside|Arbutin|Hydroquinone-O-beta-D-glucopyranoside|Ursin|Uvasol|hydroquinone O-beta-D-glucopyranoside|p-hydroxyphenyl beta-D-glucopyranoside|p-hydroxyphenyl beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_18305 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18306 biolink:ChemicalEntity thiamine(1+) carboxylic acid A monocarboxylic acid that is thiamine(1+) which carries an oxo group at position 2. beilstein:3693053|cas:22907-07-9|chemspider:388883|kegg.compound:C02892|pubmed:2988447|pubmed:4987737|pubmed:5344131|pubmed:5472363 Graph 3-(2'-methyl-4'-amino-5'-pyrimidylmethyl)-4-methylthiazol-5-acetic acid|3-(2'-methyl-4'-amino-5'-pyrimidylmethyl)-4-methylthiazole-5-acetic acid|3-(2-methyl-4-amino-5-pyrimidylmethyl)-4-methylthiazole-5-acetic acid|3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(carboxymethyl)-4-methylthiazolium|3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(carboxymethyl)-4-methyl-1,3-thiazol-3-ium|thiamin acetic acid|thiamine acetic acid 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(carboxymethyl)-4-methyl-1,3-thiazol-3-ium 3-(2'-methyl-4'-amino-5'-pyrimidylmethyl)-4-methylthiazol-5-acetic acid|3-(2'-methyl-4'-amino-5'-pyrimidylmethyl)-4-methylthiazole-5-acetic acid|3-(2-methyl-4-amino-5-pyrimidylmethyl)-4-methylthiazole-5-acetic acid|3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(carboxymethyl)-4-methylthiazolium|3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(carboxymethyl)-4-methyl-1,3-thiazol-3-ium|thiamin acetic acid|thiamine acetic acid http://purl.obolibrary.org/obo/CHEBI_18306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18307 biolink:ChemicalEntity UDP-D-galactose cas:2956-16-3|drugbank:DB03501|hmdb:HMDB0000302|kegg.compound:C00052|pdb-ccd:GDU|pubmed:19699703|pubmed:24041039|reaxys:773447 Graph UDP-D-galactopyranose|UDP-D-galactose|UDPgalactose|Udp galactose|Udpgal|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-galactopyranosyl ester|Uridine diphosphate galactose|Uridine diphosphogalactose|Uridine pyrophosphogalactose|Uridinediphosphogalactose|uridine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] UDP-D-galactopyranose|UDP-D-galactose|UDPgalactose|Udp galactose|Udpgal|Uridine 5'-(trihydrogen diphosphate), P'-alpha-D-galactopyranosyl ester|Uridine diphosphate galactose|Uridine diphosphogalactose|Uridine pyrophosphogalactose|Uridinediphosphogalactose|uridine 5'-[3-(D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_18307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18308 biolink:ChemicalEntity acrylic acid A α,β-unsaturated monocarboxylic acid that is ethene substituted by a carboxy group. cas:79-10-7|drugbank:DB02579|gmelin:1817|hmdb:HMDB0031647|kegg.compound:C00511|lipidmaps:LMFA01030193|metacyc.compound:MY148411|metacyc.compound:MY149879|pdb-ccd:AKR|pubmed:24650085|pubmed:24673501|reaxys:635743|wikipedia.en:Acrylic_acid Graph 2-Propenoic acid|ACRYLIC ACID|Acrylate|Acrylic acid|Propenoate|Propenoic acid|Vinylformic acid|acroleic acid|ethylenecarboxylic acid|prop-2-enoic acid prop-2-enoic acid 2-Propenoic acid|ACRYLIC ACID|Acrylate|Acrylic acid|Propenoate|Propenoic acid|Vinylformic acid|acroleic acid|ethylenecarboxylic acid|prop-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_18308 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183083 biolink:ChemicalEntity indirubin A member of the class of indolones that is 1,3-dihydro-2H-indol-2-one substituted by a 3-oxo-1,3-dihydro-2H-indol-2-ylidene group at position 3. It is the active component of Dang Gui Long Hui Wan, which has been used in traditional Chinese medicine to treat inflammatory diseases and chronic myeloid leukemia. cas:479-41-4|drugbank:DB12379|hmdb:HMDB0240743|knapsack:C00026982|lincs.smallmolecule:LSM-42899|pubmed:21207415|pubmed:22363408|pubmed:31652913|pubmed:31796845|pubmed:32093032|pubmed:32795328|pubmed:32914538|pubmed:32927253|pubmed:32975633|pubmed:33283739|pubmed:33611057|pubmed:34135755|pubmed:34161865|pubmed:34280616|pubmed:34366843|pubmed:34396002|reaxys:88279|wikipedia.en:Indirubin Graph 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one|C.I. 73200|[Delta(2,3')-biindoline]-2',3-dione|couroupitine B|indigo red|indigopurpurin 3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one 3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|3-(3-oxo-1,3-dihydro-2H-indol-2-ylidene)-1,3-dihydro-2H-indol-2-one|3-(3-oxo-1H-indol-2-ylidene)-1H-indol-2-one|C.I. 73200|[Delta(2,3')-biindoline]-2',3-dione|couroupitine B|indigo red|indigopurpurin http://purl.obolibrary.org/obo/CHEBI_183083 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183096 biolink:ChemicalEntity (Z)-progoitrin(1-) pubmed:11752388 Graph (2R)-2-hydroxy-3-butenyl glucosinolate|progoitrin (2R)-2-hydroxy-3-butenyl glucosinolate|progoitrin http://purl.obolibrary.org/obo/CHEBI_183096 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:183098 biolink:ChemicalEntity (Z)-glucosinolate(1-) metacyc.compound:Glucosinolates Graph a (Z)-glucosinolate a (Z)-glucosinolate http://purl.obolibrary.org/obo/CHEBI_183098 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18310 biolink:ChemicalEntity alkane An acyclic branched or unbranched hydrocarbon having the general formula CnH2n+2, and therefore consisting entirely of hydrogen atoms and saturated carbon atoms. kegg.compound:C01371 Graph Alkan|Alkane|RH|alcane|alcanes|alcano|alcanos|alkane|alkanes|an alkane Alkane|alkane|alkanes Alkan|Alkane|RH|alcane|alcanes|alcano|alcanos|alkane|alkanes|an alkane http://purl.obolibrary.org/obo/CHEBI_18310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183102 biolink:ChemicalEntity alkenyl isothiocyanate Graph an alkenyl isothiocyanate an alkenyl isothiocyanate http://purl.obolibrary.org/obo/CHEBI_183102 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18311 biolink:ChemicalEntity quinoline-4-carboxylic acid beilstein:5224|cas:486-74-8|gmelin:408550|kegg.compound:C06414 Graph 4-Quinolinecarboxylic acid|Cinchonic acid|Quinoline-4-carboxylate|Quinoline-4-carboxylic acid|quinoline-4-carboxylic acid Quinoline-4-carboxylate|quinoline-4-carboxylic acid 4-Quinolinecarboxylic acid|Cinchonic acid|Quinoline-4-carboxylate|Quinoline-4-carboxylic acid|quinoline-4-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18312 biolink:ChemicalEntity 4-(hydroxymethyl)benzenesulfonic acid beilstein:3605659|gmelin:561215|kegg.compound:C06678 Graph 4-(Hydroxymethyl)benzenesulfonate|4-(hydroxymethyl)benzenesulfonic acid|4-Sulfobenzyl alcohol 4-(Hydroxymethyl)benzenesulfonate|4-(hydroxymethyl)benzenesulfonic acid 4-(Hydroxymethyl)benzenesulfonate|4-(hydroxymethyl)benzenesulfonic acid|4-Sulfobenzyl alcohol http://purl.obolibrary.org/obo/CHEBI_18312 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18313 biolink:ChemicalEntity alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide A glycotriaosylceramide having α-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucose as the trisaccharide component. cas:71965-57-6|kegg.compound:C04737|kegg.glycan:G00093|metacyc.compound:D-GALACTOSYL-14-D-GALACTOSYL-14-D-|pubmed:11437603|pubmed:11525645|pubmed:11946769|pubmed:12227795|pubmed:15113548|pubmed:1528196|pubmed:16120140|pubmed:1724444|pubmed:17258170|pubmed:17674039|pubmed:18176841|pubmed:18810447|pubmed:19655181|pubmed:20424866|pubmed:20623712|pubmed:2120125|pubmed:21252262|pubmed:21376640|pubmed:2448252|pubmed:2456994|pubmed:2500499|pubmed:2960671|pubmed:7691279|pubmed:7841803 Graph Burkitt's lymphoma antigen, bla-CD77|CTH|D-Galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|Gal-alpha1->4Gal-beta1->4Glc-beta1->1'Cer|Gal-alpha1->4LacCer|Galalpha1-4Galbeta1-4Glcbeta1-1'ceramide|Gb3|Gb3Cer|GbOSe3Cer|Globotriosylceramide|N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|Trihexosylceramide|a globoside Gb3Cer (d18:1(4E))|alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|ceramide trihexoside|globotriaosylceramide|globotrihexosylceramide N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide Burkitt's lymphoma antigen, bla-CD77|CTH|D-Galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide|Gal-alpha1->4Gal-beta1->4Glc-beta1->1'Cer|Gal-alpha1->4LacCer|Galalpha1-4Galbeta1-4Glcbeta1-1'ceramide|Gb3|Gb3Cer|GbOSe3Cer|Globotriosylceramide|N-[(2S,3R,4E)-1-{[alpha-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|Trihexosylceramide|a globoside Gb3Cer (d18:1(4E))|alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide|ceramide trihexoside|globotriaosylceramide|globotrihexosylceramide http://purl.obolibrary.org/obo/CHEBI_18313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18314 biolink:ChemicalEntity L-2-aminopentanoic acid A 2-aminopentanoic acid that has S-configuration. cas:6600-40-4|kegg.compound:C01826|lipidmaps:LMFA01100041|metacyc.compound:L-2-AMINOPENTANOIC-ACID|pdb-ccd:NVA|pubmed:24206068|pubmed:30288668|pubmed:30703532|pubmed:31089055|pubmed:31540372|pubmed:31861122|pubmed:32123601|pubmed:32149110|pubmed:33524560|pubmed:35398371|pubmed:35543360|pubmed:783153|reaxys:1721162|wikipedia.en:Norvaline Graph (2S)-2-aminopentanoic acid|(S)-2-Aminopentanoic acid|L-2-Aminopentanoic acid|L-2-Aminovaleric acid|L-2-aminopentanoic acid|L-2-aminovaleric acid|L-Norvaline|L-norvaline (2S)-2-aminopentanoic acid (2S)-2-aminopentanoic acid|(S)-2-Aminopentanoic acid|L-2-Aminopentanoic acid|L-2-Aminovaleric acid|L-2-aminopentanoic acid|L-2-aminovaleric acid|L-Norvaline|L-norvaline http://purl.obolibrary.org/obo/CHEBI_18314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18315 biolink:ChemicalEntity pyrroloquinoline quinone A pyrroloquinoline having oxo groups at the 4- and 5-positions and carboxy groups at the 2-, 7- and 9-positions. beilstein:3596812|cas:72909-34-3|chemspider:997|drugbank:DB03205|foodb.food:FDB012848|gmelin:56633|hmdb:HMDB0013636|kegg.compound:C00113|knapsack:C00053736|pdb-ccd:PQQ|pubmed:32695625|pubmed:34140030|pubmed:34227919|resid:AA0283|wikipedia.en:Pyrroloquinoline_quinone Graph 2,4,6-tricarboxylic-pyrrolo[2,3-5,6]quinoline 8,9-quinone|2,7,9-tricarboxy-1H-pyrrolo(2,3-f)quinoline-4,5-dione|4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate|4,5-dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid|4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid|Methoxatin|PQQ|PYRROLOQUINOLINE QUINONE|Pyrrolo-quinoline quinone|Pyrroloquinoline quinone|Pyrroloquinoline-quinone|coenzyme PQQ|methoxatin 4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid 2,4,6-tricarboxylic-pyrrolo[2,3-5,6]quinoline 8,9-quinone|2,7,9-tricarboxy-1H-pyrrolo(2,3-f)quinoline-4,5-dione|4,5-Dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate|4,5-dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid|4,5-dioxo-4,5-dihydro-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid|Methoxatin|PQQ|PYRROLOQUINOLINE QUINONE|Pyrrolo-quinoline quinone|Pyrroloquinoline quinone|Pyrroloquinoline-quinone|coenzyme PQQ|methoxatin http://purl.obolibrary.org/obo/CHEBI_18315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18316 biolink:ChemicalEntity 4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol A monohydroxy-1,3,5-triazine that is atrazine in which the chloro group has been replaced by a hydroxy group. cas:2163-68-0|kegg.compound:C06552|metacyc.compound:HYDROXYATRAZINE|pubmed:11476505|pubmed:20299293|pubmed:22153354|pubmed:24062064|reaxys:612018|umbbd.compound:c0161 Graph 2-hydroxyatrazine|4-(Ethylamino)-2-hydroxy-6-(isopropylamino)-1,3,5-triazine|4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-ol|4-(ethylamino)-6-(isopropylamino)-s-triazin-2-ol|Hydroxyatrazine|hydroxyatrazine|hydroxydechloroatrazine 4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-ol 2-hydroxyatrazine|4-(Ethylamino)-2-hydroxy-6-(isopropylamino)-1,3,5-triazine|4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-ol|4-(ethylamino)-6-(isopropylamino)-s-triazin-2-ol|Hydroxyatrazine|hydroxyatrazine|hydroxydechloroatrazine http://purl.obolibrary.org/obo/CHEBI_18316 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18317 biolink:ChemicalEntity N-acetyl-LL-2,6-diaminopimelate(2-) A dicarboxylic acid dianion resulting from removal of a proton from both carboxy groups of N-acetyl-LL-2,6-diaminopimelic acid. kegg.compound:C04390|metacyc.compound:CPD-1771 Graph (2S,6S)-2-acetamido-6-aminoheptanedioate|N(2)-acetyl-L,L-2,6-diaminoheptanedioate|N(6)-acetyl-L,L-2,6-diaminoheptanedioate|N(6)-acetyl-L-2,6-diaminoheptanedioate|N-acetyl-L,L-2,6-diaminoheptanedioate|N-acetyl-L,L-2,6-diaminopimelate|N-acetyl-L,L-DAP|N-acetyl-LL-2,6-diaminoheptanedioate|N-acetyl-LL-2,6-diaminopimelate|N-acetyl-LL-2,6-diaminopimelate dianion|N2-acetyl-LL-2,6-diaminoheptanedioate|N2-acetyl-LL-2,6-diaminopimelate|N6-acetyl-L,L-2,6-diaminopimelate|N6-acetyl-L-2,6-diaminoheptanedioate|N6-acetyl-L-2,6-diaminopimelate|N6-acetyl-LL-2,6-diaminoheptanedioate|N6-acetyl-LL-2,6-diaminopimelate (2S,6S)-2-acetamido-6-aminoheptanedioate (2S,6S)-2-acetamido-6-aminoheptanedioate|N(2)-acetyl-L,L-2,6-diaminoheptanedioate|N(6)-acetyl-L,L-2,6-diaminoheptanedioate|N(6)-acetyl-L-2,6-diaminoheptanedioate|N-acetyl-L,L-2,6-diaminoheptanedioate|N-acetyl-L,L-2,6-diaminopimelate|N-acetyl-L,L-DAP|N-acetyl-LL-2,6-diaminoheptanedioate|N-acetyl-LL-2,6-diaminopimelate|N-acetyl-LL-2,6-diaminopimelate dianion|N2-acetyl-LL-2,6-diaminoheptanedioate|N2-acetyl-LL-2,6-diaminopimelate|N6-acetyl-L,L-2,6-diaminopimelate|N6-acetyl-L-2,6-diaminoheptanedioate|N6-acetyl-L-2,6-diaminopimelate|N6-acetyl-LL-2,6-diaminoheptanedioate|N6-acetyl-LL-2,6-diaminopimelate http://purl.obolibrary.org/obo/CHEBI_18317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18318 biolink:ChemicalEntity galactosylceramide sulfate A galactosylceramide substituted at O3 of galactose by a sulfo group. kegg.compound:C06125|kegg.glycan:G11122|lipidmaps:LMSP06020000|pubmed:1378088|pubmed:16341241|pubmed:16758576|pubmed:17855742|pubmed:21167756|pubmed:25748038|pubmed:27242221|pubmed:6095072|pubmed:8104274|wikipedia.en:Sulfatide Graph 3-O-sulfo-beta-D-galactosylceramide|Cerebroside 3-sulfate|Galactosylceramidesulfate|N-{(2S,3R,4E)-3-hydroxy-1-(3-O-sulfo-beta-D-galactopyranosyloxy)octadec-4-en-2-yl}alkanamide|Sulfatide|galactosylceramide sulfates|sulphatide N-{(2S,3R,4E)-3-hydroxy-1-(3-O-sulfo-beta-D-galactopyranosyloxy)octadec-4-en-2-yl}alkanamide 3-O-sulfo-beta-D-galactosylceramide|Cerebroside 3-sulfate|Galactosylceramidesulfate|N-{(2S,3R,4E)-3-hydroxy-1-(3-O-sulfo-beta-D-galactopyranosyloxy)octadec-4-en-2-yl}alkanamide|Sulfatide|galactosylceramide sulfates|sulphatide http://purl.obolibrary.org/obo/CHEBI_18318 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18319 biolink:ChemicalEntity SAICAR A 1-(phosphoribosyl)imidazolecarboxamide resulting from the formal condesation of the darboxy group of 5-amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazole-4-carboxylic acid with the amino group of L-aspartic acid. cas:3031-95-6|hmdb:HMDB0000797|kegg.compound:C04823|metacyc.compound:P-RIBOSYL-4-SUCCCARB-AMINOIMIDAZOLE|pubmed:23086999|wikipedia.en:Phosphoribosylaminoimidazolesuccinocarboxamide Graph (2S)-2-[5-amino-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamido]succinic acid|(S)-2-[5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate|1-(5'-Phosphoribosyl)-4-(N-succinocarboxamide)-5-aminoimidazole|1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole|5'-Phosphoribosyl-4-(N-succinocarboxamide)-5-aminoimidazole|N-{[5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-4-yl]carbonyl}-L-aspartic acid|SAICA riboside|SAICAR|Succino-AICAR|succinyl-5-aminoimidazole-4-carboxamide-1-ribose-5-phosphate|succinylaminoimidazolecarboxamide ribose-5'-phosphate (2S)-2-[5-amino-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamido]succinic acid|N-{[5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-4-yl]carbonyl}-L-aspartic acid (2S)-2-[5-amino-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamido]succinic acid|(S)-2-[5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate|1-(5'-Phosphoribosyl)-4-(N-succinocarboxamide)-5-aminoimidazole|1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole|5'-Phosphoribosyl-4-(N-succinocarboxamide)-5-aminoimidazole|N-{[5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-4-yl]carbonyl}-L-aspartic acid|SAICA riboside|SAICAR|Succino-AICAR|succinyl-5-aminoimidazole-4-carboxamide-1-ribose-5-phosphate|succinylaminoimidazolecarboxamide ribose-5'-phosphate http://purl.obolibrary.org/obo/CHEBI_18319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18320 biolink:ChemicalEntity 1,4-dithiothreitol The threo-diastereomer of 1,4-dimercaptobutane-2,3-diol. beilstein:8144556|cas:3483-12-3|drugbank:DB04447|kegg.compound:C00265|lincs.smallmolecule:LSM-36870|pubmed:16901854|pubmed:18022205|pubmed:23673948|pubmed:24124079|pubmed:7592847 Graph (R*,R*)-1,4-dimercapto-2,3-butanediol|1,4-Dithiothreitol|1,4-dithiothreitol|Cleland's reagent|DL-threo-1,4-Dimercapto-2,3-butanediol|DTL|DTT|Dithiothreitol|Dithiotreitol|rac-Dithiothreitol|rel-(2R,3R)-1,4-disulfanylbutane-2,3-diol|threo-1,4-Dimercapto-2,3-butanediol rel-(2R,3R)-1,4-disulfanylbutane-2,3-diol (R*,R*)-1,4-dimercapto-2,3-butanediol|1,4-Dithiothreitol|1,4-dithiothreitol|Cleland's reagent|DL-threo-1,4-Dimercapto-2,3-butanediol|DTL|DTT|Dithiothreitol|Dithiotreitol|rac-Dithiothreitol|rel-(2R,3R)-1,4-disulfanylbutane-2,3-diol|threo-1,4-Dimercapto-2,3-butanediol http://purl.obolibrary.org/obo/CHEBI_18320 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18321 biolink:ChemicalEntity 1-(sn-glycero-3-phospho)-1D-myo-inositol A myo-inositol monophosphate derivative that is 1D-myo-inositol substituted at position 1 by an sn-glycero-3-phospho group. hmdb:HMDB0011649|kegg.compound:C01225|metacyc.compound:CPD-541|reaxys:3219210 Graph 1-(sn-glycero-3-Phospho)-1D-myo-inositol|1-(sn-glycero-3-phospho)-1D-myo-inositol|1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl hydrogen phosphate]|3-Phosphoglyceroinositol|Glyerophosphoinositol|GroPIns|sn-glycero-3-Phospho-1-inositol 1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl hydrogen phosphate] 1-(sn-glycero-3-Phospho)-1D-myo-inositol|1-(sn-glycero-3-phospho)-1D-myo-inositol|1D-myo-inositol 1-[(2R)-2,3-dihydroxypropyl hydrogen phosphate]|3-Phosphoglyceroinositol|Glyerophosphoinositol|GroPIns|sn-glycero-3-Phospho-1-inositol http://purl.obolibrary.org/obo/CHEBI_18321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18322 biolink:ChemicalEntity 6-oxohexanoate A straight-chain fatty acid anion and the conjugate base of 6-oxohexanoic acid, formed by deprotonation of the carboxylic acid group. kegg.compound:C06102|metacyc.compound:6-OXO-HEXANOATE|umbbd.compound:c0112 Graph 6-oxohexanoate|adipate semialdehyde 6-oxohexanoate 6-oxohexanoate|adipate semialdehyde http://purl.obolibrary.org/obo/CHEBI_18322 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18323 biolink:ChemicalEntity anserine A dipeptide comprising of β-alanine and 3-methyl-L-histidine units. cas:584-85-0|hmdb:HMDB0000194|kegg.compound:C01262|metacyc.compound:CPD-401|pubmed:18076890|pubmed:22895378|pubmed:24211545|reaxys:89932 Graph Anserine|N(alpha)-(beta-alanyl)-N(pros)-methylhistidine|beta-Alanyl-N(pai)-methyl-L-histidine|beta-alanyl-3-methyl-L-histidine N(alpha)-(beta-alanyl)-N(pros)-methylhistidine Anserine|N(alpha)-(beta-alanyl)-N(pros)-methylhistidine|beta-Alanyl-N(pai)-methyl-L-histidine|beta-alanyl-3-methyl-L-histidine http://purl.obolibrary.org/obo/CHEBI_18323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183235 biolink:ChemicalEntity 2''-O-crotonyl-ADP-D-ribose Graph 2''-O-(2E)-but-2-enoyl-ADP-D-ribose 2''-O-(2E)-but-2-enoyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_183235 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18325 biolink:ChemicalEntity 2-succinatobenzoate drugbank:DB02251|kegg.compound:C02730 Graph 2-(3-carboxylatopropanoyl)benzoate|2-Succinylbenzoate|2-succinylbenzoate|Succinylbenzoate|o-Succinylbenzoate|o-succinatobenzoate 2-(3-carboxylatopropanoyl)benzoate 2-(3-carboxylatopropanoyl)benzoate|2-Succinylbenzoate|2-succinylbenzoate|Succinylbenzoate|o-Succinylbenzoate|o-succinatobenzoate http://purl.obolibrary.org/obo/CHEBI_18325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183255 biolink:ChemicalEntity lysophosphatidylserine 18:1 A lysophosphatidylserine in which the remaining acyl group (position not specified) contains 18 carbons and 1 double bond. Graph LPS 18:1|LPS(18:1)|Lyso-PS(18:1)|lysophosphatidylserine(18:1) LPS 18:1|LPS(18:1)|Lyso-PS(18:1)|lysophosphatidylserine(18:1) http://purl.obolibrary.org/obo/CHEBI_183255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18327 biolink:ChemicalEntity N-formimidoyl-L-glutamate(2-) A dicarboxylic acid anion resuting from removal of a proton from both carboxy groups of N-formimidoyl-L-glutamic acid. kegg.compound:C00439 Graph (2S)-2-(methanimidamido)pentanedioate|N-methanimidoyl-L-glutamate (2S)-2-(methanimidamido)pentanedioate|N-methanimidoyl-L-glutamate (2S)-2-(methanimidamido)pentanedioate|N-methanimidoyl-L-glutamate http://purl.obolibrary.org/obo/CHEBI_18327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18328 biolink:ChemicalEntity 13-hydroxylupanine cas:15358-48-2|kegg.compound:C02621|knapsack:C00002221 Graph (+)-13alpha-Hydroxylupanine|(2S,7R,7aR,14R,14aR)-2-hydroxydodecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-11-one|13-Hydroxylupanine|13-Hydroxylupinine|13alpha-hydroxyspartein-2-one (2S,7R,7aR,14R,14aR)-2-hydroxydodecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-11-one (+)-13alpha-Hydroxylupanine|(2S,7R,7aR,14R,14aR)-2-hydroxydodecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-11-one|13-Hydroxylupanine|13-Hydroxylupinine|13alpha-hydroxyspartein-2-one http://purl.obolibrary.org/obo/CHEBI_18328 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18329 biolink:ChemicalEntity 5alpha-androstane-3beta,17beta-diol An androstane-3,17-diol that is 5α-androstane substituted by β-hydroxy groups at positions 3 and 17. It is a metabolite of dihydrotestosterone. cas:571-20-0|drugbank:DB03882|hmdb:HMDB0000493|kegg.compound:C12525|lipidmaps:LMST02020053|pdb-ccd:AOM|pubmed:15958594|reaxys:2559488 Graph (3beta,5alpha,17beta)-androstane-3,17-diol|3beta,17beta-dihydroxy-5alpha-androstane|5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL|5-alpha-androstane-3-beta,17-beta-diol|5alpha-Androstan-3beta,17beta-diol|5alpha-androstane-3beta,17beta-diol 5alpha-androstane-3beta,17beta-diol (3beta,5alpha,17beta)-androstane-3,17-diol|3beta,17beta-dihydroxy-5alpha-androstane|5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL|5-alpha-androstane-3-beta,17-beta-diol|5alpha-Androstan-3beta,17beta-diol|5alpha-androstane-3beta,17beta-diol http://purl.obolibrary.org/obo/CHEBI_18329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18330 biolink:ChemicalEntity isovitexin A C-glycosyl compound that consists of apigenin substituted by a 1,5-anhydro-D-glucitol moiety at position 6. cas:29702-25-8|cas:38953-85-4|kegg.compound:C01714|knapsack:C00001059|lipidmaps:LMPK12110338|metacyc.compound:ISOVITEXIN|pubmed:16142640|pubmed:22475010|pubmed:22683902|pubmed:23057589|reaxys:66651|wikipedia.en:Isovitexin Graph (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol|6-C-Glucosylapigenin|6-Glucosylapigenin|Apigenin 6-C-glucoside|Apigenin-6-C-glucoside|Isovitexin|Saponaretin|beta-D-isovitexin (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol|6-C-Glucosylapigenin|6-Glucosylapigenin|Apigenin 6-C-glucoside|Apigenin-6-C-glucoside|Isovitexin|Saponaretin|beta-D-isovitexin http://purl.obolibrary.org/obo/CHEBI_18330 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18331 biolink:ChemicalEntity keratan 6'-sulfate A keratan sulfate with random sulfation at the 6'-position. Graph http://purl.obolibrary.org/obo/CHEBI_18331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18332 biolink:ChemicalEntity L-thyroxine The L-enantiomer of thyroxine. beilstein:2228515|beilstein:7002831|cas:51-48-9|drugbank:DB00451|drugcentral:2646|kegg.compound:C01829|kegg.drug:D08125|lincs.smallmolecule:LSM-5447|pdb-ccd:T44|pubmed:15206581|pubmed:18996189|pubmed:20483419|pubmed:2062236|pubmed:21035598|pubmed:24216002|pubmed:24548294|pubmed:24610609|vsdb:3004|wikipedia.en:Levothyroxine Graph 3,3',5,5'-tetraiodo-L-thyronine|3,5,3',5'-TETRAIODO-L-THYRONINE|3,5,3',5'-tetraiodo-L-thyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodo-L-phenylalanine|L-T4|L-Thyroxine|L-thyroxine|LT4|Levothyroxin|O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-L-tyrosine|T4|levothyroxine L-Thyroxine|L-thyroxine 3,3',5,5'-tetraiodo-L-thyronine|3,5,3',5'-TETRAIODO-L-THYRONINE|3,5,3',5'-tetraiodo-L-thyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodo-L-phenylalanine|L-T4|L-Thyroxine|L-thyroxine|LT4|Levothyroxin|O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-L-tyrosine|T4|levothyroxine http://purl.obolibrary.org/obo/CHEBI_18332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18333 biolink:ChemicalEntity D-arabinitol The D-enantiomer of arabinitol. cas:488-82-4|hmdb:HMDB0000568|kegg.compound:C01904|knapsack:C00001156|pubmed:10921974|pubmed:23261427|pubmed:8204415|reaxys:1720520|wikipedia.en:D-arabinitol Graph D-Arabinitol|D-Arabinol|D-Arabitol|D-Lyxitol|D-arabinitol D-Arabinitol|D-arabinitol D-Arabinitol|D-Arabinol|D-Arabitol|D-Lyxitol|D-arabinitol http://purl.obolibrary.org/obo/CHEBI_18333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18334 biolink:ChemicalEntity adenosine 5'-(pentahydrogen tetraphosphate) A purine ribonucleoside 5'-tetraphosphate having adenine as the nucleobase. kegg.compound:C03483|pdb-ccd:AQP Graph Adenosine 5'-tetraphosphate|Adenosine tetraphosphate|adenosine 5'-(pentahydrogen tetraphosphate) Adenosine 5'-tetraphosphate|adenosine 5'-(pentahydrogen tetraphosphate) Adenosine 5'-tetraphosphate|Adenosine tetraphosphate|adenosine 5'-(pentahydrogen tetraphosphate) http://purl.obolibrary.org/obo/CHEBI_18334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18335 biolink:ChemicalEntity pyridoxamine 5'-phosphate A vitamin B6 phosphate that is the phosphoric ester derivative of pyridoxamine. cas:529-96-4|hmdb:HMDB0001555|kegg.compound:C00647|knapsack:C00007506|pdb-ccd:PMP|pubmed:1783639|pubmed:18491919|pubmed:22445054|pubmed:2580028|reaxys:233653 Graph 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE|Pyridoxamine 5'-phosphate|Pyridoxamine 5'-phosphoric acid|Pyridoxamine 5-phosphate|Pyridoxamine 5-phosphoric acid|Pyridoxamine phosphate|[4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate|pyridoxamine 5'-(dihydrogen phosphate) [4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE|Pyridoxamine 5'-phosphate|Pyridoxamine 5'-phosphoric acid|Pyridoxamine 5-phosphate|Pyridoxamine 5-phosphoric acid|Pyridoxamine phosphate|[4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate|pyridoxamine 5'-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18336 biolink:ChemicalEntity 4-(phosphonooxy)-L-threonine kegg.compound:C06055|pdb-ccd:4TP Graph 4-(Phosphonooxy)-L-threonine|4-(Phosphonooxy)-threonine|4-(phosphonooxy)-L-threonine|O-Phospho-4-hydroxy-L-threonine|O-phospho-4-hydroxy-L-threonine 4-(Phosphonooxy)-L-threonine|4-(phosphonooxy)-L-threonine 4-(Phosphonooxy)-L-threonine|4-(Phosphonooxy)-threonine|4-(phosphonooxy)-L-threonine|O-Phospho-4-hydroxy-L-threonine|O-phospho-4-hydroxy-L-threonine http://purl.obolibrary.org/obo/CHEBI_18336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18337 biolink:ChemicalEntity 5-amino-6-(5-phospho-beta-D-ribosylamino)uracil An N-glycosyl compound that consists of 5,6-diaminouracil in which one of the hydrogens on the 6-amino function is substituted by a 5-phospho-β-D-ribosyl residue. kegg.compound:C01268|knapsack:C00019665 Graph 5-Amino-6-(5'-phosphoribosylamino)uracil|5-Amino-6-(5-phosphoribosylamino)uracil|5-Amino-6-(ribosylamino)-2,4-(1H,3H)-pyrimidinedione 5'-phosphate|N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-O-phosphono-beta-D-ribofuranosylamine|N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-beta-D-ribofuranosylamine 5-(dihydrogen phosphate) N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-O-phosphono-beta-D-ribofuranosylamine|N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-beta-D-ribofuranosylamine 5-(dihydrogen phosphate) 5-Amino-6-(5'-phosphoribosylamino)uracil|5-Amino-6-(5-phosphoribosylamino)uracil|5-Amino-6-(ribosylamino)-2,4-(1H,3H)-pyrimidinedione 5'-phosphate|N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-O-phosphono-beta-D-ribofuranosylamine|N-(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-beta-D-ribofuranosylamine 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_18337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18340 biolink:ChemicalEntity cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid cas:100459-00-5|kegg.compound:C06321|umbbd.compound:c0280 Graph 1,2t-dihydroxycyclohexa-3,5-diene-1r-carboxylic acid|1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylic acid|1,t-2-dihydroxycyclohexa-3,5-diene-r-1-carboxylic acid|rel-(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid rel-(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid 1,2t-dihydroxycyclohexa-3,5-diene-1r-carboxylic acid|1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylic acid|1,t-2-dihydroxycyclohexa-3,5-diene-r-1-carboxylic acid|rel-(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18341 biolink:ChemicalEntity diacetylchitobiosyldiphosphodolichol A chitobiosyldiphosphodolichol compound having two acetyl substituents in unspecified positions. Graph diacetylchitobiosyldiphosphodolichols diacetylchitobiosyldiphosphodolichols http://purl.obolibrary.org/obo/CHEBI_18341 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183424 biolink:ChemicalEntity O-Arachidonoyl ethanolamine cas:287937-12-6|chemspider:4650158|hmdb:HMDB0013655|lipidmaps:LMFA00000014 Graph 2-aminoethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate 2-aminoethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate 2-aminoethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate http://purl.obolibrary.org/obo/CHEBI_183424 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18344 biolink:ChemicalEntity kynurenic acid A quinolinemonocarboxylic acid that is quinoline-2-carboxylic acid substituted by a hydroxy group at C-4. cas:492-27-3|hmdb:HMDB0000715|kegg.compound:C01717|knapsack:C00026453|knapsack:C00026494|lincs.smallmolecule:LSM-24962|metacyc.compound:KYNURENATE|pdb-ccd:KYA|pubmed:10088651|pubmed:10867830|pubmed:10881031|pubmed:11051465|pubmed:11129102|pubmed:11191832|pubmed:11244357|pubmed:11334243|pubmed:11452979|pubmed:11521749|pubmed:11982504|pubmed:12503245|pubmed:12757473|pubmed:12926536|pubmed:14724046|pubmed:14770276|pubmed:15206728|pubmed:15364012|pubmed:15517427|pubmed:15605380|pubmed:15961072|pubmed:16088227|pubmed:16220290|pubmed:16388784|pubmed:16416446|pubmed:16457470|pubmed:16603336|pubmed:16644124|pubmed:16845213|pubmed:16888405|pubmed:16920787|pubmed:17023091|pubmed:17364732|pubmed:17573079|pubmed:17959203|pubmed:18231708|pubmed:18235993|pubmed:18346850|pubmed:18462830|pubmed:18836681|pubmed:18950711|pubmed:19187269|pubmed:19523966|pubmed:19616570|pubmed:19815960|pubmed:19816853|pubmed:22065206|pubmed:22108572|pubmed:22224417|pubmed:22732505|pubmed:22770225|pubmed:22814028|pubmed:22915278|pubmed:23030614|pubmed:7882580|pubmed:8579218|pubmed:8637415|pubmed:9078543|reaxys:147451|wikipedia.en:Kynurenic_acid Graph 4-Hydroxy-2-chinolincarbonsaeure|4-Hydroxy-2-quinolinecarboxylic acid|4-hydroxy-2-quinolinecarboxylic acid|4-hydroxyquinaldic acid|4-hydroxyquinaldinic acid|4-hydroxyquinoline-2-carboxylic acid|Kynurenate|Kynurenic acid|Kynurensaeure 4-hydroxyquinoline-2-carboxylic acid 4-Hydroxy-2-chinolincarbonsaeure|4-Hydroxy-2-quinolinecarboxylic acid|4-hydroxy-2-quinolinecarboxylic acid|4-hydroxyquinaldic acid|4-hydroxyquinaldinic acid|4-hydroxyquinoline-2-carboxylic acid|Kynurenate|Kynurenic acid|Kynurensaeure http://purl.obolibrary.org/obo/CHEBI_18344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18346 biolink:ChemicalEntity vanillin A member of the class of benzaldehydes carrying methoxy and hydroxy substituents at positions 3 and 4 respectively. beilstein:472792|cas:121-33-5|foodb.food:FDB000838|gmelin:3596|hmdb:HMDB0012308|kegg.compound:C00755|kegg.drug:D00091|knapsack:C00002683|knapsack:C00029531|metacyc.compound:VANILLIN|pdb-ccd:V55|pmc:PMC7790484|pmc:PMC8235570|pubmed:18479250|pubmed:19238838|pubmed:19812218|pubmed:21417387|pubmed:21542597|pubmed:21846089|pubmed:22308371|pubmed:29950589|pubmed:31661600|pubmed:33477040|pubmed:33938405|pubmed:34013088|pubmed:34035660|umbbd.compound:c0193|wikipedia.en:Vanillin Graph 3-methoxy-4-hydroxybenzaldehyde|4-Hydroxy-3-methoxy-benzaldehyde|4-Hydroxy-3-methoxybenzaldehyde|4-formyl-2-methoxyphenol|4-hydroxy-3-methoxybenzaldehyde|4-hydroxy-m-anisaldehyde|Vanillaldehyde|Vanillin|methylprotocatechuic aldehyde|p-hydroxy-m-methoxybenzaldehyde|p-vanillin|vaniline|vanillaldehyde|vanillic aldehyde|vanillin 4-Hydroxy-3-methoxybenzaldehyde|4-hydroxy-3-methoxybenzaldehyde 3-methoxy-4-hydroxybenzaldehyde|4-Hydroxy-3-methoxy-benzaldehyde|4-Hydroxy-3-methoxybenzaldehyde|4-formyl-2-methoxyphenol|4-hydroxy-3-methoxybenzaldehyde|4-hydroxy-m-anisaldehyde|Vanillaldehyde|Vanillin|methylprotocatechuic aldehyde|p-hydroxy-m-methoxybenzaldehyde|p-vanillin|vaniline|vanillaldehyde|vanillic aldehyde|vanillin http://purl.obolibrary.org/obo/CHEBI_18346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18347 biolink:ChemicalEntity L-norleucine A non-proteinogenic L-α-amino acid comprising hexanoic acid carrying an amino group at C-2. It does not occur naturally. beilstein:1721750|beilstein:5241165|cas:327-57-1|drugbank:DB04419|gmelin:261032|hmdb:HMDB0001645|kegg.compound:C01933|lipidmaps:LMFA01100042|metacyc.compound:L-2-AMINOHEXANOATE|pdb-ccd:NLE|reaxys:1721750|wikipedia.en:Norleucine Graph (2S)-2-aminohexanoic acid|(S)-2-Aminohexanoic acid|2-Aminocaproic acid|2-Aminohexanoic acid|Caprine|Glycoleucine|L(+)-norleucine|L-(+)-Norleucine|L-(+)-norleucine|L-2-Aminohexanoate|L-2-Aminohexanoic acid|L-Aminohexanoate|L-Aminohexanoic acid|L-Norleucine|L-norleucine|NORLEUCINE|Nle|alpha-aminocaproic acid|norleucine (2S)-2-aminohexanoic acid|2-Aminohexanoic acid|L-Norleucine|L-norleucine (2S)-2-aminohexanoic acid|(S)-2-Aminohexanoic acid|2-Aminocaproic acid|2-Aminohexanoic acid|Caprine|Glycoleucine|L(+)-norleucine|L-(+)-Norleucine|L-(+)-norleucine|L-2-Aminohexanoate|L-2-Aminohexanoic acid|L-Aminohexanoate|L-Aminohexanoic acid|L-Norleucine|L-norleucine|NORLEUCINE|Nle|alpha-aminocaproic acid|norleucine http://purl.obolibrary.org/obo/CHEBI_18347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18348 biolink:ChemicalEntity 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate A phosphatidylinositol bisphosphate in which the two phosphate groups are at C-4 and C-5 of the inositol moiety which has the 1D-myo configuration. kegg.compound:C04637|pubmed:6095072 Graph 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-4',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4,5-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 4,5-bisphosphate|1-Phosphatidyl-D-myo-inositol 4,5-bisphosphate|PIP2|PIPP|Phosphatidyl-myo-inositol 4,5-bisphosphate|Phosphatidylinositol-4,5-bisphosphate|PtsIns(4,5)P2|PtsIns-4,5-P2 1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4,5-bis(dihydrogen phosphate) 1,2-Diacyl-sn-glycero-3-phospho-(1'-myo-inositol-4',5'-bisphosphate)|1-O-(3-sn-phosphatidyl)-1D-myo-inositol 4,5-bis(dihydrogen phosphate)|1-Phosphatidyl-1D-myo-inositol 4,5-bisphosphate|1-Phosphatidyl-D-myo-inositol 4,5-bisphosphate|PIP2|PIPP|Phosphatidyl-myo-inositol 4,5-bisphosphate|Phosphatidylinositol-4,5-bisphosphate|PtsIns(4,5)P2|PtsIns-4,5-P2 http://purl.obolibrary.org/obo/CHEBI_18348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18349 biolink:ChemicalEntity N(1)-(5-phospho-D-ribosyl)glycinamide drugbank:DB02236|kegg.compound:C03838 Graph 5'-Phosphoribosylglycinamide|5'-Phosphoribosylglycineamide|GAR|Glycinamide ribonucleotide|Glycineamide ribonucleotide|Glycineamideribotide|N-glycyl-5-O-phosphono-D-ribofuranosylamine|N-glycyl-D-ribofuranosylamine 5-(dihydrogen phosphate)|N1-(5-Phospho-D-ribosyl)glycinamide N-glycyl-D-ribofuranosylamine 5-(dihydrogen phosphate) 5'-Phosphoribosylglycinamide|5'-Phosphoribosylglycineamide|GAR|Glycinamide ribonucleotide|Glycineamide ribonucleotide|Glycineamideribotide|N-glycyl-5-O-phosphono-D-ribofuranosylamine|N-glycyl-D-ribofuranosylamine 5-(dihydrogen phosphate)|N1-(5-Phospho-D-ribosyl)glycinamide http://purl.obolibrary.org/obo/CHEBI_18349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18350 biolink:ChemicalEntity isoquinolin-1(2H)-one cas:491-30-5|kegg.compound:C06324 Graph 1(2H)-Isoquinolinone|1(2H)-isoquinolinone|Isoquinolin-1(2H)-one|isoquinolin-1(2H)-one Isoquinolin-1(2H)-one|isoquinolin-1(2H)-one 1(2H)-Isoquinolinone|1(2H)-isoquinolinone|Isoquinolin-1(2H)-one|isoquinolin-1(2H)-one http://purl.obolibrary.org/obo/CHEBI_18350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183508 biolink:ChemicalEntity methyl-branched fatty acyl-CoA(4-) A branched-chain fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any methyl-branched-chain fatty acyl-CoA; major species at pH 7.3. Graph methyl-FA-CoA(4-)|methyl-FA-coenzyme A(4-)|methyl-branched fatty acyl-coenzyme A(4-)|methyl-fatty acyl-CoA(4-)|methyl-substituted fatty acyl-CoA(4-)|methyl-substituted fatty acyl-coenzyme A(4-)|methylacyl-CoAs(4-) methyl-FA-CoA(4-)|methyl-FA-coenzyme A(4-)|methyl-branched fatty acyl-coenzyme A(4-)|methyl-fatty acyl-CoA(4-)|methyl-substituted fatty acyl-CoA(4-)|methyl-substituted fatty acyl-coenzyme A(4-)|methylacyl-CoAs(4-) http://purl.obolibrary.org/obo/CHEBI_183508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183509 biolink:ChemicalEntity branched-chain fatty acyl-CoA(4-) A fatty acyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of any branched-chain fatty acyl-CoA; major species at pH 7.3. Graph branched-chain FA-CoA(4-)|branched-chain FA-coenzyme A(4-)|branched-chain fatty acyl-CoAs(4-)|branched-chain fatty acyl-coenzyme A(4-)|branched-chain fatty acyl-coenzyme As(4-) branched-chain FA-CoA(4-)|branched-chain FA-coenzyme A(4-)|branched-chain fatty acyl-CoAs(4-)|branched-chain fatty acyl-coenzyme A(4-)|branched-chain fatty acyl-coenzyme As(4-) http://purl.obolibrary.org/obo/CHEBI_183509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18351 biolink:ChemicalEntity 4-hydroxyhexan-3-one A hexanone that is hexan-3-one substituted by a hydroxy group at position 4. cas:4984-85-4|kegg.compound:C02948|lipidmaps:LMFA12000029|metacyc.compound:CPD-1132|pubmed:17497614|pubmed:19224568|reaxys:1560286 Graph 4-Hydroxy-3-hexanone|4-Hydroxyhexan-3-one|4-hydroxyhexan-3-one|Propioin 4-Hydroxyhexan-3-one|4-hydroxyhexan-3-one 4-Hydroxy-3-hexanone|4-Hydroxyhexan-3-one|4-hydroxyhexan-3-one|Propioin http://purl.obolibrary.org/obo/CHEBI_18351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183510 biolink:ChemicalEntity 2-methylacyl-CoA(4-) A methyl-branched fatty acyl-CoA(4−) arising from the deprotonation of the phosphate and diphosphate OH groups of 2-methylacyl-CoA; major microspecies at pH 7.3. Graph 2-methylacyl-CoAs(4-)|2-methylacyl-coenzyme A(4-) 2-methylacyl-CoAs(4-)|2-methylacyl-coenzyme A(4-) http://purl.obolibrary.org/obo/CHEBI_183510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183511 biolink:ChemicalEntity 2-methylacyl-CoA A methyl-branched fatty acyl-CoA in which the unspecified acyl group carries a methyl substituent at position 2. Graph 2-methylacyl-CoAs|2-methylacyl-coenzyme A 2-methylacyl-CoAs|2-methylacyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_183511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18353 biolink:ChemicalEntity vanillyl alcohol A monomethoxybenzene that is 2-methoxyphenol substituted by a hydroxymethyl group at position 4. cas:498-00-0|hmdb:HMDB0032012|kegg.compound:C06317|pubmed:21705974|pubmed:23615732|pubmed:24508370|pubmed:24725964|reaxys:1910044|umbbd.compound:c0588|wikipedia.en:Vanillyl_alcohol Graph 4-(hydroxymethyl)-2-methoxyphenol|4-Hydroxy-3-methoxy-benzenemethanol|4-Hydroxy-3-methoxybenzenemethanol|4-Hydroxy-3-methoxybenzyl alcohol|4-hydroxy-3-methoxy-benzenemethanol|4-hydroxy-3-methoxybenzenemethanol|4-hydroxy-3-methoxybenzyl alcohol|Vanillyl alcohol 4-(hydroxymethyl)-2-methoxyphenol 4-(hydroxymethyl)-2-methoxyphenol|4-Hydroxy-3-methoxy-benzenemethanol|4-Hydroxy-3-methoxybenzenemethanol|4-Hydroxy-3-methoxybenzyl alcohol|4-hydroxy-3-methoxy-benzenemethanol|4-hydroxy-3-methoxybenzenemethanol|4-hydroxy-3-methoxybenzyl alcohol|Vanillyl alcohol http://purl.obolibrary.org/obo/CHEBI_18353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18354 biolink:ChemicalEntity (R)-2-hydroxypropyl-CoM kegg.compound:C11496|umbbd.compound:c0784 Graph (R)-2-Hydroxypropyl-CoM|(R)-2-hydroxypropyl-CoM|2-(R)-Hydroxypropyl-CoM|2-{[(2R)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid 2-{[(2R)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid (R)-2-Hydroxypropyl-CoM|(R)-2-hydroxypropyl-CoM|2-(R)-Hydroxypropyl-CoM|2-{[(2R)-2-hydroxypropyl]sulfanyl}ethanesulfonic acid http://purl.obolibrary.org/obo/CHEBI_18354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18355 biolink:ChemicalEntity 2-hydroxypenta-2,4-dienoic acid A 5-carbon, bis-unsaturated, α-hydroxy fatty acid metabolite of the proteobacterium substrate 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid (HOPDA). pubmed:16964968 Graph 2-hydroxy-2,4-pentadienoic acid|2-hydroxypenta-2,4-dienoic acid|HPD 2-hydroxypenta-2,4-dienoic acid 2-hydroxy-2,4-pentadienoic acid|2-hydroxypenta-2,4-dienoic acid|HPD http://purl.obolibrary.org/obo/CHEBI_18355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183569 biolink:ChemicalEntity Lucidone chemspider:9428886|lipidmaps:LMPK12120439 Graph 3-hydroxy-4-methoxy-2-[(E)-3-phenylprop-2-enoyl]cyclopenta-2,4-dien-1-one 3-hydroxy-4-methoxy-2-[(E)-3-phenylprop-2-enoyl]cyclopenta-2,4-dien-1-one 3-hydroxy-4-methoxy-2-[(E)-3-phenylprop-2-enoyl]cyclopenta-2,4-dien-1-one http://purl.obolibrary.org/obo/CHEBI_183569 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18357 biolink:ChemicalEntity (R)-noradrenaline The R-enantiomer of noradrenaline. beilstein:4231961|cas:51-41-2|drugbank:DB00368|drugcentral:1960|hmdb:HMDB0000216|kegg.compound:C00547|kegg.drug:D00076|knapsack:C00001424|pdb-ccd:LNR|reaxys:2804840|wikipedia.en:Norepinephrine Graph (-)-arterenol|(-)-noradrenaline|(-)-norepinephrine|(R)-(-)-norepinephrine|(R)-4-(2-amino-1-hydroxyethyl)-1,2-benzenediol|(R)-norepinephrine|4-[(1R)-2-Amino-1-hydroxyethyl]-1,2-benzenediol|4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol|Arterenol|L-NOREPINEPHRINE|L-Noradrenaline|Noradrenaline|Norepinephrine|norepinefrina|norepinephrine|norepinephrinum 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol (-)-arterenol|(-)-noradrenaline|(-)-norepinephrine|(R)-(-)-norepinephrine|(R)-4-(2-amino-1-hydroxyethyl)-1,2-benzenediol|(R)-norepinephrine|4-[(1R)-2-Amino-1-hydroxyethyl]-1,2-benzenediol|4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol|Arterenol|L-NOREPINEPHRINE|L-Noradrenaline|Noradrenaline|Norepinephrine|norepinefrina|norepinephrine|norepinephrinum http://purl.obolibrary.org/obo/CHEBI_18357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18358 biolink:ChemicalEntity methoxsalen A member of the class of psoralens that is 7H-furo[3,2-g]chromen-7-one in which the 9 position is substituted by a methoxy group. It is a constituent of the fruits of Ammi majus. Like other psoralens, trioxsalen causes photosensitization of the skin. It is administered topically or orally in conjunction with UV-A for phototherapy treatment of vitiligo and severe psoriasis. cas:298-81-7|drugbank:DB00553|drugcentral:30|hmdb:HMDB0014693|kegg.compound:C01864|kegg.drug:D00139|knapsack:C00000576|lincs.smallmolecule:LSM-3410|patent:US2889337|pdb-ccd:8MO|pubmed:15009205|pubmed:28166217|pubmed:7945434|reaxys:196453|wikipedia.en:Methoxsalen Graph 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone|8-MOP|8-MP|8-Methoxyfuranocoumarin|8-Methoxypsoralen|8-methoxy-2',3',6,7-furocoumarin|8-methoxy-4',5':6,7-furocoumarin|8-methoxy-[furano-3'.2':6.7-coumarin]|8-methoxypsoralen|9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one|9-methoxy-7H-furo[3,2-g]chromen-7-one|METHOXSALEN|Meladinine|Meloxine|Methoxsalen|O-Methylxanthotoxol|O-methylxanthotoxol|Oxsoralen|Ultra Mop|Uvadex|Xanthotoxin|xanthotoxin 9-methoxy-7H-furo[3,2-g]chromen-7-one 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone|8-MOP|8-MP|8-Methoxyfuranocoumarin|8-Methoxypsoralen|8-methoxy-2',3',6,7-furocoumarin|8-methoxy-4',5':6,7-furocoumarin|8-methoxy-[furano-3'.2':6.7-coumarin]|8-methoxypsoralen|9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one|9-methoxy-7H-furo[3,2-g]chromen-7-one|METHOXSALEN|Meladinine|Meloxine|Methoxsalen|O-Methylxanthotoxol|O-methylxanthotoxol|Oxsoralen|Ultra Mop|Uvadex|Xanthotoxin|xanthotoxin http://purl.obolibrary.org/obo/CHEBI_18358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18359 biolink:ChemicalEntity holo-[acyl-carrier protein] kegg.compound:C00229 Graph ACP|Acyl-carrier protein|[Acyl-carrier protein] ACP|Acyl-carrier protein|[Acyl-carrier protein] http://purl.obolibrary.org/obo/CHEBI_18359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18360 biolink:ChemicalEntity 13-(2-methylcrotonoyloxy)lupanine kegg.compound:C04170 Graph (+)-13alpha-Tigloyloxylupanine|(2S,7R,7aR,14R,14aR)-11-oxododecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-2-yl (2E)-2-methylbut-2-enoate|13-(2-Methylcrotonoyl)oxylupanine|13-(2-Methylcrotonoyl)oxylupinine|2-oxospartein-13beta-yl 2-methylcrotonate (2S,7R,7aR,14R,14aR)-11-oxododecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-2-yl (2E)-2-methylbut-2-enoate (+)-13alpha-Tigloyloxylupanine|(2S,7R,7aR,14R,14aR)-11-oxododecahydro-2H,11H-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocin-2-yl (2E)-2-methylbut-2-enoate|13-(2-Methylcrotonoyl)oxylupanine|13-(2-Methylcrotonoyl)oxylupinine|2-oxospartein-13beta-yl 2-methylcrotonate http://purl.obolibrary.org/obo/CHEBI_18360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18361 biolink:ChemicalEntity diphosphate(4-) cas:14000-31-8|gmelin:26938|kegg.compound:C00013|pdb-ccd:DPO Graph DIPHOSPHATE|Diphosphat|Diphosphate|P2O7(4-)|PPi|Pyrophosphat|Pyrophosphate|[O3POPO3](4-)|diphosphate|mu-oxido-bis(trioxidophosphate)(4-)|mu-oxo-hexaoxodiphosphate|pyrophosphate ion DIPHOSPHATE|diphosphate|mu-oxido-bis(trioxidophosphate)(4-)|mu-oxo-hexaoxodiphosphate DIPHOSPHATE|Diphosphat|Diphosphate|P2O7(4-)|PPi|Pyrophosphat|Pyrophosphate|[O3POPO3](4-)|diphosphate|mu-oxido-bis(trioxidophosphate)(4-)|mu-oxo-hexaoxodiphosphate|pyrophosphate ion http://purl.obolibrary.org/obo/CHEBI_18361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18362 biolink:ChemicalEntity 17-O-deacetylvindoline A vinca alkaloid that is vindoline in which the acetate ester group at position 17 has been hydrolysed to give the corresponding secondary alcohol. kegg.compound:C01091|knapsack:C00024529|reaxys:63743|wikipedia.en:Deacetylvindoline Graph 17-O-Deacetylvindoline|17-O-deacetylvindoline|Deacetylvindoline|Desacetylvindoline|methyl (2beta,3beta,4beta,5alpha,12beta,19alpha)-3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate|methyl 3beta,4beta-dihydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate methyl 3beta,4beta-dihydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate 17-O-Deacetylvindoline|17-O-deacetylvindoline|Deacetylvindoline|Desacetylvindoline|methyl (2beta,3beta,4beta,5alpha,12beta,19alpha)-3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate|methyl 3beta,4beta-dihydroxy-16-methoxy-1-methyl-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate http://purl.obolibrary.org/obo/CHEBI_18362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18363 biolink:ChemicalEntity reticulinylium A benzylisoquinoline alkaloid that is obtained by selective dehydrogenation at the 1,2-position of reticuline. cas:16202-17-8|kegg.compound:C06167|knapsack:C00027111|pubmed:15081299|pubmed:15921406|reaxys:4158880 Graph 1,2-Dehydroreticuline|1,2-Dehydroreticulinium|1,2-dehydroreticuline|3,4-Dihydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(methyl-14C)-isoquinolinium|7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolinium 7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolinium 1,2-Dehydroreticuline|1,2-Dehydroreticulinium|1,2-dehydroreticuline|3,4-Dihydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(methyl-14C)-isoquinolinium|7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolinium http://purl.obolibrary.org/obo/CHEBI_18363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183638 biolink:ChemicalEntity ketanserin(1+) A piperidinium ion obtained by protonation of the piperidine nitrogen of ketanserin; major microspecies at pH 7.3. Graph 1-[2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)ethyl]-4-(4-fluorobenzoyl)piperidinium|ketanserin cation 1-[2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)ethyl]-4-(4-fluorobenzoyl)piperidinium 1-[2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)ethyl]-4-(4-fluorobenzoyl)piperidinium|ketanserin cation http://purl.obolibrary.org/obo/CHEBI_183638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183639 biolink:ChemicalEntity SRT 1720 cas:925434-55-5 Graph N-{2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}quinoxaline-2-carboxamide|SRT-1720|SRT1720 N-{2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}quinoxaline-2-carboxamide N-{2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}quinoxaline-2-carboxamide|SRT-1720|SRT1720 http://purl.obolibrary.org/obo/CHEBI_183639 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:18364 biolink:ChemicalEntity 14-demethyllanosterol A 3β-sterol formed formally by loss of a methyl group from the 14-position of lanosterol. cas:7448-02-4|kegg.compound:C05108|knapsack:C00023776|reaxys:2302110 Graph (3beta,5alpha)-4,4-dimethylcholesta-8,24-dien-3-ol|14-Demethyllanosterol|14-desmethyllanosterol|4,4-Dimethyl-5alpha-cholesta-8,24-dien-3beta-ol|4,4-Dimethyl-8,24-cholestadienol|4,4-dimethyl-5-alpha-cholesta-8,24-dien-3-beta-ol|4,4-dimethyl-5alpha-cholesta-8,24-dien-3beta-ol|4,4-dimethylcholesta-8(9),24-dien-3beta-ol|4,4-dimethylzymosterol 4,4-Dimethyl-5alpha-cholesta-8,24-dien-3beta-ol|4,4-dimethyl-5alpha-cholesta-8,24-dien-3beta-ol (3beta,5alpha)-4,4-dimethylcholesta-8,24-dien-3-ol|14-Demethyllanosterol|14-desmethyllanosterol|4,4-Dimethyl-5alpha-cholesta-8,24-dien-3beta-ol|4,4-Dimethyl-8,24-cholestadienol|4,4-dimethyl-5-alpha-cholesta-8,24-dien-3-beta-ol|4,4-dimethyl-5alpha-cholesta-8,24-dien-3beta-ol|4,4-dimethylcholesta-8(9),24-dien-3beta-ol|4,4-dimethylzymosterol http://purl.obolibrary.org/obo/CHEBI_18364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18365 biolink:ChemicalEntity naphthalene-1,3,6,8-tetrol A naphthalenetetrol that is naphthalene substituted by hydroxy groups at positions 1, 3, 6 and 8. cas:18512-30-6|kegg.compound:C04033|knapsack:C00000548 Graph 1,3,6,8-Naphthalenetetrol|1,3,6,8-Tetrahydroxynaphthalene|naphthalene-1,3,6,8-tetrol naphthalene-1,3,6,8-tetrol 1,3,6,8-Naphthalenetetrol|1,3,6,8-Tetrahydroxynaphthalene|naphthalene-1,3,6,8-tetrol http://purl.obolibrary.org/obo/CHEBI_18365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18366 biolink:ChemicalEntity Arg-tRNA(Arg) kegg.compound:C02163 Graph Arg-tRNA(Arg)|L-Arginyl-tRNA|L-Arginyl-tRNA(Arg) Arg-tRNA(Arg)|L-Arginyl-tRNA|L-Arginyl-tRNA(Arg) http://purl.obolibrary.org/obo/CHEBI_18366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18367 biolink:ChemicalEntity phosphate(3-) A phosphate ion that is the conjugate base of hydrogenphosphate. cas:14265-44-2|gmelin:1997|kegg.compound:C00009|pdb-ccd:PO4|reaxys:3903772|wikipedia.en:Phosphate Graph Orthophosphate|PHOSPHATE ION|PO4(3-)|Phosphate|[PO4](3-)|phosphate|tetraoxidophosphate(3-)|tetraoxophosphate(3-)|tetraoxophosphate(V) Phosphate|phosphate|tetraoxidophosphate(3-)|tetraoxophosphate(3-)|tetraoxophosphate(V) Orthophosphate|PHOSPHATE ION|PO4(3-)|Phosphate|[PO4](3-)|phosphate|tetraoxidophosphate(3-)|tetraoxophosphate(3-)|tetraoxophosphate(V) http://purl.obolibrary.org/obo/CHEBI_18367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18368 biolink:ChemicalEntity D-glucosyl-N-acylsphingosine Sphingosine substituted at the 1-hydroxy group by a D-glucosyl group and at the 2-amino group by an acyl group. kegg.compound:C01190|kegg.glycan:G10238|metacyc.compound:Glucosyl-Cermaides|pubmed:10951276|pubmed:10970788|pubmed:12649340|pubmed:19443184|pubmed:20919653 Graph D-Glucosyl-N-acylsphingosine|Glucocerebroside|Glucosylceramide|N-acyl-D-glucosylsphingosine D-Glucosyl-N-acylsphingosine|Glucocerebroside|Glucosylceramide|N-acyl-D-glucosylsphingosine http://purl.obolibrary.org/obo/CHEBI_18368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18370 biolink:ChemicalEntity 7-deoxyloganin cas:26660-57-1|kegg.compound:C06071|knapsack:C00003077 Graph 7-Deoxyloganin|7-deoxyloganin|Deoxyloganin|methyl (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate methyl (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate 7-Deoxyloganin|7-deoxyloganin|Deoxyloganin|methyl (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate http://purl.obolibrary.org/obo/CHEBI_18370 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18371 biolink:ChemicalEntity cis-4-carboxymethylenebut-2-en-4-olide beilstein:3649017|cas:3374-46-7|cas:73237-79-3|kegg.compound:C04431|umbbd.compound:c0299 Graph (2E)-(5-oxofuran-2(5H)-ylidene)acetic acid|(5-oxo-2(5H)-furanylidene)acetic acid|4-Carboxymethylenebut-2-en-4-olide|cis-4-Carboxymethylenebut-2-en-4-olide (2E)-(5-oxofuran-2(5H)-ylidene)acetic acid (2E)-(5-oxofuran-2(5H)-ylidene)acetic acid|(5-oxo-2(5H)-furanylidene)acetic acid|4-Carboxymethylenebut-2-en-4-olide|cis-4-Carboxymethylenebut-2-en-4-olide http://purl.obolibrary.org/obo/CHEBI_18371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18372 biolink:ChemicalEntity 7,8-dihydroneopterin 3'-triphosphate kegg.compound:C04895|knapsack:C00007510 Graph (2R,3S)-3-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)-2,3-dihydroxypropyl tetrahydrogen triphosphate|2-Amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate|6-(L-erythro-1,2-Dihydroxypropyl 3-triphosphate)-7,8-dihydropterin|6-(L-erythro-1,2-dihydroxy-3-triphosphooxypropyl)-7,8-dihydropterin|6-[(1S,2R)-1,2-Dihydroxy-3-triphosphooxypropyl]-7,8-dihydropterin|7,8-Dihydroneopterin 3'-triphosphate|7,8-dihydroneopterin 3'-triphosphate (2R,3S)-3-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)-2,3-dihydroxypropyl tetrahydrogen triphosphate (2R,3S)-3-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)-2,3-dihydroxypropyl tetrahydrogen triphosphate|2-Amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate|6-(L-erythro-1,2-Dihydroxypropyl 3-triphosphate)-7,8-dihydropterin|6-(L-erythro-1,2-dihydroxy-3-triphosphooxypropyl)-7,8-dihydropterin|6-[(1S,2R)-1,2-Dihydroxy-3-triphosphooxypropyl]-7,8-dihydropterin|7,8-Dihydroneopterin 3'-triphosphate|7,8-dihydroneopterin 3'-triphosphate http://purl.obolibrary.org/obo/CHEBI_18372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18373 biolink:ChemicalEntity (7S)-salutaridinol beilstein:1552912|kegg.compound:C05220 Graph 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7alpha-diol|5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol|Salutaridinol|salutaridinol-II 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7alpha-diol 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7alpha-diol|5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol|Salutaridinol|salutaridinol-II http://purl.obolibrary.org/obo/CHEBI_18373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18374 biolink:ChemicalEntity 1-(5-phospho-beta-D-ribosyl)-5'-AMP An AMP-sugar in which the hydrogen at position 1 of AMP is substituted by a 5-phospho-β-D-ribosyl group. kegg.compound:C02741|knapsack:C00007241|reaxys:7064825 Graph 1-(5-O-phosphono-beta-D-ribofuranosyl)adenosine 5'-(dihydrogen phosphate)|1-(5-Phospho-beta-D-ribosyl)-AMP|1-(5-Phosphoribosyl)-AMP|1-(5-phospho-beta-D-ribofuranosyl)-5'-adenylic acid|5-phosphoribosyl-AMP|N1-(5-Phospho-D-ribosyl)-AMP|Phosphoribosyl-AMP 1-(5-O-phosphono-beta-D-ribofuranosyl)adenosine 5'-(dihydrogen phosphate)|1-(5-phospho-beta-D-ribofuranosyl)-5'-adenylic acid 1-(5-O-phosphono-beta-D-ribofuranosyl)adenosine 5'-(dihydrogen phosphate)|1-(5-Phospho-beta-D-ribosyl)-AMP|1-(5-Phosphoribosyl)-AMP|1-(5-phospho-beta-D-ribofuranosyl)-5'-adenylic acid|5-phosphoribosyl-AMP|N1-(5-Phospho-D-ribosyl)-AMP|Phosphoribosyl-AMP http://purl.obolibrary.org/obo/CHEBI_18374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18375 biolink:ChemicalEntity nucleoside 3',5'-cyclic phosphate A ribosyl or deoxyribosyl derivative of a pyrimidine or purine base in which C-3 and C-5 of the ribose ring are engaged in formation of a cyclic mono-, di-, tri- or tetra-phosphate. Graph nucleoside 3',5'-cyclic phosphates nucleoside 3',5'-cyclic phosphates http://purl.obolibrary.org/obo/CHEBI_18375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18376 biolink:ChemicalEntity dermatan sulfate Any of a group of glycosaminoglycans with repeating units consisting of variously sulfated β1→4-linked L-iduronyl-(α1→3)-N-acetyl-D-galactosamine units. beilstein:8390617|cas:24967-94-0|kegg.compound:C00426 Graph Chondroitin sulfate B|Dermatan L-iduronate|beta-Heparin Chondroitin sulfate B|Dermatan L-iduronate|beta-Heparin http://purl.obolibrary.org/obo/CHEBI_18376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18377 biolink:ChemicalEntity N-formylkynurenine cas:1022-31-7|foodb.food:FDB022486|hmdb:HMDB0001200|knapsack:C00058937|pubmed:1018016|pubmed:1086300|pubmed:1187809|pubmed:19353782|pubmed:20408979|pubmed:21254311|pubmed:21527632|pubmed:21770952|pubmed:21892828|pubmed:22860088|pubmed:23314482|pubmed:25907332|pubmed:26560839|pubmed:38649417|pubmed:4275312|pubmed:4674628|pubmed:4819957|pubmed:4835227|pubmed:5168391|pubmed:7118867|pubmed:8766816 Graph 2-amino-4-(2-formamidophenyl)-4-oxo-butanoic acid|2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid|3-(2-formamidobenzoyl)alanine|N'-formylkynurenine|N-formylkynurenine|alpha-amino-2-(formylamino)-gamma-oxobenzenebutanoic acid|formylkynurenine 2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid 2-amino-4-(2-formamidophenyl)-4-oxo-butanoic acid|2-amino-4-(2-formamidophenyl)-4-oxobutanoic acid|3-(2-formamidobenzoyl)alanine|N'-formylkynurenine|N-formylkynurenine|alpha-amino-2-(formylamino)-gamma-oxobenzenebutanoic acid|formylkynurenine http://purl.obolibrary.org/obo/CHEBI_18377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18379 biolink:ChemicalEntity nitrile A compound having the structure RC≡N; thus a C-substituted derivative of hydrocyanic acid, HC≡N. In systematic nomenclature, the suffix nitrile denotes the triply bound ≡N atom, not the carbon atom attached to it. kegg.compound:C00726 Graph Nitril|Nitrile|R-CN|a nitrile|nitrile|nitriles|nitrilos nitriles Nitril|Nitrile|R-CN|a nitrile|nitrile|nitriles|nitrilos http://purl.obolibrary.org/obo/CHEBI_18379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183798 biolink:ChemicalEntity CE(20:4) A cholesterol ester in which the acyl group contains 20 carbons in total and 4 double bonds. Graph CE 20:4|ChE 20:4|cholesterol ester 20:4|cholesterol ester(20:4) CE 20:4|ChE 20:4|cholesterol ester 20:4|cholesterol ester(20:4) http://purl.obolibrary.org/obo/CHEBI_183798 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18381 biolink:ChemicalEntity 5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide beilstein:58077|kegg.compound:C04734|pdb-ccd:FAI Graph 1-(4-carbamoyl-5-formamido-1H-imidazol-1-yl)-1-deoxy-D-ribofuranose 5-(dihydrogen phosphate)|1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide|1-(5'-phosphoribosyl)-5-formamido-4-imidazolecarboxamide|5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide|5'-phosphoribosyl-5-formamido-4-imidazolecarboxamide|5-Formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-Formamido-1-(5-phosphoribosyl)imidazole-4-carboxamide|5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-formamido-1-(5-phosphoribosyl)imidazole-4-carboxamide|FAICAR 1-(4-carbamoyl-5-formamido-1H-imidazol-1-yl)-1-deoxy-D-ribofuranose 5-(dihydrogen phosphate) 1-(4-carbamoyl-5-formamido-1H-imidazol-1-yl)-1-deoxy-D-ribofuranose 5-(dihydrogen phosphate)|1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide|1-(5'-phosphoribosyl)-5-formamido-4-imidazolecarboxamide|5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide|5'-phosphoribosyl-5-formamido-4-imidazolecarboxamide|5-Formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-Formamido-1-(5-phosphoribosyl)imidazole-4-carboxamide|5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-formamido-1-(5-phosphoribosyl)imidazole-4-carboxamide|FAICAR http://purl.obolibrary.org/obo/CHEBI_18381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183811 biolink:ChemicalEntity Moxidectin cas:113507-06-5|chemspider:22901017|drugbank:DB11431|drugcentral:5286|kegg.drug:D05084 Graph (1R,4S,4'E,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,4'E,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,4'E,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_183811 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18383 biolink:ChemicalEntity 3-aminoalanine A diamino acid that is alanine in which one of the hydrogens of the methyl group is replaced by an amino group. cas:515-94-6|kegg.compound:C06393|metacyc.compound:CPD-1782|pubmed:20480482|pubmed:24144917|reaxys:1721398 Graph 2,3-Diaminopropanoate|2,3-Diaminopropanoic acid|2,3-Diaminopropionate|2,3-Diaminopropionic acid|2,3-diaminopropanoic acid|2,3-diaminopropionic acid|Dap|Dpr 2,3-Diaminopropanoate|2,3-Diaminopropanoic acid|2,3-diaminopropanoic acid 2,3-Diaminopropanoate|2,3-Diaminopropanoic acid|2,3-Diaminopropionate|2,3-Diaminopropionic acid|2,3-diaminopropanoic acid|2,3-diaminopropionic acid|Dap|Dpr http://purl.obolibrary.org/obo/CHEBI_18383 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18384 biolink:ChemicalEntity 1D-myo-inositol 4-phosphate cas:46495-39-0|kegg.compound:C03546 Graph 1D-myo-Inositol 4-monophosphate|1D-myo-Inositol 4-phosphate|1D-myo-inositol 4-(dihydrogen phosphate)|D-myo-Inositol 4-phosphate 1D-myo-Inositol 4-phosphate|1D-myo-inositol 4-(dihydrogen phosphate) 1D-myo-Inositol 4-monophosphate|1D-myo-Inositol 4-phosphate|1D-myo-inositol 4-(dihydrogen phosphate)|D-myo-Inositol 4-phosphate http://purl.obolibrary.org/obo/CHEBI_18384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18385 biolink:ChemicalEntity thiamine(1+) A primary alcohol that is 1,3-thiazol-3-ium substituted by (4-amino-2-methylpyrimidin-5-yl)methyl, methyl and 2-hydroxyethyl groups at positions 3, 4 and 5, respectively. beilstein:3595616|cas:70-16-6|chemspider:1098|drugbank:DB00152|drugcentral:2832|foodb.food:FDB008424|gmelin:334462|hmdb:HMDB0000235|kegg.compound:C00378|knapsack:C00000775|lincs.smallmolecule:LSM-5996|metacyc.compound:THIAMINE|pdb-ccd:VIB|pubmed:10436256|pubmed:10542220|pubmed:10883001|pubmed:11015250|pubmed:11435118|pubmed:11899071|pubmed:11977806|pubmed:12111441|pubmed:1538220|pubmed:15451668|pubmed:15862682|pubmed:16645728|pubmed:17964830|pubmed:18652651|pubmed:21706007|pubmed:21848803|pubmed:24079939|pubmed:24768306|pubmed:7291135|pubmed:7731897|pubmed:7733128|pubmed:8192530|pubmed:8205249|pubmed:8522961|pubmed:8619543|pubmed:9387133|wikipedia.en:Thiamine Graph 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM|3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium|Aneurin|Antiberiberi factor|Thiamin|Thiamine|Vitamin B1|thiamine|thiamine cation|thiamine ion|thiamine(1+) ion|thiaminium|vitamin B1 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM|3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium|Aneurin|Antiberiberi factor|Thiamin|Thiamine|Vitamin B1|thiamine|thiamine cation|thiamine ion|thiamine(1+) ion|thiaminium|vitamin B1 http://purl.obolibrary.org/obo/CHEBI_18385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18386 biolink:ChemicalEntity quinaldic acid A quinolinemonocarboxylic acid having the carboxy group at the 2-position. cas:93-10-7|drugbank:DB02428|gmelin:143145|hmdb:HMDB0000842|kegg.compound:C06325|pubmed:23801834|pubmed:801703|reaxys:126322 Graph 2-Chinolincarbonsaeure|2-Quinolinecarboxylate|2-Quinolinecarboxylic acid|2-carboxyquinoline|Chinaldinsaeure|QUINALDIC ACID|Quinaldate|Quinaldic acid|Quinaldinic acid|quinoline-2-carboxylic acid quinoline-2-carboxylic acid 2-Chinolincarbonsaeure|2-Quinolinecarboxylate|2-Quinolinecarboxylic acid|2-carboxyquinoline|Chinaldinsaeure|QUINALDIC ACID|Quinaldate|Quinaldic acid|Quinaldinic acid|quinoline-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_18386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18387 biolink:ChemicalEntity N-formimidoyl-L-aspartate(2-) A dicarboxylic acid anion resuting from removal of a proton from both carboxy groups of N-formimidoyl-L-aspartic acid. Graph (2S)-2-(methanimidamido)butanedioate|N-methanimidoyl-L-aspartate (2S)-2-(methanimidamido)butanedioate|N-methanimidoyl-L-aspartate (2S)-2-(methanimidamido)butanedioate|N-methanimidoyl-L-aspartate http://purl.obolibrary.org/obo/CHEBI_18387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18388 biolink:ChemicalEntity apigenin A trihydroxyflavone that is flavone substituted by hydroxy groups at positions 4', 5 and 7. It induces autophagy in leukaemia cells. cas:520-36-5|hmdb:HMDB0002124|kegg.compound:C01477|knapsack:C00003817|lincs.smallmolecule:LSM-5206|lipidmaps:LMPK12110005|metacyc.compound:CPD-431|pdb-ccd:AGI|pubmed:23304222|pubmed:23344191|pubmed:23354402|pubmed:23359392|pubmed:28166217|reaxys:262620|wikipedia.en:Apigenin Graph 2-(p-hydroxyphenyl)-5,7-dihydroxychromone|4',5,7-Trihydroxyflavone|5,7,4'-Trihydroxyflavone|5,7-dihydroxy-2-(4-hydroxyphenyl)-4-benzopyrone|5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|Apigenin|C.I. Natural Yellow 1|chamomile|spigenin|versulin 5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 2-(p-hydroxyphenyl)-5,7-dihydroxychromone|4',5,7-Trihydroxyflavone|5,7,4'-Trihydroxyflavone|5,7-dihydroxy-2-(4-hydroxyphenyl)-4-benzopyrone|5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|Apigenin|C.I. Natural Yellow 1|chamomile|spigenin|versulin http://purl.obolibrary.org/obo/CHEBI_18388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18390 biolink:ChemicalEntity N-acyl-beta-D-galactosylsphingosine An N-acyl-D-galactosylsphingosine in which the anomeric configuration of the galactosyl residue is β; sphingosine substituted at the O-1 position by a β-D-galactosyl group and at the N-2 position by an acyl group. kegg.compound:C02686|kegg.glycan:G11121|pubmed:16083805|pubmed:1620344|pubmed:27485170|pubmed:8866432 Graph 1-O-D-galactopyranosyl-2-N-acylsphingosine|1-O-beta-D-galactopyranosylceramide|Cerebroside|D-Galactosyl-N-acylsphingosine|D-Galactosylceramide|GalC|Galactocerebroside|Galactosylceramide|a beta-D-galactosyl-(1<->1')-N-acylsphing-4-enine|beta-GalCer|beta-galactosyl-(1->1)-ceramide|galactocerebrosides|ganglioside GL1b 1-O-D-galactopyranosyl-2-N-acylsphingosine|1-O-beta-D-galactopyranosylceramide|Cerebroside|D-Galactosyl-N-acylsphingosine|D-Galactosylceramide|GalC|Galactocerebroside|Galactosylceramide|a beta-D-galactosyl-(1<->1')-N-acylsphing-4-enine|beta-GalCer|beta-galactosyl-(1->1)-ceramide|galactocerebrosides|ganglioside GL1b http://purl.obolibrary.org/obo/CHEBI_18390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183905 biolink:ChemicalEntity Biphenylindanone a chemspider:8044271 Graph 4-[3-[(2-cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydroinden-5-yl)oxymethyl]phenyl]benzoic acid 4-[3-[(2-cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydroinden-5-yl)oxymethyl]phenyl]benzoic acid 4-[3-[(2-cyclopentyl-6,7-dimethyl-1-oxo-2,3-dihydroinden-5-yl)oxymethyl]phenyl]benzoic acid http://purl.obolibrary.org/obo/CHEBI_183905 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18391 biolink:ChemicalEntity D-gluconate A gluconate having D-configuration. gmelin:83544|hmdb:HMDB0000625|kegg.compound:C00257|metacyc.compound:GLUCONATE|pubmed:17439666|reaxys:3906521 Graph 2,3,4,5,6-pentahydroxyhexanoate|D-gluconate|Dextronate|Glycogenate|Glyconate|Maltonate D-gluconate 2,3,4,5,6-pentahydroxyhexanoate|D-gluconate|Dextronate|Glycogenate|Glyconate|Maltonate http://purl.obolibrary.org/obo/CHEBI_18391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18392 biolink:ChemicalEntity bis(beta-glucosyluronic acid)bilirubin cas:17459-92-6|kegg.compound:C05787 Graph 1,1'-di-O-{3,3'-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-diene-8,12-diyl]dipropanoyl}bis(beta-D-glucopyranuronic acid)|Bilirubin beta-diglucuronide|Bilirubin-bisglucuronoside 1,1'-di-O-{3,3'-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-diene-8,12-diyl]dipropanoyl}bis(beta-D-glucopyranuronic acid) 1,1'-di-O-{3,3'-[8-(carboxyethyl)-2,17-diethenyl-2,7,13,18-tetramethyl-1,19-dioxo-21,24-dihydrobila-4,15-diene-8,12-diyl]dipropanoyl}bis(beta-D-glucopyranuronic acid)|Bilirubin beta-diglucuronide|Bilirubin-bisglucuronoside http://purl.obolibrary.org/obo/CHEBI_18392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:183921 biolink:ChemicalEntity Glutathione ethyl ester cas:24425-52-3|chemspider:96831 Graph (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-ethylsulanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-ethylsulanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-ethylsulanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid http://purl.obolibrary.org/obo/CHEBI_183921 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18393 biolink:ChemicalEntity naphthalene-1,3,8-triol A naphthalenetriol that is naphthalene substituted by hydroxy groups at positions 1, 3 and 8. kegg.compound:C01173 Graph 1,3,8-Naphthalenertriol|1,3,8-Trihydroxynaphthalene|1,3,8-trihydroxynaphthalene|naphthalene-1,3,8-triol naphthalene-1,3,8-triol 1,3,8-Naphthalenertriol|1,3,8-Trihydroxynaphthalene|1,3,8-trihydroxynaphthalene|naphthalene-1,3,8-triol http://purl.obolibrary.org/obo/CHEBI_18393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18394 biolink:ChemicalEntity 6-O-alpha-D-glucopyranosyl-D-fructofuranose A glycosylfructose that is D-fructofuranose attached to a α-D-glucopyranosyl unit at position 6 via a glycosidic linkage. It is found in honey and sugarcane. beilstein:1435314|cas:13718-94-0|cas:15132-06-6|kegg.compound:C01742|kegg.glycan:G01241|metacyc.compound:CPD-230|patent:EP1328647|patent:WO0218603|pubmed:17548953|pubmed:21895946|pubmed:22133441|pubmed:22264450|pubmed:24866943|reaxys:1435314 Graph 6-O-alpha-D-Glucopyranosyl-D-fructofuranose|6-O-alpha-D-glucopyranosyl-D-fructofuranose|6-O-alpha-D-glucopyranosyl-D-fructose|Palatinose|isomaltulose 6-O-alpha-D-Glucopyranosyl-D-fructofuranose|6-O-alpha-D-glucopyranosyl-D-fructofuranose 6-O-alpha-D-Glucopyranosyl-D-fructofuranose|6-O-alpha-D-glucopyranosyl-D-fructofuranose|6-O-alpha-D-glucopyranosyl-D-fructose|Palatinose|isomaltulose http://purl.obolibrary.org/obo/CHEBI_18394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18395 biolink:ChemicalEntity 2-dehydropantolactone cas:13031-04-4|kegg.compound:C01125 Graph 2-Dehydropantolactone|2-Dehydropantoyl lactone|2-dehydropantolactone|4,4-dimethyl-4,5-dihydrofuran-2,3-dione|Dihydro-4,4-dimethyl-2,3-Furandione 4,4-dimethyl-4,5-dihydrofuran-2,3-dione 2-Dehydropantolactone|2-Dehydropantoyl lactone|2-dehydropantolactone|4,4-dimethyl-4,5-dihydrofuran-2,3-dione|Dihydro-4,4-dimethyl-2,3-Furandione http://purl.obolibrary.org/obo/CHEBI_18395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18396 biolink:ChemicalEntity beta-D-mannosyldiacetylchitobiosyldiphosphodolichol kegg.compound:C05860|kegg.glycan:G00003 Graph beta-1,4-D-Mannosylchitobiosyldiphosphodolichol|beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol beta-1,4-D-Mannosylchitobiosyldiphosphodolichol|beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol http://purl.obolibrary.org/obo/CHEBI_18396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18397 biolink:ChemicalEntity 2-phenylethylamine A phenylethylamine having the phenyl substituent at the 2-position. cas:64-04-0|drugbank:DB04325|ecmdb:ECMDB02654|gmelin:50120|hmdb:HMDB0012275|kegg.compound:C05332|knapsack:C00001426|pdb-ccd:PEA|pubmed:20390105|pubmed:21191624|pubmed:23225177|pubmed:23564683|pubmed:7906896|reaxys:507488|wikipedia.en:2-phenylethylamine Graph 2-Phenylethylamine|2-phenylethanamine|Phenethylamine|Phenylethylamine|benzeneethanamine|beta-Phenylethylamine|beta-aminoethylbenzene|beta-phenethylamine 2-phenylethanamine 2-Phenylethylamine|2-phenylethanamine|Phenethylamine|Phenylethylamine|benzeneethanamine|beta-Phenylethylamine|beta-aminoethylbenzene|beta-phenethylamine http://purl.obolibrary.org/obo/CHEBI_18397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18398 biolink:ChemicalEntity linear maltodextrin A maltodextrin in which the α-(1→4)-linked D-glucose units form a linear chain, typically from 3 to 17 glucose units long. (Cf. amylose, in which the chain length ranges from around 300 to several thousand glucose units). kegg.compound:C01935|kegg.drug:D02329|kegg.glycan:G10495|wikipedia.en:Maltodextrin Graph Linear maltodextrin|Maltodextrin|linear maltodextrin Linear maltodextrin|Maltodextrin|linear maltodextrin http://purl.obolibrary.org/obo/CHEBI_18398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18399 biolink:ChemicalEntity codeinone cas:467-13-0|kegg.compound:C06171|knapsack:C00027603|pubmed:12606908|pubmed:1723940|pubmed:29779229|pubmed:34547292|pubmed:3707597 Graph (5alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-one|3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6-one|Codeinone 3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6-one (5alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-one|3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6-one|Codeinone http://purl.obolibrary.org/obo/CHEBI_18399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18400 biolink:ChemicalEntity 2-hydroxy-1,4-benzoquinone The simplest member of the class of 2-hydroxy-1,4-benzoquinones, that is 1,4-benzoquinone in which a single hydrogen is replaced by a hydroxy group. cas:2474-72-8|kegg.compound:C07103|pubmed:1899343|pubmed:2801212|reaxys:1929846|umbbd.compound:c0598|wikipedia.en:Hydroxy-1,4-benzoquinone Graph 2-Hydroxy-1,4-benzoquinone|2-Hydroxy-p-benzoquinone|2-hydroxy-1,4-benzoquinone|2-hydroxycyclohexa-2,5-diene-1,4-dione|Hydroxybenzoquinone 2-Hydroxy-1,4-benzoquinone|2-hydroxy-1,4-benzoquinone 2-Hydroxy-1,4-benzoquinone|2-Hydroxy-p-benzoquinone|2-hydroxy-1,4-benzoquinone|2-hydroxycyclohexa-2,5-diene-1,4-dione|Hydroxybenzoquinone http://purl.obolibrary.org/obo/CHEBI_18400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18401 biolink:ChemicalEntity phenylacetate A monocarboxylic acid anion that is the conjugate base of phenylacetic acid. gmelin:327522|metacyc.compound:PHENYLACETATE|reaxys:3539899|umbbd.compound:c0211 Graph 2-phenylacetate|2-phenylethanoate|phenylacetate|phenylacetate anion|phenylacetate(1-)|phenylacetic acid anion phenylacetate 2-phenylacetate|2-phenylethanoate|phenylacetate|phenylacetate anion|phenylacetate(1-)|phenylacetic acid anion http://purl.obolibrary.org/obo/CHEBI_18401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184014 biolink:ChemicalEntity 7-hydroxyfluphenazine chemspider:148229 Graph 10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(triluoromethyl)phenothiazin-3-ol 10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(triluoromethyl)phenothiazin-3-ol 10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-8-(triluoromethyl)phenothiazin-3-ol http://purl.obolibrary.org/obo/CHEBI_184014 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18402 biolink:ChemicalEntity 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid A steroid acid that is 5β-cholestan-26-oic acid which is substituted by hydroxy groups as the 3α, 7α, and 12α positions. cas:547-98-8|hmdb:HMDB0000601|hmdb:HMDB0003873|kegg.compound:C04722|lipidmaps:LMST04030001|reaxys:5384623 Graph (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-oic acid|3,7,12-trihydroxycholestan-26-oic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid|coprocholic acid 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-oic acid|3,7,12-trihydroxycholestan-26-oic acid|3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid|coprocholic acid http://purl.obolibrary.org/obo/CHEBI_18402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184023 biolink:ChemicalEntity Argininosuccinic acid chemspider:16059|hmdb:HMDB0000052|kegg.compound:C03406|metacyc.compound:L-ARGININO-SUCCINATE Graph (2S)-2-[[N'-[(4S)-4-amino-4-carboxybutyl]carbamimidoyl]amino]butanedioic acid (2S)-2-[[N'-[(4S)-4-amino-4-carboxybutyl]carbamimidoyl]amino]butanedioic acid (2S)-2-[[N'-[(4S)-4-amino-4-carboxybutyl]carbamimidoyl]amino]butanedioic acid http://purl.obolibrary.org/obo/CHEBI_184023 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:184024 biolink:ChemicalEntity Bacoside a chemspider:21468707 Graph (5R,8R,9S,10S,13R,14R,17S)-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-(hydroxymethyl)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,14-tetramethyl-1,2,3,5,6,7,9,11,12,13,15,17-dodecahydrocyclopenta[a]phenanthren-16-one (5R,8R,9S,10S,13R,14R,17S)-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-(hydroxymethyl)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,14-tetramethyl-1,2,3,5,6,7,9,11,12,13,15,17-dodecahydrocyclopenta[a]phenanthren-16-one (5R,8R,9S,10S,13R,14R,17S)-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-(hydroxymethyl)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,14-tetramethyl-1,2,3,5,6,7,9,11,12,13,15,17-dodecahydrocyclopenta[a]phenanthren-16-one http://purl.obolibrary.org/obo/CHEBI_184024 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18403 biolink:ChemicalEntity L-arabinitol The L-enantiomer of arabinitol. cas:7643-75-6|hmdb:HMDB0001851|kegg.compound:C00532|metacyc.compound:L-ARABITOL|pubmed:13525419|pubmed:17979222|pubmed:21742908|pubmed:22306314|pubmed:22609752|pubmed:22810910|pubmed:23287496|pubmed:23436125|pubmed:23713061|pubmed:24193245|pubmed:24643482|pubmed:25108762 Graph L-Arabinitol|L-Arabinol|L-Arabitol|L-Lyxitol|L-arabinitol|L-arabinol|L-arabitol|L-lyxitol L-Arabinitol|L-arabinitol L-Arabinitol|L-Arabinol|L-Arabitol|L-Lyxitol|L-arabinitol|L-arabinol|L-arabitol|L-lyxitol http://purl.obolibrary.org/obo/CHEBI_18403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18404 biolink:ChemicalEntity 3-methylcatechol A methylcatechol carrying a methyl substituent at position 3. It is a xenobiotic metabolite produced by some bacteria capable of degrading nitroaromatic compounds present in pesticide-contaminated soil samples. cas:488-17-5|drugbank:DB03454|kegg.compound:C02923|metacyc.compound:CPD-111|pdb-ccd:MBD|pubmed:20582618|pubmed:22854893|pubmed:23250222|reaxys:774602|umbbd.compound:c0125|wikipedia.en:3-Methylcatechol Graph 2,3-Dihydroxytoluene|2,3-dihydroxytoluene|3-METHYLCATECHOL|3-Methylcatechol|3-methylbenzene-1,2-diol|3-methylcatechol 3-methylbenzene-1,2-diol 2,3-Dihydroxytoluene|2,3-dihydroxytoluene|3-METHYLCATECHOL|3-Methylcatechol|3-methylbenzene-1,2-diol|3-methylcatechol http://purl.obolibrary.org/obo/CHEBI_18404 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18405 biolink:ChemicalEntity pyridoxal 5'-phosphate The monophosphate ester obtained by condensation of phosphoric acid with the primary hydroxy group of pyridoxal. cas:54-47-7|drugbank:DB00114|drugcentral:3506|gmelin:465416|hmdb:HMDB0001491|kegg.compound:C00018|knapsack:C00007503|pdb-ccd:PLP|pubmed:14651974|pubmed:16277678|pubmed:18491919|pubmed:6339724|pubmed:7284379|pubmed:9866693|reaxys:234749|wikipedia.en:Pyridoxal_phosphate Graph (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate|3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinecarboxaldehyde|3-hydroxy-5-(hydroxymethyl)-2-methylisonicotinaldehyde 5-phosphate|PLP|PYRIDOXAL-5'-PHOSPHATE|Phosphoric acid mono-(4-formyl-5-hydroxy-6-methyl-pyridin-3-ylmethyl) ester|Pyridoxal 5'-phosphate|Pyridoxal 5-phosphate|Pyridoxal phosphate|codecarboxylase|pyridoxal 5'-(dihydrogen phosphate)|pyridoxal 5-monophosphoric acid ester (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate|3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinecarboxaldehyde|3-hydroxy-5-(hydroxymethyl)-2-methylisonicotinaldehyde 5-phosphate|PLP|PYRIDOXAL-5'-PHOSPHATE|Phosphoric acid mono-(4-formyl-5-hydroxy-6-methyl-pyridin-3-ylmethyl) ester|Pyridoxal 5'-phosphate|Pyridoxal 5-phosphate|Pyridoxal phosphate|codecarboxylase|pyridoxal 5'-(dihydrogen phosphate)|pyridoxal 5-monophosphoric acid ester http://purl.obolibrary.org/obo/CHEBI_18405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18406 biolink:ChemicalEntity AICA ribonucleotide A 1-(phosphoribosyl)imidazolecarboxamide that is acadesine in which the hydroxy group at the 5' position has been converted to its monophosphate derivative. cas:3031-94-5|drugbank:DB01700|ecmdb:ECMDB01517|hmdb:HMDB0001517|kegg.compound:C04677|knapsack:C00007383|pdb-ccd:AMZ|pubmed:23988673|pubmed:25078608|pubmed:8227467|reaxys:52565|wikipedia.en:AICA_ribonucleotide|ymdb:YMDB01481 Graph 1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxamide|1-(5'-phosphoribosyl)-5-amino-4-imidazolecarboxamide|5'-Phospho-ribosyl-5-amino-4-imidazole carboxamide|5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide|5'-phospho-ribosyl-5-amino-4-imidazole carboxamide|5'-phosphoribosyl-5-amino-4-imidazolecarboxamide|5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-Aminoimidazole-4-carboxamide ribotide|5-Phosphoribosyl-4-carbamoyl-5-aminoimidazole|5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide|5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-aminoimidazole-4-carboxamide ribotide|5-phosphoribosyl-4-carbamoyl-5-aminoimidazole|AICA-ribonucleotide|AICAR|Aica ribonucleotide|acadesine 5'-monophosphate 5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide 1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxamide|1-(5'-phosphoribosyl)-5-amino-4-imidazolecarboxamide|5'-Phospho-ribosyl-5-amino-4-imidazole carboxamide|5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide|5'-phospho-ribosyl-5-amino-4-imidazole carboxamide|5'-phosphoribosyl-5-amino-4-imidazolecarboxamide|5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-Aminoimidazole-4-carboxamide ribotide|5-Phosphoribosyl-4-carbamoyl-5-aminoimidazole|5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide|5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide|5-aminoimidazole-4-carboxamide ribotide|5-phosphoribosyl-4-carbamoyl-5-aminoimidazole|AICA-ribonucleotide|AICAR|Aica ribonucleotide|acadesine 5'-monophosphate http://purl.obolibrary.org/obo/CHEBI_18406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18407 biolink:ChemicalEntity hydrogen cyanide A one-carbon compound consisting of a methine group triple bonded to a nitrogen atom cas:74-90-8|hmdb:HMDB0060292|kegg.compound:C01326|knapsack:C00007569|metacyc.compound:HCN|pubmed:19849830|pubmed:26700190|pubmed:26778429|pubmed:26823582|pubmed:26940198|pubmed:27123778|reaxys:1718793|wikipedia.en:Hydrogen_cyanide Graph Blausaeure|Cyanwasserstoff|HCN|Hydrogen cyanide|[CHN]|formonitrile|hydridonitridocarbon|hydrocyanic acid|hydrogen cyanide|hydrogen(nitridocarbonate)|methanenitrile hydridonitridocarbon|hydrogen(nitridocarbonate)|methanenitrile Blausaeure|Cyanwasserstoff|HCN|Hydrogen cyanide|[CHN]|formonitrile|hydridonitridocarbon|hydrocyanic acid|hydrogen cyanide|hydrogen(nitridocarbonate)|methanenitrile http://purl.obolibrary.org/obo/CHEBI_18407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18408 biolink:ChemicalEntity cobamamide A member of the class of cobalamins that is vitamin B12 in which the cyano group is replaced by a 5'-deoxyadenos-5'-yl moiety. It is one of the two metabolically active form of vitamin B12. cas:13870-90-1|drugbank:DB11191|gmelin:439994|hmdb:HMDB0002086|kegg.compound:C00194|metacyc.compound:ADENOSYLCOBALAMIN|pdb-ccd:B1Z|pubmed:11792214|pubmed:12093296|pubmed:17011224|reaxys:4122932|wikipedia.en:Cobamamide Graph (5,6-Dimethylbenzimidazolyl)cobamide coenzyme|(5,6-dimethylbenzimidazolyl)cobamide coenzyme|5'-Deoxy-5'-adenosyl vitamin B12|5'-Deoxy-5'-adenosyl-5,6-dimethylbenzimidazolylcobamide|5'-Deoxy-5'-adenosylcobalamin|5'-deoxyadenosyl vitamin B12|5'-deoxyadenosyl-5,6-dimethylbenzimidazolylcobamide|5'-deoxyadenosylcobalamin|5,6-Dimethylbenzimidazolyl-5-deoxyadenosyl-cobamide|5,6-Dimethylbenzimidazolyl-Co-5'-deoxy-5'-adenosylcobamide|Adenosylcob(III)alamin|Adenosylcobalamin|AdoCbl|Calomide|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-(5'-deoxy-5'-adenosyl)cobamide|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-adenosylcobamide|Cobalamin coenzyme|Cobamamide|Coenzyme B12|DBC coenzyme|DMBC coenzyme|Deoxyadenosylcobalamin|Dibencozide|Funacomide|Vitamin B12 coenzyme|adenosylcob(III)alamin|adenosylcobalamin|alpha-(5,6-Dimethylbenzimidazolyl)cobamide coenzyme|cobamamid|cobamamida|cobamamide|cobamamidum|cobamide coenzyme|coenzyme B-12 Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-(5'-deoxy-5'-adenosyl)cobamide (5,6-Dimethylbenzimidazolyl)cobamide coenzyme|(5,6-dimethylbenzimidazolyl)cobamide coenzyme|5'-Deoxy-5'-adenosyl vitamin B12|5'-Deoxy-5'-adenosyl-5,6-dimethylbenzimidazolylcobamide|5'-Deoxy-5'-adenosylcobalamin|5'-deoxyadenosyl vitamin B12|5'-deoxyadenosyl-5,6-dimethylbenzimidazolylcobamide|5'-deoxyadenosylcobalamin|5,6-Dimethylbenzimidazolyl-5-deoxyadenosyl-cobamide|5,6-Dimethylbenzimidazolyl-Co-5'-deoxy-5'-adenosylcobamide|Adenosylcob(III)alamin|Adenosylcobalamin|AdoCbl|Calomide|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-(5'-deoxy-5'-adenosyl)cobamide|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-adenosylcobamide|Cobalamin coenzyme|Cobamamide|Coenzyme B12|DBC coenzyme|DMBC coenzyme|Deoxyadenosylcobalamin|Dibencozide|Funacomide|Vitamin B12 coenzyme|adenosylcob(III)alamin|adenosylcobalamin|alpha-(5,6-Dimethylbenzimidazolyl)cobamide coenzyme|cobamamid|cobamamida|cobamamide|cobamamidum|cobamide coenzyme|coenzyme B-12 http://purl.obolibrary.org/obo/CHEBI_18408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18409 biolink:ChemicalEntity (2S)-2-hydroxy-2-methyl-3-oxobutanoic acid kegg.compound:C06010 Graph (2S)-2-hydroxy-2-methyl-3-oxobutanoic acid|(S)-2-Acetolactate|(S)-2-Hydroxy-2-methyl-3-oxobutanoate|(S)-2-acetolactate|(S)-2-hydroxy-2-methyl-3-oxobutanoate (2S)-2-hydroxy-2-methyl-3-oxobutanoic acid (2S)-2-hydroxy-2-methyl-3-oxobutanoic acid|(S)-2-Acetolactate|(S)-2-Hydroxy-2-methyl-3-oxobutanoate|(S)-2-acetolactate|(S)-2-hydroxy-2-methyl-3-oxobutanoate http://purl.obolibrary.org/obo/CHEBI_18409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18410 biolink:ChemicalEntity N-formylanthranilate An amidobenzoate consisting of anthranilate carrying an N-formyl group. Graph 2-(formylamino)benzoate|2-formamidobenzoate|Formylanthranilate|N-Formylanthranilate|N-formylanthranilate|N-formylanthranilate anion 2-formamidobenzoate 2-(formylamino)benzoate|2-formamidobenzoate|Formylanthranilate|N-Formylanthranilate|N-formylanthranilate|N-formylanthranilate anion http://purl.obolibrary.org/obo/CHEBI_18410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18411 biolink:ChemicalEntity laminarabiose A glycosylglucose consisting of D-glucose with undefined anomeric stereochemistry and a β-D-glucosyl residue attached at the 3-position. beilstein:1292730|cas:34980-39-7|kegg.compound:C02048|kegg.glycan:G00357|knapsack:C00001137|pdb-ccd:LB2 Graph 3-O-(beta-D-Glucopyranosyl)-D-glucose|3-beta-D-Glucosyl-D-glucose|Laminarabiose|Laminariaceae|Laminaribiose|beta-D-Glc-(1->3)-D-Glc|beta-D-Glcp-(1->3)-D-Glcp|beta-D-Glup-(1->3)-D-Glu|beta-D-glucopyranosyl-(1->3)-D-glucopyranose|beta-D-glucosyl-(1->3)-D-glucose|betaGlcbeta(1-3)Glc beta-D-glucopyranosyl-(1->3)-D-glucopyranose 3-O-(beta-D-Glucopyranosyl)-D-glucose|3-beta-D-Glucosyl-D-glucose|Laminarabiose|Laminariaceae|Laminaribiose|beta-D-Glc-(1->3)-D-Glc|beta-D-Glcp-(1->3)-D-Glcp|beta-D-Glup-(1->3)-D-Glu|beta-D-glucopyranosyl-(1->3)-D-glucopyranose|beta-D-glucosyl-(1->3)-D-glucose|betaGlcbeta(1-3)Glc http://purl.obolibrary.org/obo/CHEBI_18411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18412 biolink:ChemicalEntity N(omega)-phospho-L-arginine An arginine derivative that is L-arginine substituted by a phosphono group at Nω-position. beilstein:1729410|cas:1189-11-3|hmdb:HMDB0029438|kegg.compound:C05945|pdb-ccd:RPI|pubmed:2836197|pubmed:7371925|pubmed:891981|reaxys:1729410 Graph (2S)-2-amino-5-{[imino(phosphonoamino)methyl]amino}pentanoic acid|Arginine phosphate|L-Arginine phosphate|L-Arginine-NG-phosphoric acid|N(5)-[imino(phosphonoamino)methyl]-L-ornithine|N(omega)-Phospho-L-arginine|N(omega)-phosphono-L-arginine|N-Phospho-L-arginine|N5-[Imino(phosphonoamino)methyl]L-ornithine|Phospho-L-arginine|Phosphoarginine|Phosphoarginine A|alpha-amino-delta-phosphonoguanidinovaleric acid|omega-N-Phosphoarginine|omega-N-phospho-L-arginine N(omega)-phosphono-L-arginine (2S)-2-amino-5-{[imino(phosphonoamino)methyl]amino}pentanoic acid|Arginine phosphate|L-Arginine phosphate|L-Arginine-NG-phosphoric acid|N(5)-[imino(phosphonoamino)methyl]-L-ornithine|N(omega)-Phospho-L-arginine|N(omega)-phosphono-L-arginine|N-Phospho-L-arginine|N5-[Imino(phosphonoamino)methyl]L-ornithine|Phospho-L-arginine|Phosphoarginine|Phosphoarginine A|alpha-amino-delta-phosphonoguanidinovaleric acid|omega-N-Phosphoarginine|omega-N-phospho-L-arginine http://purl.obolibrary.org/obo/CHEBI_18412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18413 biolink:ChemicalEntity 2-formamido-N(1)-(5-phospho-D-ribosyl)acetamidine kegg.compound:C04640 Graph 1-(5'-Phosphoribosyl)-N-formylglycinamidine|1-deoxy-1-[2-(formamido)acetimidamido]-D-ribofuranose 5-(dihydrogen phosphate)|2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine|2-(Formamido)-N1-(5-phospho-D-ribosyl)acetamidine|5'-Phosphoribosyl-N-formylglycinamidine|5'-Phosphoribosylformylglycinamidine|N-[2-(formamido)ethanimidoyl]-5-O-phosphono-D-ribofuranosylamine 1-deoxy-1-[2-(formamido)acetimidamido]-D-ribofuranose 5-(dihydrogen phosphate)|N-[2-(formamido)ethanimidoyl]-5-O-phosphono-D-ribofuranosylamine 1-(5'-Phosphoribosyl)-N-formylglycinamidine|1-deoxy-1-[2-(formamido)acetimidamido]-D-ribofuranose 5-(dihydrogen phosphate)|2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine|2-(Formamido)-N1-(5-phospho-D-ribosyl)acetamidine|5'-Phosphoribosyl-N-formylglycinamidine|5'-Phosphoribosylformylglycinamidine|N-[2-(formamido)ethanimidoyl]-5-O-phosphono-D-ribofuranosylamine http://purl.obolibrary.org/obo/CHEBI_18413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18415 biolink:ChemicalEntity N-formimidoylglycine cas:2140-03-6|kegg.compound:C02718 Graph Formiminoglycine|Glycine, N-(iminomethyl)-|N-(iminomethyl)glycine|N-Formimidoylglycine|N-Formiminoglycine|[(iminomethyl)amino]acetic acid N-(iminomethyl)glycine|[(iminomethyl)amino]acetic acid Formiminoglycine|Glycine, N-(iminomethyl)-|N-(iminomethyl)glycine|N-Formimidoylglycine|N-Formiminoglycine|[(iminomethyl)amino]acetic acid http://purl.obolibrary.org/obo/CHEBI_18415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18416 biolink:ChemicalEntity N-[(R)-pantothenoyl]-L-cysteine kegg.compound:C04079 Graph D-Pantothenoyl-L-cysteine|N-((R)-Pantothenoyl)-L-cysteine|N-{N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanyl}-L-cysteine N-{N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanyl}-L-cysteine D-Pantothenoyl-L-cysteine|N-((R)-Pantothenoyl)-L-cysteine|N-{N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanyl}-L-cysteine http://purl.obolibrary.org/obo/CHEBI_18416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18417 biolink:ChemicalEntity (RS)-coclaurine cas:486-39-5|kegg.compound:C06348 Graph (R,S)-Coclaurine|1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|6-Methoxy-7-hydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Coclaurine 1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (R,S)-Coclaurine|1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|6-Methoxy-7-hydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Coclaurine http://purl.obolibrary.org/obo/CHEBI_18417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18418 biolink:ChemicalEntity (RS)-norcoclaurine cas:5843-65-2|kegg.compound:C06346 Graph (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol|(+-)-Demethylcoclaurine|(+-)-Norcoclaurine|(+-)-O-Demethylcoclaurine|(R,S)-Norcoclaurine|1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Higenamine|Norcoclaurine 1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol|(+-)-Demethylcoclaurine|(+-)-Norcoclaurine|(+-)-O-Demethylcoclaurine|(R,S)-Norcoclaurine|1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Higenamine|Norcoclaurine http://purl.obolibrary.org/obo/CHEBI_18418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18419 biolink:ChemicalEntity lactaldehyde A member of the class of propanals obtained by the reduction of the carboxylic group of lactic acid (2-hydroxypropanoic acid). cas:598-35-6|kegg.compound:C05999 Graph 2-Hydroxypropanal|2-Hydroxypropionaldehyde|2-hydroxypropanal|2-hydroxypropionaldehyde|Lactaldehyde 2-Hydroxypropanal|2-hydroxypropanal 2-Hydroxypropanal|2-Hydroxypropionaldehyde|2-hydroxypropanal|2-hydroxypropionaldehyde|Lactaldehyde http://purl.obolibrary.org/obo/CHEBI_18419 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18420 biolink:ChemicalEntity magnesium(2+) cas:22537-22-0|gmelin:6857|kegg.compound:C00305|pdb-ccd:MG|pubmed:24259558 Graph MAGNESIUM ION|Mg(2+)|Mg2+|magnesium cation|magnesium(2+)|magnesium(2+) ion|magnesium(II) cation|magnesium, doubly charged positive ion|magnesium, ion (Mg(2+)) magnesium cation|magnesium(2+)|magnesium(2+) ion|magnesium(II) cation MAGNESIUM ION|Mg(2+)|Mg2+|magnesium cation|magnesium(2+)|magnesium(2+) ion|magnesium(II) cation|magnesium, doubly charged positive ion|magnesium, ion (Mg(2+)) http://purl.obolibrary.org/obo/CHEBI_18420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18421 biolink:ChemicalEntity superoxide cas:11062-77-4|chemspider:4514331|foodb.food:FDB022880|gmelin:487|hmdb:HMDB0002168|kegg.compound:C00704|metacyc.compound:SUPER-OXIDE|pdb-ccd:2FK|pubmed:10440226|pubmed:10523323|pubmed:10588368|pubmed:11008114|pubmed:11333112|pubmed:11485972|pubmed:12097818|pubmed:12137408|pubmed:12598407|pubmed:14529453|pubmed:14703794|pubmed:14726604|pubmed:15586010|pubmed:15807660|pubmed:15952898|pubmed:1671684|pubmed:16771675|pubmed:16814528|pubmed:17052238|pubmed:17303648|pubmed:17531522|pubmed:18519744|pubmed:18827931|pubmed:19273321|pubmed:19482633|pubmed:19628033|pubmed:19857607|pubmed:19914407|pubmed:20868230|pubmed:21297912|pubmed:21434856|pubmed:21473702|pubmed:2160451|pubmed:217531|pubmed:22198225|pubmed:22247596|pubmed:22521482|pubmed:22729857|pubmed:22759590|pubmed:23542447|pubmed:23660153|pubmed:23668959|pubmed:24567847|pubmed:24862271|pubmed:2552230|pubmed:26047895|pubmed:26475962|pubmed:26875845|pubmed:27066025|pubmed:27066179|pubmed:27085844|pubmed:27357008|pubmed:27590268|pubmed:27965593|pubmed:28341974|pubmed:28599858|pubmed:28825637|pubmed:28842347|pubmed:28842493|pubmed:29259135|pubmed:29385710|pubmed:29669742|pubmed:29896077|pubmed:30307099|pubmed:30500433|pubmed:30573187|pubmed:30886134|pubmed:31254369|pubmed:31484901|pubmed:32144830|pubmed:32220789|pubmed:32478084|pubmed:32667121|pubmed:32760286|pubmed:32927603|pubmed:33248264|pubmed:33716500|pubmed:33805942|pubmed:34635271|pubmed:7998676|pubmed:8577306|pubmed:8720916|pubmed:8959373|pubmed:9337481|wikipedia.en:Superoxide Graph (O2)(.-)|Dioxid(1-)|Hyperoxid|O2(-)|O2(.-)|O2-|O2.-|Superoxide anion|dioxidanidyl|dioxide(.1-)|dioxide(1-)|hiperoxido|hyperoxide|superoxide|superoxide anion radical|superoxide radical|superoxide radical anion|superoxido|superoxyde dioxidanidyl|dioxide(.1-) (O2)(.-)|Dioxid(1-)|Hyperoxid|O2(-)|O2(.-)|O2-|O2.-|Superoxide anion|dioxidanidyl|dioxide(.1-)|dioxide(1-)|hiperoxido|hyperoxide|superoxide|superoxide anion radical|superoxide radical|superoxide radical anion|superoxido|superoxyde http://purl.obolibrary.org/obo/CHEBI_18421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184217 biolink:ChemicalEntity PC(19:3(10Z,13Z,16Z)/0:0) chemspider:24823001|lipidmaps:LMGP01050003 Graph [(2R)-2-hydroxy-3-[(10Z,13Z,16Z)-nonadeca-10,13,16-trienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate [(2R)-2-hydroxy-3-[(10Z,13Z,16Z)-nonadeca-10,13,16-trienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate [(2R)-2-hydroxy-3-[(10Z,13Z,16Z)-nonadeca-10,13,16-trienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate http://purl.obolibrary.org/obo/CHEBI_184217 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18422 biolink:ChemicalEntity sulfur dioxide cas:7446-09-5|drugbank:DB16426|foodb.food:FDB013399|gmelin:1443|hmdb:HMDB0034834|kegg.compound:C09306|kegg.drug:D05961|pdb-ccd:SO2|pubmed:19238997|pubmed:36976798|pubmed:37049885|pubmed:37192218|pubmed:37439466|pubmed:37844159|pubmed:38099545|pubmed:38232945|pubmed:38305621|pubmed:38414396|pubmed:38476666|pubmed:38642156|pubmed:38661196|wikipedia.en:Sulfur_dioxide Graph R-764|SO2|SULFUR DIOXIDE|Schwefel(IV)-oxid|Schwefeldioxid|Sulfur dioxide|[SO2]|dioxidosulfur|oxosulfane oxide|sulfur dioxide|sulfurous anhydride|sulfurous oxide|sulphur dioxide SULFUR DIOXIDE|Sulfur dioxide|dioxidosulfur|sulfur dioxide R-764|SO2|SULFUR DIOXIDE|Schwefel(IV)-oxid|Schwefeldioxid|Sulfur dioxide|[SO2]|dioxidosulfur|oxosulfane oxide|sulfur dioxide|sulfurous anhydride|sulfurous oxide|sulphur dioxide http://purl.obolibrary.org/obo/CHEBI_18422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18425 biolink:ChemicalEntity 2-C-methyl-D-erythritol 2,4-cyclic diphosphate cas:143488-44-2|kegg.compound:C11453|knapsack:C00007295|pdb-ccd:CDI|wikipedia.en:2-C-Methyl-D-erythritol-2,4-cyclopyrophosphate Graph (6S,7R)-6-(hydroxymethyl)-6-methyl-1,3,5,2,4-trioxadiphosphocane-2,4,7-triol 2,4-dioxide|2-C-Methyl-D-erythritol 2,4-cyclodiphosphate|3-Methyl-1,2,3,4-tetrahydroxybutane-1,3-cyclic bisphosphate|MEcPP (6S,7R)-6-(hydroxymethyl)-6-methyl-1,3,5,2,4-trioxadiphosphocane-2,4,7-triol 2,4-dioxide (6S,7R)-6-(hydroxymethyl)-6-methyl-1,3,5,2,4-trioxadiphosphocane-2,4,7-triol 2,4-dioxide|2-C-Methyl-D-erythritol 2,4-cyclodiphosphate|3-Methyl-1,2,3,4-tetrahydroxybutane-1,3-cyclic bisphosphate|MEcPP http://purl.obolibrary.org/obo/CHEBI_18425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184255 biolink:ChemicalEntity Bavachinin cas:19879-30-2|chemspider:8512670 Graph (2S)-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one (2S)-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one (2S)-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one http://purl.obolibrary.org/obo/CHEBI_184255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18426 biolink:ChemicalEntity 1D-myo-inositol 1,2-cyclic phosphate A myo-inositol cyclic phosphate that is the 1,2-cyclic phosphate derivative of 1D-myo-inositol. cas:43119-57-9|kegg.compound:C04299|pubmed:11417877|pubmed:2450138|pubmed:6860706|pubmed:7679286|pubmed:9214296|reaxys:3208785 Graph 1D-myo-Inositol 1,2-cyclic phosphate|1D-myo-inositol 1,2-(hydrogen phosphate)|D-myo-Inositol 1,2-cyclic phosphate|myo-inositol 1,2-cyclic phosphate 1D-myo-inositol 1,2-(hydrogen phosphate) 1D-myo-Inositol 1,2-cyclic phosphate|1D-myo-inositol 1,2-(hydrogen phosphate)|D-myo-Inositol 1,2-cyclic phosphate|myo-inositol 1,2-cyclic phosphate http://purl.obolibrary.org/obo/CHEBI_18426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18427 biolink:ChemicalEntity 1D-1-O-methyl-myo-inositol A member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2R,3S,4S,5R,6S-isomer). hmdb:HMDB0031437|kegg.compound:C03659|knapsack:C00048928|pubmed:22333437|pubmed:23413198 Graph (-)-bornesitol|(1R,2R,3S,4S,5R,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1-O-Methyl-myo-inositol|1D-1-O-Methyl-myo-inositol|1D-1-O-methyl-myo-inositol|D-(-)-bornesitol|bornesitol 1D-1-O-Methyl-myo-inositol|1D-1-O-methyl-myo-inositol (-)-bornesitol|(1R,2R,3S,4S,5R,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1-O-Methyl-myo-inositol|1D-1-O-Methyl-myo-inositol|1D-1-O-methyl-myo-inositol|D-(-)-bornesitol|bornesitol http://purl.obolibrary.org/obo/CHEBI_18427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18429 biolink:ChemicalEntity dehydrovomifoliol A fenchane monoterpenoid that is substituted by methyl groups at positions 3, 5, and 5, and by both a hydroxy group and a 3-oxobut-1-en-1-yl group at position 4. beilstein:2050826|kegg.compound:C04223 Graph (+/-)-6-Hydroxy-3-oxo-alpha-ionone|(+/-)-6-hydroxy-3-oxo-alpha-ionone|(6RS)-6-hydroxy-9-apo-epsilon-carotene-3,9-dione|4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one|6-hydroxy-3-oxo-alpha-ionone 4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one (+/-)-6-Hydroxy-3-oxo-alpha-ionone|(+/-)-6-hydroxy-3-oxo-alpha-ionone|(6RS)-6-hydroxy-9-apo-epsilon-carotene-3,9-dione|4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one|6-hydroxy-3-oxo-alpha-ionone http://purl.obolibrary.org/obo/CHEBI_18429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18430 biolink:ChemicalEntity 3-hydroxy-16-methoxy-2,3-dihydrotabersonine kegg.compound:C04578 Graph 16-Methoxy-2,3-dihydro-3-hydroxytabersonine|16-methoxy-2,3-dihydro-3-hydroxytabersonine|methyl 3beta-hydroxy-16-methoxy-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate methyl 3beta-hydroxy-16-methoxy-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate 16-Methoxy-2,3-dihydro-3-hydroxytabersonine|16-methoxy-2,3-dihydro-3-hydroxytabersonine|methyl 3beta-hydroxy-16-methoxy-6,7-didehydro-2beta,5alpha,12beta,19alpha-aspidospermidine-3alpha-carboxylate http://purl.obolibrary.org/obo/CHEBI_18430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184300 biolink:ChemicalEntity ADP-2'-imine-ribofurano[1',2':4,5]oxazolidine(2-) residue pubmed:34671164 Graph ADP-2'-imine-ribofurano[1',2':4,5]oxazolidine residue ADP-2'-imine-ribofurano[1',2':4,5]oxazolidine residue http://purl.obolibrary.org/obo/CHEBI_184300 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18431 biolink:ChemicalEntity 7alpha,26-dihydroxycholesterol An oxysterol that is cholesterol which is substituted by hydroxy groups at the 7α and 26 positions. beilstein:6374535|cas:4725-24-0|kegg.compound:C06341|lipidmaps:LMST04030081|reaxys:6374535 Graph 5-cholestene-3beta,7alpha,26-triol|7-alpha,27-Dihydroxycholesterol|Cholest-5-ene-3beta,7alpha,26-triol|Cholest-5-ene-3beta,7alpha,27-triol|cholest-5-ene-3beta,7alpha,26-triol cholest-5-ene-3beta,7alpha,26-triol 5-cholestene-3beta,7alpha,26-triol|7-alpha,27-Dihydroxycholesterol|Cholest-5-ene-3beta,7alpha,26-triol|Cholest-5-ene-3beta,7alpha,27-triol|cholest-5-ene-3beta,7alpha,26-triol http://purl.obolibrary.org/obo/CHEBI_18431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18435 biolink:ChemicalEntity (+)-7-isojasmonic acid An oxylipin that is [(1S)-3-oxocyclopentyl]acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 on the cyclopentanone ring. kegg.compound:C16317|knapsack:C00000446|lipidmaps:LMFA02020003|metacyc.compound:CPD-731|reaxys:4180666 Graph (+)-7-iso-jasmonic acid|(+)-7-isojasmonic acid|(+)-Epijasmonic acid|2-[(1R,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid|{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid {(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid (+)-7-iso-jasmonic acid|(+)-7-isojasmonic acid|(+)-Epijasmonic acid|2-[(1R,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid|{(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetic acid http://purl.obolibrary.org/obo/CHEBI_18435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184376 biolink:ChemicalEntity streptidine(2+) A guanidinium ion obtained by protonation of both guanidino groups of streptidine; major species at pH 7.3. Graph streptidine|streptidine dication|{[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diazanediyl}bis(aminomethaniminium)|{[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diimino}bis(aminomethaniminium) {[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diimino}bis(aminomethaniminium) streptidine|streptidine dication|{[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diazanediyl}bis(aminomethaniminium)|{[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diimino}bis(aminomethaniminium) http://purl.obolibrary.org/obo/CHEBI_184376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:184381 biolink:ChemicalEntity bacitracin A zwitterion metacyc.compound:CPD-19353 Graph bacitracin A bacitracin A http://purl.obolibrary.org/obo/CHEBI_184381 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:184385 biolink:ChemicalEntity N6-[(R)-S8-glutaryldihydrolipoyl]-L-lysine(1-) residue pubmed:28435050 Graph N(6)-((R)-S(8)-glutaryldihydrolipoyl)-L-lysine residue N(6)-((R)-S(8)-glutaryldihydrolipoyl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_184385 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1845 biolink:ChemicalEntity 4-hydroxy-3-polyprenylbenzoic acid A monohydroxybenzoic acid that is 4-hydroxybenzoic acid substituted at position 3 by any polyprenyl group. kegg.compound:C05848|metacyc.compound:4-Hydroxy-3-polyprenylbenzoates Graph http://purl.obolibrary.org/obo/CHEBI_1845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18450 biolink:ChemicalEntity (R)-mandelonitrile beilstein:2613369|beilstein:3588636|beilstein:3588637 Graph (+)-mandelonitrile|(2R)-hydroxy(phenyl)acetonitrile|(R)-(+)-mandelonitrile|(R)-mandelonitrile|d-mandelonitrile (2R)-hydroxy(phenyl)acetonitrile (+)-mandelonitrile|(2R)-hydroxy(phenyl)acetonitrile|(R)-(+)-mandelonitrile|(R)-mandelonitrile|d-mandelonitrile http://purl.obolibrary.org/obo/CHEBI_18450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18481 biolink:ChemicalEntity (-)-cis-sabinol beilstein:6912099 Graph (1R,3R,5R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol (1R,3R,5R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol (1R,3R,5R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol http://purl.obolibrary.org/obo/CHEBI_18481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18504 biolink:ChemicalEntity (1->3,1->4)-beta-D-glucan A β-D-glucan of more than 20 D-glucose residues joined by β-(1→3) and β-(1→4) glycosidic linkages. Graph (1->3,1->4)-beta-D-glucans|beta-1,3-1,4-glucan (1->3,1->4)-beta-D-glucans|beta-1,3-1,4-glucan http://purl.obolibrary.org/obo/CHEBI_18504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:185095 biolink:ChemicalEntity PS(O-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) chemspider:113376658|lipidmaps:LMGP03020093 Graph (2S)-2-amino-3-[[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid (2S)-2-amino-3-[[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid (2S)-2-amino-3-[[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid http://purl.obolibrary.org/obo/CHEBI_185095 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:185277 biolink:ChemicalEntity 5-hydroperoxy-7-[3,5-epidioxy-2-(2-octenyl)-cyclopentyl]-6-heptenoic acid chemspider:4445995|lipidmaps:LMFA01040028 Graph (6Z)-5-hydroperoxy-6-[6-[(E)-oct-2-enyl]-2,3-dioxabicyclo[2.2.1]heptan-5-ylidene]hexanoic acid (6Z)-5-hydroperoxy-6-[6-[(E)-oct-2-enyl]-2,3-dioxabicyclo[2.2.1]heptan-5-ylidene]hexanoic acid (6Z)-5-hydroperoxy-6-[6-[(E)-oct-2-enyl]-2,3-dioxabicyclo[2.2.1]heptan-5-ylidene]hexanoic acid http://purl.obolibrary.org/obo/CHEBI_185277 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:185613 biolink:ChemicalEntity Sphingofungin B cas:121025-45-4|chemspider:4943512|chemspider:8605863|lipidmaps:LMSP01080062 Graph (E,2S,3R,4R,5S)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid|(E,2S,3R,4R,5S,14R)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid (E,2S,3R,4R,5S)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid|(E,2S,3R,4R,5S,14R)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid (E,2S,3R,4R,5S)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid|(E,2S,3R,4R,5S,14R)-2-amino-3,4,5,14-tetrahydroxyicos-6-enoic acid http://purl.obolibrary.org/obo/CHEBI_185613 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:185704 biolink:ChemicalEntity Trimidox cas:95933-74-7|chemspider:11633195|lincs.smallmolecule:LSM-5297 Graph N',3,4,5-tetrahydroxybenzenecarboximidamide N',3,4,5-tetrahydroxybenzenecarboximidamide N',3,4,5-tetrahydroxybenzenecarboximidamide http://purl.obolibrary.org/obo/CHEBI_185704 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:186021 biolink:ChemicalEntity Liensinine cas:2586-96-1|chemspider:141157 Graph 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol http://purl.obolibrary.org/obo/CHEBI_186021 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18608 biolink:ChemicalEntity (6S)-5-methyltetrahydrofolate(2-) beilstein:10132446|metacyc.compound:5-METHYL-THF Graph (2S)-2-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]amino}pentanedioate|(6S)-5-methyl-5,6,7,8-tetrahydrofolate|(6S)-5-methyltetrahydrofolate (2S)-2-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]amino}pentanedioate (2S)-2-{[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]amino}pentanedioate|(6S)-5-methyl-5,6,7,8-tetrahydrofolate|(6S)-5-methyltetrahydrofolate http://purl.obolibrary.org/obo/CHEBI_18608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:186090 biolink:ChemicalEntity Limonexic acid chemspider:4479081 Graph (1R,2R,7S,10R,13R,14R,16S,19R,20S)-19-(2-hydroxy-5-oxo-2H-uran-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione (1R,2R,7S,10R,13R,14R,16S,19R,20S)-19-(2-hydroxy-5-oxo-2H-uran-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione (1R,2R,7S,10R,13R,14R,16S,19R,20S)-19-(2-hydroxy-5-oxo-2H-uran-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione http://purl.obolibrary.org/obo/CHEBI_186090 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:186253 biolink:ChemicalEntity Cardamonin cas:19309-14-9|chemspider:557026|drugbank:DB14122|hmdb:HMDB0132913|lincs.smallmolecule:LSM-44652|lipidmaps:LMPK12120245 Graph (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one http://purl.obolibrary.org/obo/CHEBI_186253 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18634 biolink:ChemicalEntity (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde Graph (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde http://purl.obolibrary.org/obo/CHEBI_18634 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:1864 biolink:ChemicalEntity 4-hydroxycyclophosphamide A phosphorodiamide that consists of 2-amino-1,3,2-oxazaphosphinan-4-ol 2-oxide having two 2-chloroethyl groups attached to the exocyclic nitrogen. cas:40277-05-2|kegg.compound:C07643|reaxys:526395|wikipedia.en:4-Hydroxycyclophosphamide Graph 2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-ol 2-oxide|4-Hydroxycyclophosphamide|Tetrahydro-2-(bis(2-chloroethyl)amino)-2H-1,3,2-oxazaphosphorin-4-ol 2-oxide 2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-ol 2-oxide 2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-ol 2-oxide|4-Hydroxycyclophosphamide|Tetrahydro-2-(bis(2-chloroethyl)amino)-2H-1,3,2-oxazaphosphorin-4-ol 2-oxide http://purl.obolibrary.org/obo/CHEBI_1864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:186604 biolink:ChemicalEntity N-linolenoyl glutamine chemspider:20128289|lipidmaps:LMFA08020213 Graph (2S)-5-amino-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]-5-oxopentanoic acid (2S)-5-amino-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]-5-oxopentanoic acid (2S)-5-amino-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]-5-oxopentanoic acid http://purl.obolibrary.org/obo/CHEBI_186604 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18697 biolink:ChemicalEntity (R)-pantoic acid beilstein:1722601|cas:470-29-1|kegg.compound:C00522|knapsack:C00007622|pdb-ccd:PAF Graph (2R)-2,4-dihydroxy-3,3-dimethylbutanoic acid|Pantoate|Pantoic acid (2R)-2,4-dihydroxy-3,3-dimethylbutanoic acid (2R)-2,4-dihydroxy-3,3-dimethylbutanoic acid|Pantoate|Pantoic acid http://purl.obolibrary.org/obo/CHEBI_18697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18703 biolink:ChemicalEntity D-pipecolate The D-enantiomer of pipecolate. gmelin:533523 Graph (2R)-piperidine-2-carboxylate|(R)-pipecolate (2R)-piperidine-2-carboxylate (2R)-piperidine-2-carboxylate|(R)-pipecolate http://purl.obolibrary.org/obo/CHEBI_18703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18723 biolink:ChemicalEntity nicotine A racemate composed of equimolar amounts of (R)- and (S)-nicotine. beilstein:82111|cas:22083-74-5|drugbank:DB00184|hmdb:HMDB0014330|kegg.compound:C16150|knapsack:C00002057|pubmed:10751565|pubmed:11192937|pubmed:11471991|pubmed:11559179|pubmed:11682702|pubmed:11714820|pubmed:11719700|pubmed:11801622|pubmed:11818389|pubmed:11860617|pubmed:12197757|pubmed:12700710|pubmed:12965231|pubmed:14715938|pubmed:15183514|pubmed:15251917|pubmed:15313135|pubmed:15458549|pubmed:15707677|pubmed:15894687|pubmed:15960296|pubmed:15961264|pubmed:16496293|pubmed:16950410|pubmed:17167832|pubmed:17206646|pubmed:17438652|pubmed:17498149|pubmed:17942810|pubmed:18077004|pubmed:18311975|pubmed:18380035|pubmed:18383130|pubmed:18651995|pubmed:18922921|pubmed:19100331|pubmed:19287496|pubmed:19389046|pubmed:19465085|pubmed:20338106|pubmed:20528766|pubmed:21636612|pubmed:21822688|pubmed:21945235|pubmed:22129149|pubmed:22218403|pubmed:22331007|pubmed:22377934|pubmed:22448647|pubmed:22459798|pubmed:22529223|pubmed:22573728|pubmed:22585541|pubmed:22589423|pubmed:22770225|pubmed:22792725|pubmed:22855884|pubmed:22930863|pubmed:22935730|pubmed:23108361|pubmed:23117126|pubmed:7097594|pubmed:7564279|pubmed:7566693|pubmed:7807214|pubmed:7896575|pubmed:8156919|pubmed:8545712|pubmed:8764340|pubmed:9203638|pubmed:9450943|pubmed:9621392|reaxys:82108|umbbd.compound:c0468|wikipedia.en:Nicotine Graph (+-)-3-(1-Methyl-2-pyrrolidinyl)pyridine|(+-)-nicotine|(R,S)-nicotine|(RS)-nicotine|nicotin|nikotin|rac-3-(1-methylpyrrolidin-2-yl)pyridine rac-3-(1-methylpyrrolidin-2-yl)pyridine (+-)-3-(1-Methyl-2-pyrrolidinyl)pyridine|(+-)-nicotine|(R,S)-nicotine|(RS)-nicotine|nicotin|nikotin|rac-3-(1-methylpyrrolidin-2-yl)pyridine http://purl.obolibrary.org/obo/CHEBI_18723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:187279 biolink:ChemicalEntity PRIM-O-GLUCOSYLCIMIFUGIN chemspider:24534049 Graph (2S)-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydrouro[3,2-g]chromen-5-one (2S)-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydrouro[3,2-g]chromen-5-one (2S)-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-2,3-dihydrouro[3,2-g]chromen-5-one http://purl.obolibrary.org/obo/CHEBI_187279 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:187431 biolink:ChemicalEntity Ipurolic acid chemspider:4446050|lipidmaps:LMFA01050081 Graph 3,11-dihydroxytetradecanoic acid 3,11-dihydroxytetradecanoic acid 3,11-dihydroxytetradecanoic acid http://purl.obolibrary.org/obo/CHEBI_187431 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:187612 biolink:ChemicalEntity LY293111 cas:161172-51-6|chemspider:154905|drugbank:DB12850|kegg.drug:D04074 Graph 2-[3-[3-[2-ethyl-4-(4-luorophenyl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid 2-[3-[3-[2-ethyl-4-(4-luorophenyl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid 2-[3-[3-[2-ethyl-4-(4-luorophenyl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid http://purl.obolibrary.org/obo/CHEBI_187612 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:187892 biolink:ChemicalEntity benzamidine(1+) A carboxamidinium ion obtained by protonation of the amidino group of benzamidine. Major species at pH 7.3. Graph benzamidine|benzamidinium benzamidine|benzamidinium http://purl.obolibrary.org/obo/CHEBI_187892 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:187893 biolink:ChemicalEntity baclofen zwitterion An amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of baclofen. Graph baclofen baclofen http://purl.obolibrary.org/obo/CHEBI_187893 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:187896 biolink:ChemicalEntity tacrine(1+) Graph tacrine tacrine http://purl.obolibrary.org/obo/CHEBI_187896 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1879 biolink:ChemicalEntity 2-(4-hydroxyphenyl)ethanol A phenol substituted at position 4 by a 2-hydroxyethyl group. cas:501-94-0|chemspider:9964|foodb.food:FDB012695|hmdb:HMDB0004284|kegg.compound:C06044|knapsack:C00029515|pdb-ccd:YRL|pubmed:21162532|pubmed:21381678|pubmed:22824366|pubmed:25074014|reaxys:1859884|wikipedia.en:Tyrosol Graph 4-(2-hydroxyethyl)phenol|4-Hydroxybenzeneethanol|4-Hydroxyphenylethanol|4-tyrosol|Tyrosol|p-Hydroxyphenethyl alcohol|tyrosol 4-(2-hydroxyethyl)phenol 4-(2-hydroxyethyl)phenol|4-Hydroxybenzeneethanol|4-Hydroxyphenylethanol|4-tyrosol|Tyrosol|p-Hydroxyphenethyl alcohol|tyrosol http://purl.obolibrary.org/obo/CHEBI_1879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18790 biolink:ChemicalEntity (S)-mevalonate The (S)-enantiomer of mevalonate. beilstein:6191681|kegg.compound:C02104|metacyc.compound:CPD-350|pubmed:29392731|pubmed:34687147 Graph (3S)-3,5-dihydroxy-3-methylpentanoate|(3S)-3,5-dihydroxy-3-methylvalerate|(3S)-mevalonate|(S)-3,5-dihydroxy-3-methylpentanoate|(S)-3,5-dihydroxy-3-methylvalerate|(S)-mevalonic acid anion|(S)-mevalonic acid(1-)|L-mevalonate (3S)-3,5-dihydroxy-3-methylpentanoate (3S)-3,5-dihydroxy-3-methylpentanoate|(3S)-3,5-dihydroxy-3-methylvalerate|(3S)-mevalonate|(S)-3,5-dihydroxy-3-methylpentanoate|(S)-3,5-dihydroxy-3-methylvalerate|(S)-mevalonic acid anion|(S)-mevalonic acid(1-)|L-mevalonate http://purl.obolibrary.org/obo/CHEBI_18790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188074 biolink:ChemicalEntity rosiglitazone(1-) Graph rosiglitazone rosiglitazone http://purl.obolibrary.org/obo/CHEBI_188074 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188145 biolink:ChemicalEntity (2R,3R)-nemonapride(1+) Graph (2R,3R)-nemonapride (2R,3R)-nemonapride http://purl.obolibrary.org/obo/CHEBI_188145 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188147 biolink:ChemicalEntity urea herbicide Any herbicide composed of urea or substituted urea substructure. Graph substituted urea herbicide|substituted urea herbicides|urea herbicides substituted urea herbicide|substituted urea herbicides|urea herbicides http://purl.obolibrary.org/obo/CHEBI_188147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188157 biolink:ChemicalEntity (S)-timolol(1+) pdb-ccd:TIM Graph (S)-timolol (S)-timolol http://purl.obolibrary.org/obo/CHEBI_188157 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188347 biolink:ChemicalEntity N-methylthiourea A member of the class of thioureas that is thiourea in which one of the hydrogens is replaced by a methyl group. cas:598-52-7|chemspider:2005903|pubmed:10725113|pubmed:15997371|pubmed:16136239|pubmed:18464928|pubmed:23256569|pubmed:23264945|pubmed:23873066|pubmed:24312826|pubmed:24477281|pubmed:2568740|pubmed:3087930|pubmed:3087931|pubmed:31093638|pubmed:32326038|pubmed:33562907|pubmed:34788025|pubmed:3921689|pubmed:6810507|reaxys:506162 Graph 1-methyl-2-thiourea|1-methylthiocarbamide|1-methylthiourea|N-methyl-2-thiourea|N-methylthiocarbamide|N-methylthiourea|methyl thiourea|methyl-2-thiourea|methylthiocarbamide|methylthiourea|monomethylthiourea N-methylthiourea 1-methyl-2-thiourea|1-methylthiocarbamide|1-methylthiourea|N-methyl-2-thiourea|N-methylthiocarbamide|N-methylthiourea|methyl thiourea|methyl-2-thiourea|methylthiocarbamide|methylthiourea|monomethylthiourea http://purl.obolibrary.org/obo/CHEBI_188347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188348 biolink:ChemicalEntity 7-methyloctan-1-ol A primary alcohol that is octane which is substituted by a methyl group at position 7 and a hydroxy group at position 1. It is a fragrance ingredient. cas:2430-22-0|chemspider:16158|pubmed:20659642|pubmed:27315375|pubmed:27551504|pubmed:31615683|pubmed:33797572|pubmed:9216748|reaxys:1733654 Graph 7-methyl-1-octanol|7-methyloctan-1-ol|7-methyloctanol|Isononanol|isononyl alcohol 7-methyloctan-1-ol 7-methyl-1-octanol|7-methyloctan-1-ol|7-methyloctanol|Isononanol|isononyl alcohol http://purl.obolibrary.org/obo/CHEBI_188348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188349 biolink:ChemicalEntity N-ethylthiourea A member of the class of thioureas that is thiourea in which one of the hydrogens is replaced by an ethyl group. cas:625-53-6|chemspider:2297335|hmdb:HMDB0252087|pubmed:12444606|pubmed:12511092|pubmed:16599434|pubmed:18961514|pubmed:1901311|pubmed:20422096|pubmed:28850075|pubmed:31322358|reaxys:1699551 Graph 1-ethyl-2-thiourea|1-ethylthiourea|N-ethylthiocarbamide|N-ethylthiourea|ethyl thiourea|ethyl-2-thiourea|ethylthiourea 1-ethylthiourea 1-ethyl-2-thiourea|1-ethylthiourea|N-ethylthiocarbamide|N-ethylthiourea|ethyl thiourea|ethyl-2-thiourea|ethylthiourea http://purl.obolibrary.org/obo/CHEBI_188349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188350 biolink:ChemicalEntity N-acetylthiourea A member of the class of thioureas that is thiourea in which one of the hydrogens is replaced by an acetyl group. cas:591-08-2|chemspider:2005797|pubmed:16480299|pubmed:18962206|pubmed:22619575|pubmed:2481120|reaxys:969960 Graph 1-acetyl-2-thiourea|1-acetylthiourea|1-ethanoylthiourea|N-(aminothioxomethyl)acetamide|N-acetyl-2-thiourea|N-acetylthiocarbamide|N-acetylthiourea|N-carbamothioylacetamide|acetothiourea|acetyl thiourea|acetylthiocarbamide|acetylthiourea N-carbamothioylacetamide 1-acetyl-2-thiourea|1-acetylthiourea|1-ethanoylthiourea|N-(aminothioxomethyl)acetamide|N-acetyl-2-thiourea|N-acetylthiocarbamide|N-acetylthiourea|N-carbamothioylacetamide|acetothiourea|acetyl thiourea|acetylthiocarbamide|acetylthiourea http://purl.obolibrary.org/obo/CHEBI_188350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188351 biolink:ChemicalEntity octane-1-thiol An alkanethiol that is octane substituted by a thiol group at position 1. cas:111-88-6|chemspider:7852|hmdb:HMDB0243979|pubmed:10517148|pubmed:17252789|pubmed:17719597|pubmed:18211108|pubmed:19778022|pubmed:20714578|pubmed:22849140|pubmed:23519474|pubmed:23545324|pubmed:30625535|pubmed:31408346|pubmed:32375074|pubmed:33561741|pubmed:33625852|pubmed:34037376|pubmed:34182040|pubmed:34198766|pubmed:35193051|reaxys:1733101|wikipedia.en:1-Octanethiol Graph 1-mercaptooctane|1-octanethiol|1-octyl mercaptan|1-octylmercaptan|1-octylthiol|mercaptan C8|n-octanethiol|n-octanethiolate|n-octyl mercaptan|n-octylmercaptan|n-octylthiol|octane-1-thiol|octyl mercaptan|octylmercaptan|octylthiol octane-1-thiol 1-mercaptooctane|1-octanethiol|1-octyl mercaptan|1-octylmercaptan|1-octylthiol|mercaptan C8|n-octanethiol|n-octanethiolate|n-octyl mercaptan|n-octylmercaptan|n-octylthiol|octane-1-thiol|octyl mercaptan|octylmercaptan|octylthiol http://purl.obolibrary.org/obo/CHEBI_188351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188358 biolink:ChemicalEntity (S)-2-benzylsuccinate Graph (S)-2-benzylsuccinate (S)-2-benzylsuccinate http://purl.obolibrary.org/obo/CHEBI_188358 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188470 biolink:ChemicalEntity N(6)-methyl,N(6)-L-threonylcarbamoyladenosine 5'-phosphate(2-) residue Graph N(6)-methyl,N(6)-L-threonylcarbamoyladenosine 5'-phosphate residue N(6)-methyl,N(6)-L-threonylcarbamoyladenosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_188470 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188567 biolink:ChemicalEntity Belnacasan cas:273404-37-8|chemspider:9572992|kegg.drug:D10416 Graph (2S)-1-[(2S)-2-[(4-amino-3-chlorobenzoyl)amino]-3,3-dimethylbutanoyl]-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-[(4-amino-3-chlorobenzoyl)amino]-3,3-dimethylbutanoyl]-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-[(4-amino-3-chlorobenzoyl)amino]-3,3-dimethylbutanoyl]-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]pyrrolidine-2-carboxamide http://purl.obolibrary.org/obo/CHEBI_188567 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18859 biolink:ChemicalEntity 1,2,3-tribromopropane beilstein:1732082|cas:96-11-7|gmelin:101184|umbbd.compound:c0622 Graph 1,2,3-tribromopropane|glycerol tribromohydrin|glyceryl tribromohydrin|s-tribromopropane|sym-tribromopropane 1,2,3-tribromopropane 1,2,3-tribromopropane|glycerol tribromohydrin|glyceryl tribromohydrin|s-tribromopropane|sym-tribromopropane http://purl.obolibrary.org/obo/CHEBI_18859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188602 biolink:ChemicalEntity Seletracetam cas:357336-74-4|chemspider:8118337|drugbank:DB05885|kegg.drug:D05817 Graph (2S)-2-[(4S)-4-(2,2-diluoroethenyl)-2-oxopyrrolidin-1-yl]butanamide (2S)-2-[(4S)-4-(2,2-diluoroethenyl)-2-oxopyrrolidin-1-yl]butanamide (2S)-2-[(4S)-4-(2,2-diluoroethenyl)-2-oxopyrrolidin-1-yl]butanamide http://purl.obolibrary.org/obo/CHEBI_188602 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188708 biolink:ChemicalEntity Methyl Arachidonyl Fluorophosphonate chemspider:8604682 Graph (5Z,8Z,11Z,14Z)-1-[luoro(methoxy)phosphoryl]icosa-5,8,11,14-tetraene (5Z,8Z,11Z,14Z)-1-[luoro(methoxy)phosphoryl]icosa-5,8,11,14-tetraene (5Z,8Z,11Z,14Z)-1-[luoro(methoxy)phosphoryl]icosa-5,8,11,14-tetraene http://purl.obolibrary.org/obo/CHEBI_188708 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188719 biolink:ChemicalEntity Ertugliflozin cas:1210344-57-2|chemspider:26340533|drugbank:DB11827|drugcentral:5270|kegg.drug:D10313 Graph (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol http://purl.obolibrary.org/obo/CHEBI_188719 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188730 biolink:ChemicalEntity ifetroban cas:143443-90-7|chemspider:16736637|drugbank:DB12321 Graph 3-[2-[[(1S,2R,3S,4R)-3-[4-(pentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoic acid 3-[2-[[(1S,2R,3S,4R)-3-[4-(pentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoic acid 3-[2-[[(1S,2R,3S,4R)-3-[4-(pentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoic acid http://purl.obolibrary.org/obo/CHEBI_188730 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188772 biolink:ChemicalEntity Sophoricoside cas:152-95-4|chemspider:4479150 Graph 5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one 5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one 5,7-dihydroxy-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one http://purl.obolibrary.org/obo/CHEBI_188772 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18882 biolink:ChemicalEntity 1,2-dichloroethene beilstein:1719345|cas:540-59-0|gmelin:100732 Graph 1,2-Dichloraethen|1,2-dichloroethene|1,2-dichloroethylene|acetylene dichloride 1,2-dichloroethene 1,2-Dichloraethen|1,2-dichloroethene|1,2-dichloroethylene|acetylene dichloride http://purl.obolibrary.org/obo/CHEBI_18882 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188851 biolink:ChemicalEntity Muraglitazar cas:331741-94-7|chemspider:178524|drugbank:DB06510|kegg.drug:D05091 Graph 2-[(4-methoxyphenoxy)carbonyl-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid 2-[(4-methoxyphenoxy)carbonyl-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid 2-[(4-methoxyphenoxy)carbonyl-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]amino]acetic acid http://purl.obolibrary.org/obo/CHEBI_188851 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18887 biolink:ChemicalEntity cyclohexa-3,5-diene-1,2-diol beilstein:3233703 Graph 1,2-dihydrobenzene-1,2-diol|cyclohexa-3,5-diene-1,2-diol cyclohexa-3,5-diene-1,2-diol 1,2-dihydrobenzene-1,2-diol|cyclohexa-3,5-diene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_18887 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188870 biolink:ChemicalEntity Idoxifene cas:116057-75-1|chemspider:2298565|kegg.drug:D04496 Graph 1-[2-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]ethyl]pyrrolidine 1-[2-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]ethyl]pyrrolidine 1-[2-[4-[(E)-1-(4-iodophenyl)-2-phenylbut-1-enyl]phenoxy]ethyl]pyrrolidine http://purl.obolibrary.org/obo/CHEBI_188870 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188921 biolink:ChemicalEntity C28-steroid metacyc.compound:C28-Steroids|pubmed:16460510 Graph a C28-steroid a C28-steroid http://purl.obolibrary.org/obo/CHEBI_188921 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188923 biolink:ChemicalEntity C29-steroid metacyc.compound:C29-Steroids|pubmed:16460510 Graph a C29-steroid a C29-steroid http://purl.obolibrary.org/obo/CHEBI_188923 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18898 biolink:ChemicalEntity 1,2-dinitroglycerol cas:621-65-8|umbbd.compound:c0062 Graph 1,2,3-Propanetriol, 1,2-dinitrate|1,2-Dinitroglycerin|1,2-dinitroglycerol|3-hydroxypropane-1,2-diyl dinitrate|Glyceryl-1,2-dinitrate 3-hydroxypropane-1,2-diyl dinitrate 1,2,3-Propanetriol, 1,2-dinitrate|1,2-Dinitroglycerin|1,2-dinitroglycerol|3-hydroxypropane-1,2-diyl dinitrate|Glyceryl-1,2-dinitrate http://purl.obolibrary.org/obo/CHEBI_18898 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:188998 biolink:ChemicalEntity alpha-D-xylulofuranose metacyc.compound:CPD-24961 Graph alpha-D-xylulofuranose alpha-D-xylulofuranose http://purl.obolibrary.org/obo/CHEBI_188998 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:188999 biolink:ChemicalEntity dopaminechrome (enol form) A member of the class of indolones that is 3,5-dihydro-2H-indole substituted by an oxo group at position 5 and a hydroxy group at position 6. cas:39984-17-3|pubmed:34388859|pubmed:8405659 Graph 2,3-dihydro-6-hydroxy-5H-indol-5-one|6-hydroxy-2,3-dihydro-5H-indol-5-one|6-hydroxy-2,3-dihydroindol-5-one|6-hydroxy-3,5-dihydro-2H-indol-5-one|aminochrome|aminochrome 1|dopaminochrome 6-hydroxy-2,3-dihydro-5H-indol-5-one 2,3-dihydro-6-hydroxy-5H-indol-5-one|6-hydroxy-2,3-dihydro-5H-indol-5-one|6-hydroxy-2,3-dihydroindol-5-one|6-hydroxy-3,5-dihydro-2H-indol-5-one|aminochrome|aminochrome 1|dopaminochrome http://purl.obolibrary.org/obo/CHEBI_188999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189002 biolink:ChemicalEntity dopaminechrome (keto form) A member of the class of indoledione that is 2,3,5,6-tetrahydro-1H-indole carrying oxo groups at positions 5 and 6; major microspecies at pH 7.3. It is an endogenous compound formed during dopamine oxidation and can induce neurotoxicity under certain aberrant conditions and induce Parkinson-like syndrome. cas:67992-45-4|chemspider:148871|hmdb:HMDB0248311|pubmed:22528249|pubmed:24434817|pubmed:25403520|pubmed:25634539|pubmed:26345577|pubmed:26695514|pubmed:27001668|pubmed:27020540|pubmed:27168424|pubmed:28285345|pubmed:28392416|pubmed:28478529|pubmed:28586763|pubmed:28763613|pubmed:29588162|pubmed:29593482|pubmed:30203271|pubmed:30343424|pubmed:30355251|pubmed:30983959|pubmed:31321384|pubmed:32588357|pubmed:33510082|pubmed:34388859|pubmed:34988761|pubmed:8405659 Graph 2,3,5,6-tetrahydro-1H-indole-5,6-dione|2,3-dihydro-1H-indole-5,6-dione|5,6-indolinedione|5.6-dihydroxyindoline quinone|aminochrome|dopaminechrome|indoline-5,6-dione 2,3-dihydro-1H-indole-5,6-dione 2,3,5,6-tetrahydro-1H-indole-5,6-dione|2,3-dihydro-1H-indole-5,6-dione|5,6-indolinedione|5.6-dihydroxyindoline quinone|aminochrome|dopaminechrome|indoline-5,6-dione http://purl.obolibrary.org/obo/CHEBI_189002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189047 biolink:ChemicalEntity carbovir triphosphate(4-) An organophosphate oxoanion that is the tetraanion of carbovir triphosphate, arising from deprotonation of the four triphosphate OH groups; major species at pH 7.3. pubmed:1703154 Graph (-)-carbovir 5'-triphosphate tetraanion|(-)-carbovir triphosphate tetraanion|({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)(phosphonatooxy)phosphinate|carbovir 5'-triphosphate tetraanion|carbovir triphosphate tetraanion ({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)(phosphonatooxy)phosphinate (-)-carbovir 5'-triphosphate tetraanion|(-)-carbovir triphosphate tetraanion|({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)(phosphonatooxy)phosphinate|carbovir 5'-triphosphate tetraanion|carbovir triphosphate tetraanion http://purl.obolibrary.org/obo/CHEBI_189047 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189052 biolink:ChemicalEntity carbovir diphosphate(3-) An organophosphate oxoanion that is the trianion of carbovir diphosphate, arising from deprotonation of the diphosphate OH groups; major species at pH 7.3. Graph (-)-carbovir 5'-diphosphate trianion|(-)-carbovir diphosphate trianion|({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)phosphonate|carbovir 5'-diphosphate trianion|carbovir diphosphate trianion ({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)phosphonate (-)-carbovir 5'-diphosphate trianion|(-)-carbovir diphosphate trianion|({[(1S,4R)-4-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)cyclopent-2-en-1-yl]methylphosphonato}oxy)phosphonate|carbovir 5'-diphosphate trianion|carbovir diphosphate trianion http://purl.obolibrary.org/obo/CHEBI_189052 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189053 biolink:ChemicalEntity carbovir monophosphate(2-) An organophosphate oxoanion that is the dianion of carbovir monophosphate, arising from deprotonation of the monophosphate OH groups; major species at pH 7.3. Graph (-)-carbovir 5'-monophosphate dianion|(-)-carbovir 5'-phosphate dianion|(-)-carbovir monophosphate dianion|(-)-carbovir phosphate dianion|[(1S,4R)-4-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)cyclopent-2-en-1-yl]methyl phosphate|carbovir 5'-monophosphate dianion|carbovir 5'-phosphate dianion|carbovir phosphate dianion [(1S,4R)-4-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)cyclopent-2-en-1-yl]methyl phosphate (-)-carbovir 5'-monophosphate dianion|(-)-carbovir 5'-phosphate dianion|(-)-carbovir monophosphate dianion|(-)-carbovir phosphate dianion|[(1S,4R)-4-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)cyclopent-2-en-1-yl]methyl phosphate|carbovir 5'-monophosphate dianion|carbovir 5'-phosphate dianion|carbovir phosphate dianion http://purl.obolibrary.org/obo/CHEBI_189053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189064 biolink:ChemicalEntity phytochromobilin(2-) Dicarboxylate anion of phytochromobilin; major species at pH 7.3. Graph phytochromobilin phytochromobilin http://purl.obolibrary.org/obo/CHEBI_189064 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189091 biolink:ChemicalEntity ribavirin 5'-monophosphate(2-) An organophosphate oxoanion resulting from the removal of both protons from the phosphate group of ribavirin 5'-monophosphate. It is the major species at pH 7.3. Graph 1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxamide 1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxamide 1-(5-O-phosphonato-beta-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxamide http://purl.obolibrary.org/obo/CHEBI_189091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189092 biolink:ChemicalEntity ribavirin 5'-diphosphate(3-) An organophosphate oxoanion resulting from the removal of the three diphosphate OH groups of ribavirin 5'-diphosphate. It is the major species at pH 7.3. Graph 1-{5-O-[(phosphonatooxy)phosphinato]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide 1-{5-O-[(phosphonatooxy)phosphinato]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide 1-{5-O-[(phosphonatooxy)phosphinato]-beta-D-ribofuranosyl}-1H-1,2,4-triazole-3-carboxamide http://purl.obolibrary.org/obo/CHEBI_189092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189093 biolink:ChemicalEntity ribavirin 5'-triphosphate(4-) An organophosphate oxoanion resulting from the removal of the four triphosphate OH groups of ribavirin 5'-triphosphate. It is the major species at pH 7.3. Graph 1-[5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-beta-D-ribofuranosyl]-1H-1,2,4-triazole-3-carboxamide 1-[5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-beta-D-ribofuranosyl]-1H-1,2,4-triazole-3-carboxamide 1-[5-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-beta-D-ribofuranosyl]-1H-1,2,4-triazole-3-carboxamide http://purl.obolibrary.org/obo/CHEBI_189093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189095 biolink:ChemicalEntity conidiogenone A diterpenoid with formula C20H32O2. It is isolated from Penicillium cyclopium and exhibits potent conidiation inducing activity. pubmed:12455699|pubmed:26937844|pubmed:30343633|pubmed:32502325 Graph (-)-conidiogenone|(1R,2R,4aR,6aS,6bR,9aR,10aR)-2-hydroxy-1,4a,7,7,9a-pentamethyldodecahydropentaleno[1,2-c]inden-4(1H)-one (1R,2R,4aR,6aS,6bR,9aR,10aR)-2-hydroxy-1,4a,7,7,9a-pentamethyldodecahydropentaleno[1,2-c]inden-4(1H)-one (-)-conidiogenone|(1R,2R,4aR,6aS,6bR,9aR,10aR)-2-hydroxy-1,4a,7,7,9a-pentamethyldodecahydropentaleno[1,2-c]inden-4(1H)-one http://purl.obolibrary.org/obo/CHEBI_189095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189099 biolink:ChemicalEntity 1D-myo-inositol 3,4,6-trisphosphate(6-) metacyc.compound:CPD-6681|pubmed:11909533 Graph 1D-myo-inositol 3,4,6-trisphosphate 1D-myo-inositol 3,4,6-trisphosphate http://purl.obolibrary.org/obo/CHEBI_189099 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189104 biolink:ChemicalEntity Febantel cas:58306-30-2|chemspider:4514715|drugbank:DB11409|kegg.compound:C75732|kegg.drug:D04135 Graph methyl N-[N'-[2-[(2-methoxyacetyl)amino]-4-phenylsulanylphenyl]-N-methoxycarbonylcarbamimidoyl]carbamate methyl N-[N'-[2-[(2-methoxyacetyl)amino]-4-phenylsulanylphenyl]-N-methoxycarbonylcarbamimidoyl]carbamate methyl N-[N'-[2-[(2-methoxyacetyl)amino]-4-phenylsulanylphenyl]-N-methoxycarbonylcarbamimidoyl]carbamate http://purl.obolibrary.org/obo/CHEBI_189104 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:18913 biolink:ChemicalEntity (1->3)-alpha-D-mannooligosaccharide Graph (1->3)-alpha-D-mannooligosaccharides (1->3)-alpha-D-mannooligosaccharides http://purl.obolibrary.org/obo/CHEBI_18913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18914 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-D-glucosaminyl group A group obtained by removing the hydroxy group from the hemiacetal function of β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-D-glucosamine. kegg.compound:C04850 Graph 1,3-beta-D-Galactosyl-(alpha-1,4-L-fucosyl)-N-acetyl-D-glucosaminyl-R|1,3-beta-D-galactosyl-(alpha-1,4-l-fucosyl)-N-acetyl-D-glucosaminyl group|6-deoxy-alpha-L-galactopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucopyranosyl|alpha-L-fucopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucopyranosyl|beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl alpha-L-fucopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucopyranosyl 1,3-beta-D-Galactosyl-(alpha-1,4-L-fucosyl)-N-acetyl-D-glucosaminyl-R|1,3-beta-D-galactosyl-(alpha-1,4-l-fucosyl)-N-acetyl-D-glucosaminyl group|6-deoxy-alpha-L-galactopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucopyranosyl|alpha-L-fucopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-D-glucopyranosyl|beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl http://purl.obolibrary.org/obo/CHEBI_18914 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18915 biolink:ChemicalEntity beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminyl group A group obtained by removing the hydroxy group from the hemiacetal function of β-D-galactosyl-(1→3)-N-acetyl-D-glucosamine. kegg.compound:C04656 Graph 1,3-beta-D-Galactosyl-N-acetyl-D-glucosaminyl-R|2-acetamido-2-deoxy-3-O-beta-D-galactopyranosyl-D-glucopyranosyl|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranosyl|beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminyl beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranosyl 1,3-beta-D-Galactosyl-N-acetyl-D-glucosaminyl-R|2-acetamido-2-deoxy-3-O-beta-D-galactopyranosyl-D-glucopyranosyl|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranosyl|beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminyl http://purl.obolibrary.org/obo/CHEBI_18915 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18918 biolink:ChemicalEntity 1,3-dichloropropene A chloropropene with two chloro substituents at positions 1 and 3 respectively.. pesticides:1,3-dichloropropene|pubmed:19259476|wikipedia.en:1,3-dichloropropene Graph http://purl.obolibrary.org/obo/CHEBI_18918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:18946 biolink:ChemicalEntity delta-lactone A lactone having a six-membered lactone ring. Graph 1,5-lactone|1,5-lactones|delta-lactona|delta-lactonas|delta-lactone|delta-lactones 1,5-lactone|1,5-lactones|delta-lactona|delta-lactonas|delta-lactone|delta-lactones http://purl.obolibrary.org/obo/CHEBI_18946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189471 biolink:ChemicalEntity Pseudolaric acid B chemspider:24534088 Graph (2E,4E)-5-[(1S,7S,8S,9R)-7-acetyloxy-4-methoxycarbonyl-9-methyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-3-en-9-yl]-2-methylpenta-2,4-dienoic acid (2E,4E)-5-[(1S,7S,8S,9R)-7-acetyloxy-4-methoxycarbonyl-9-methyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-3-en-9-yl]-2-methylpenta-2,4-dienoic acid (2E,4E)-5-[(1S,7S,8S,9R)-7-acetyloxy-4-methoxycarbonyl-9-methyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-3-en-9-yl]-2-methylpenta-2,4-dienoic acid http://purl.obolibrary.org/obo/CHEBI_189471 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189551 biolink:ChemicalEntity ribavirin carboxylate A monocarboxylic acid anion that is the conjugate base of ribavirin carboxylic acid arising from the deprotonation of the carboxy group. Major species at pH 7.3. Graph 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-3-carboxylate|1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylate|ribavirin carboxylic acid anion|ribavirin carboxylic acid(1-) 1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylate 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-3-carboxylate|1-beta-D-ribofuranosyl-1H-1,2,4-triazole-3-carboxylate|ribavirin carboxylic acid anion|ribavirin carboxylic acid(1-) http://purl.obolibrary.org/obo/CHEBI_189551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189554 biolink:ChemicalEntity S-[(2E,6E,10E)-geranylgeranyl]-L-cysteine zwitterion metacyc.compound:CPD-20307|pubmed:9287348 Graph [(2E,6E,10E)-geranylgeranyl]-L-cysteine [(2E,6E,10E)-geranylgeranyl]-L-cysteine http://purl.obolibrary.org/obo/CHEBI_189554 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189572 biolink:ChemicalEntity 2''-O-lipoyl-ADP-D-ribose(2-) pubmed:25525879 Graph 2''-O-lipoyl-ADP-D-ribose 2''-O-lipoyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_189572 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189573 biolink:ChemicalEntity 2''-O-biotinyl-ADP-D-ribose(2-) pubmed:25525879 Graph 2''-O-biotinyl-ADP-D-ribose 2''-O-biotinyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_189573 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189642 biolink:ChemicalEntity alpha-D-glucuronate A D-glucopyranuronate that has α configuration at the anomeric centre. Graph alpha-D-glucuronate alpha-D-glucuronate http://purl.obolibrary.org/obo/CHEBI_189642 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189666 biolink:ChemicalEntity varespladib(1-) A dicarboxylic acid monoamide(1−) that is the conjugate base of varespladib resulting from the deprotonation of the carboxy group; major species at pH 7.3. pubmed:33865953 Graph ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetate|varespladib|varespladib anion ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetate ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetate|varespladib|varespladib anion http://purl.obolibrary.org/obo/CHEBI_189666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189667 biolink:ChemicalEntity 5-methyltetrahydrofolate(2-) A dicarboxylic acid dianion resulting from the deprotonation of the two carboxy groups of 5-methyltetrahydrofolic acid; major species at pH 7.3. Graph (2S)-2-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzamido)pentanedioate|5-methyltetrahydrofolic acid dianion|N-(5-methyl-5,6,7,8-tetrahydropteroyl)-L-glutamate(2-) (2S)-2-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzamido)pentanedioate (2S)-2-(4-{[(2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzamido)pentanedioate|5-methyltetrahydrofolic acid dianion|N-(5-methyl-5,6,7,8-tetrahydropteroyl)-L-glutamate(2-) http://purl.obolibrary.org/obo/CHEBI_189667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189668 biolink:ChemicalEntity varespladib A member of the class of indoles that is 1H-indole substituted by benzyl, ethyl, oxamoyl, and carboxymethoxy groups at positions 1, 2, 3, and 4, respectively. It is an oral secretory phospholipase A2 inhibitor and exhibits anti-inflammatory effects. cas:172732-68-2|chemspider:137248|drugbank:DB11909|hmdb:HMDB0259766|kegg.drug:D08107|patent:CN101838232|pdb-ccd:VRD|pubmed:10027849|pubmed:12626975|pubmed:15467263|pubmed:16096451|pubmed:20809869|pubmed:21446779|pubmed:23071714|pubmed:27571102|pubmed:29439513|pubmed:30447275|pubmed:30453607|pubmed:30518149|pubmed:31748642|pubmed:32093386|pubmed:32442717|pubmed:32485836|pubmed:32512199|pubmed:32560391|pubmed:32889027|pubmed:33359941|pubmed:33865953|pubmed:33922825|pubmed:34143707|pubmed:34562493|pubmed:34744732|pubmed:34774704|pubmed:34929179|pubmed:35095526|wikipedia.en:Varespladib Graph ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetic acid|2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid|2-[[3-(2-Amino-2-oxoacetyl)-2-ethyl-1-(phenylmethyl)-1H-indol-4-yl]oxy]acetic acid|A-001|LY 315920|LY-315920|LY315920|S 5920|S-5920|varespladib|varespladibum ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetic acid ({3-[amino(oxo)acetyl]-1-benzyl-2-ethyl-1H-indol-4-yl}oxy)acetic acid|2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid|2-[[3-(2-Amino-2-oxoacetyl)-2-ethyl-1-(phenylmethyl)-1H-indol-4-yl]oxy]acetic acid|A-001|LY 315920|LY-315920|LY315920|S 5920|S-5920|varespladib|varespladibum http://purl.obolibrary.org/obo/CHEBI_189668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189673 biolink:ChemicalEntity 2''-O-hexadecanoyl-ADP-D-ribose(2-) Graph 2''-O-hexadecanoyl-ADP-D-ribose 2''-O-hexadecanoyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_189673 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189674 biolink:ChemicalEntity 2''-O-tetradecanoyl-ADP-D-ribose(2-) Graph 2''-O-tetradecanoyl-ADP-D-ribose 2''-O-tetradecanoyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_189674 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189697 biolink:ChemicalEntity (2Z,4E)-2-aminomuconic acid A 2-aminomuconic acid in which the two double bonds adopt a 2Z,4E-configuration. chemspider:4573610 Graph (2Z,4E)-2-amino-2,4-hexadienedioic acid|(2Z,4E)-2-aminohexa-2,4-dienedioic acid|cis,trans-2-aminomuconic acid (2Z,4E)-2-aminohexa-2,4-dienedioic acid (2Z,4E)-2-amino-2,4-hexadienedioic acid|(2Z,4E)-2-aminohexa-2,4-dienedioic acid|cis,trans-2-aminomuconic acid http://purl.obolibrary.org/obo/CHEBI_189697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189700 biolink:ChemicalEntity 2-aminomuconate A polyunsaturated dicarboxylic acid dianion arising from the deprotonation of the two carboxy groups of 2-aminomuconic acid. Graph 2-aminohexa-2,4-dienedioate|2-aminomuconic acid dianion|alpha-aminomuconate 2-aminohexa-2,4-dienedioate 2-aminohexa-2,4-dienedioate|2-aminomuconic acid dianion|alpha-aminomuconate http://purl.obolibrary.org/obo/CHEBI_189700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189750 biolink:ChemicalEntity Ophthalmate chemspider:5381694 Graph (2S)-2-azaniumyl-5-[[(2S)-1-(carboxylatomethylamino)-1-oxobutan-2-yl]amino]-5-oxopentanoate|ophthalmate (2S)-2-azaniumyl-5-[[(2S)-1-(carboxylatomethylamino)-1-oxobutan-2-yl]amino]-5-oxopentanoate (2S)-2-azaniumyl-5-[[(2S)-1-(carboxylatomethylamino)-1-oxobutan-2-yl]amino]-5-oxopentanoate|ophthalmate http://purl.obolibrary.org/obo/CHEBI_189750 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189823 biolink:ChemicalEntity hydroperoxydocosapentaenoic acid Graph hydroperoxydocosapentaenoic acids hydroperoxydocosapentaenoic acids http://purl.obolibrary.org/obo/CHEBI_189823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189831 biolink:ChemicalEntity hydroperoxydocosahexaenoic acid Graph hydroperoxydocosahexaenoic acids hydroperoxydocosahexaenoic acids http://purl.obolibrary.org/obo/CHEBI_189831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189832 biolink:ChemicalEntity hydroperoxy polyunsaturated fatty acid Any polyunsaturated fatty acid carrying one or more hydroperoxy substituents. Graph hydroperoxy polyunsaturated fatty acids hydroperoxy polyunsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_189832 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:189840 biolink:ChemicalEntity dicarboxylic fatty acid Any fatty acid containing two carboxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_189840 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189846 biolink:ChemicalEntity dicarboxylic fatty acid dianion Any fatty acid that contains 2 carboxylic groups. Major microspecies at pH 7.3 Graph http://purl.obolibrary.org/obo/CHEBI_189846 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189847 biolink:ChemicalEntity phthiocerol derivatives A lipid derived from phthiocerol. Graph http://purl.obolibrary.org/obo/CHEBI_189847 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189854 biolink:ChemicalEntity N(6)-(fatty acyl)-L-lysine residue An L-α-amino acid residue derived from any N6-(fatty acyl)-L-lysine. Graph N(6)-(fatty acyl)-L-lysine residue N(6)-(fatty acyl)-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_189854 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:189870 biolink:ChemicalEntity Arg-Phe(1+) A peptide cation obtained by deprotonation of the carboxy terminus and protonation of the side-chain guanidino group and the amino terminus of Arg-Phe; major species at pH 7.3. pubmed:35201898 Graph (2S)-2-{[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]amino}-3-phenylpropanoate|L-Arg-L-Phe(1+)|L-arginyl-L-phenylalanine|L-arginyl-L-phenylalanine cation|L-arginyl-L-phenylalanine(1+)|R-F(1+)|RF(1+)|arginylphenylalanine(1+) (2S)-2-{[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]amino}-3-phenylpropanoate (2S)-2-{[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]amino}-3-phenylpropanoate|L-Arg-L-Phe(1+)|L-arginyl-L-phenylalanine|L-arginyl-L-phenylalanine cation|L-arginyl-L-phenylalanine(1+)|R-F(1+)|RF(1+)|arginylphenylalanine(1+) http://purl.obolibrary.org/obo/CHEBI_189870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190006 biolink:ChemicalEntity (S)-tianeptine The S-enantiomer of tianeptine. pubmed:9175617 Graph 7-{[(11S)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid 7-{[(11S)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid 7-{[(11S)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid http://purl.obolibrary.org/obo/CHEBI_190006 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190007 biolink:ChemicalEntity (R)-tianeptine The R-enantiomer of tianeptine. pubmed:9175617 Graph 7-{[(11R)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid 7-{[(11R)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid 7-{[(11R)-3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl]amino}heptanoic acid http://purl.obolibrary.org/obo/CHEBI_190007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190008 biolink:ChemicalEntity 7-[(3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid A member of the class of dibenzothiazepines that is 3-chloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine 5,5-dioxide substituted by a (6-carboxyhexyl)amino group at position 11. Graph 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid|7-[(3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid|7-[(3-chloro-6-methyl-5,5-dioxo-6,11-dihydro-5H-5lambda(6)-dibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid 7-[(3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid 7-[(3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid|7-[(3-chloro-6-methyl-5,5-dioxido-6,11-dihydrodibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid|7-[(3-chloro-6-methyl-5,5-dioxo-6,11-dihydro-5H-5lambda(6)-dibenzo[c,f][1,2]thiazepin-11-yl)amino]heptanoic acid http://purl.obolibrary.org/obo/CHEBI_190008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190012 biolink:ChemicalEntity 3-(alpha-D-6-sulfoquinovosyl)-sn-glycerol(1-) pubmed:35074914 Graph 3-(6-sulfo-alpha-D-quinovosyl)glycerol|SQGro 3-(6-sulfo-alpha-D-quinovosyl)glycerol|SQGro http://purl.obolibrary.org/obo/CHEBI_190012 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190135 biolink:ChemicalEntity di-mu-sulfido-diiron Graph [2Fe-2S] cluster [2Fe-2S] cluster http://purl.obolibrary.org/obo/CHEBI_190135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190214 biolink:ChemicalEntity SM(d32:1) Graph [(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate [(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate [(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate http://purl.obolibrary.org/obo/CHEBI_190214 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190231 biolink:ChemicalEntity SM(d41:1) Graph [(2S,3R)-3-hydroxy-2-(tricosanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate [(2S,3R)-3-hydroxy-2-(tricosanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate [(2S,3R)-3-hydroxy-2-(tricosanoylamino)octadec-5-enyl] 2-(trimethylazaniumyl)ethyl phosphate http://purl.obolibrary.org/obo/CHEBI_190231 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190281 biolink:ChemicalEntity Alamandine chemspider:62956427|kegg.compound:C20971 Graph (2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxylic acid (2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxylic acid (2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_190281 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190288 biolink:ChemicalEntity hispidin(1-) An organic anion that is the conjugate base of hispidin resulting from the deprotonation of the 4-hydroxy group; major species at pH 7.3. metacyc.compound:CPD-6989|pubmed:30478037 Graph 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-2-oxo-2H-pyran-4-olate|hispidin|hispidin anion 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-2-oxo-2H-pyran-4-olate 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-2-oxo-2H-pyran-4-olate|hispidin|hispidin anion http://purl.obolibrary.org/obo/CHEBI_190288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19029 biolink:ChemicalEntity 1-aminopropan-2-yl phosphate Graph 1-aminopropan-2-ol O-phosphate|1-aminopropan-2-yl dihydrogen phosphate|2-amino-1-methylethyl dihydrogen phosphate 1-aminopropan-2-yl dihydrogen phosphate 1-aminopropan-2-ol O-phosphate|1-aminopropan-2-yl dihydrogen phosphate|2-amino-1-methylethyl dihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_19029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190295 biolink:ChemicalEntity inorganic calcium salt A calcium salt that lacks C-H bonds pubmed:28457049 Graph http://purl.obolibrary.org/obo/CHEBI_190295 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190297 biolink:ChemicalEntity inorganic magnesium salt A magnesium salt that lacks C-H bonds pubmed:16548135 Graph http://purl.obolibrary.org/obo/CHEBI_190297 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190299 biolink:ChemicalEntity organic magnesium salt Graph http://purl.obolibrary.org/obo/CHEBI_190299 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19030 biolink:ChemicalEntity 1-aminopropan-2-ol Any amino alcohol that is propan-2-ol substituted by an amino group at position 1. cas:78-96-6|ecmdb:ECMDB04013|hmdb:HMDB0012136|kegg.compound:C05771|pubmed:4362743|pubmed:5329339|reaxys:605275|wikipedia.en:1-Amino-2-propanol Graph 1-aminopropan-2-ol|1-methyl-2-aminoethanol|2-hydroxypropylamine|alpha-aminoisopropyl alcohol|isopropanolamine|monoisopropanolamine 1-aminopropan-2-ol 1-aminopropan-2-ol|1-methyl-2-aminoethanol|2-hydroxypropylamine|alpha-aminoisopropyl alcohol|isopropanolamine|monoisopropanolamine http://purl.obolibrary.org/obo/CHEBI_19030 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190300 biolink:ChemicalEntity inorganic phosphate salt A phosphate salt that lacks C-H bonds pubmed:11434984 Graph http://purl.obolibrary.org/obo/CHEBI_190300 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190303 biolink:ChemicalEntity inorganic potassium salt A potassium salt that lacks C-H bonds Graph http://purl.obolibrary.org/obo/CHEBI_190303 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190378 biolink:ChemicalEntity Leucyl-Asparagine chemspider:3341296|hmdb:HMDB0028924 Graph 4-amino-2-[(2-amino-4-methylpentanoyl)amino]-4-oxobutanoic acid 4-amino-2-[(2-amino-4-methylpentanoyl)amino]-4-oxobutanoic acid 4-amino-2-[(2-amino-4-methylpentanoyl)amino]-4-oxobutanoic acid http://purl.obolibrary.org/obo/CHEBI_190378 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190432 biolink:ChemicalEntity inorganic aluminium salt A aluminium salt that lacks C-H bonds Graph http://purl.obolibrary.org/obo/CHEBI_190432 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190438 biolink:ChemicalEntity inorganic barium salt A barium salt that lacks C-H bonds Graph http://purl.obolibrary.org/obo/CHEBI_190438 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190463 biolink:ChemicalEntity ergotamine(1+) A tertiary ammonium ion that is conjugate acid of ergotamine resulting from the protonation of the tertiary amino group; major species at pH 7.3. metacyc.compound:CPD-12363 Graph 8beta-{[(2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]carbamoyl}-6-methyl-9,10-didehydroergolin-6-ium|ergotamine|ergotamine cation 8beta-{[(2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]carbamoyl}-6-methyl-9,10-didehydroergolin-6-ium 8beta-{[(2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]carbamoyl}-6-methyl-9,10-didehydroergolin-6-ium|ergotamine|ergotamine cation http://purl.obolibrary.org/obo/CHEBI_190463 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190509 biolink:ChemicalEntity imipenem zwitterion Zwitterionic form of imipenem having an anionic carboxy group and a protonated methaneimidamido group; major species at pH 7.3. Graph (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-({2-[(iminiomethyl)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate|imipenem (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-({2-[(iminiomethyl)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-({2-[(iminiomethyl)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate|imipenem http://purl.obolibrary.org/obo/CHEBI_190509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190523 biolink:ChemicalEntity fructooligosaccharide carbohydrate-based polymers derived from natural sources that can be utilized by certain gastrointestinal tract bacteria but not by the host animal pdb-ccd:138392202|pubmed:25717086 Graph Fructo-oligosaccharide DP12/GF11 Fructo-oligosaccharide DP12/GF11 http://purl.obolibrary.org/obo/CHEBI_190523 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:190529 biolink:ChemicalEntity phosphatidylinositol 34:0 A 1-phosphatidyl-1D-myo-inositol in which the two acyl groups contain a total of 34 carbon atoms and no double bonds. Graph PI 34:0|PI(34:0)|phosphatidylinositol(34:0) PI 34:0|PI(34:0)|phosphatidylinositol(34:0) http://purl.obolibrary.org/obo/CHEBI_190529 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19062 biolink:ChemicalEntity 1-methylguanosine Guanosine substituted with a methyl group at position N-1. cas:2140-65-0|hmdb:HMDB0001563|metacyc.compound:CPD0-1043|pubmed:22770225|pubmed:2471265|pubmed:6477620|pubmed:7592438|reaxys:1226983|reaxys:570907 Graph 1-methylguanosine|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-1,9-dihydro-6H-purin-6-one|N1-Methylguanosine|m1g 1-methylguanosine|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-1,9-dihydro-6H-purin-6-one 1-methylguanosine|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-methyl-1,9-dihydro-6H-purin-6-one|N1-Methylguanosine|m1g http://purl.obolibrary.org/obo/CHEBI_19062 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190692 biolink:ChemicalEntity substance P(3+) A peptide cation obtained from the protonation of the amino and guanidino groups of substance P; major species at pH 7.3. Graph 1-[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]-L-prolyl-6-azaniumyl-L-norleucyl-L-prolyl-L-glutaminyl-L-glutaminyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-L-methioninamide|L-Arg-L-Pro-L-Lys-L-Pro-L-Gln-L-Gln-L-Phe-L-Phe-Gly-L-Leu-L-Met-NH2(3+)|RPKPQQFFGLM-NH2(3+)|RPKPQQFFGLM-amide(3+)|substance P|substance P trication 1-[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]-L-prolyl-6-azaniumyl-L-norleucyl-L-prolyl-L-glutaminyl-L-glutaminyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-L-methioninamide 1-[(2S)-5-{[amino(iminio)methyl]amino}-2-azaniumylpentanoyl]-L-prolyl-6-azaniumyl-L-norleucyl-L-prolyl-L-glutaminyl-L-glutaminyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-L-methioninamide|L-Arg-L-Pro-L-Lys-L-Pro-L-Gln-L-Gln-L-Phe-L-Phe-Gly-L-Leu-L-Met-NH2(3+)|RPKPQQFFGLM-NH2(3+)|RPKPQQFFGLM-amide(3+)|substance P|substance P trication http://purl.obolibrary.org/obo/CHEBI_190692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190701 biolink:ChemicalEntity goralatide(1-) A peptide anion obtained by removal of protons from the two carboxy groups as well as protonation of the primary amino group of goralatide; major species at pH 7.3. pubmed:7876104 Graph (2S)-1-(N-{(2S)-2-[(N-acetyl-L-seryl)amino]-3-carboxylatopropanoyl}-6-azaniumyl-L-norleucyl)pyrrolidine-2-carboxylate|Ac-SDKP(1-)|Ac-Ser-Asp-Lys-Pro(1-)|AcSDKP(1-)|N-acetyl-L-Ser-L-Asp-L-Lys-L-Pro(1-)|N-acetyl-L-seryl-L-alpha-aspartyl-L-lysyl-L-proline(1-)|N-acetyl-L-seryl-L-aspartyl-L-lysyl-L-proline(1-)|N-acetyl-Ser-Asp-Lys-Pro(1-)|goralatide|seraspenide(1-) (2S)-1-(N-{(2S)-2-[(N-acetyl-L-seryl)amino]-3-carboxylatopropanoyl}-6-azaniumyl-L-norleucyl)pyrrolidine-2-carboxylate (2S)-1-(N-{(2S)-2-[(N-acetyl-L-seryl)amino]-3-carboxylatopropanoyl}-6-azaniumyl-L-norleucyl)pyrrolidine-2-carboxylate|Ac-SDKP(1-)|Ac-Ser-Asp-Lys-Pro(1-)|AcSDKP(1-)|N-acetyl-L-Ser-L-Asp-L-Lys-L-Pro(1-)|N-acetyl-L-seryl-L-alpha-aspartyl-L-lysyl-L-proline(1-)|N-acetyl-L-seryl-L-aspartyl-L-lysyl-L-proline(1-)|N-acetyl-Ser-Asp-Lys-Pro(1-)|goralatide|seraspenide(1-) http://purl.obolibrary.org/obo/CHEBI_190701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190711 biolink:ChemicalEntity epoxy fatty acid anion An epoxy monocarboxylic acid anion resulting from the deprotonation of the carboxy group of any epoxy fatty acid. Graph epoxy fatty acid anions|epoxy fatty acid(1-)|epoxy-FA anion|epoxy-FA(1-)|fatty acid epoxide anion|fatty acid epoxide anions epoxy fatty acid anions|epoxy fatty acid(1-)|epoxy-FA anion|epoxy-FA(1-)|fatty acid epoxide anion|fatty acid epoxide anions http://purl.obolibrary.org/obo/CHEBI_190711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190712 biolink:ChemicalEntity epoxy monocarboxylic acid anion Any monocarboxylic acid anion containing at least one epoxy group. Graph epoxy monocarboxylic acid anions epoxy monocarboxylic acid anions http://purl.obolibrary.org/obo/CHEBI_190712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190744 biolink:ChemicalEntity dihydrodemethylsterigmatocystin An organic heteropentacyclic compound that is sterigmatocystin in which the methoxy group at position 6 is replaced by a hydroxy group. cas:30517-66-9|chemspider:20129490|kegg.compound:C20444|metacyc.compound:CPD-4586|pubmed:10543813|pubmed:10806361|pubmed:16349476|pubmed:2802602 Graph (3S,7R)-11,15-dihydroxy-6,8,20-trioxapentacyclo[10.8.0.0(2,9).0(3,7).0(14,19)]icosa-1(12),2(9),10,14,16,18-hexaen-13-one|(3aR,12cS)-1,2,3a,12c-tetrahydro-6,8-dihydroxy-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|(3aR,12cS)-6,8-dihydroxy-1,2,3a,12c-tetrahydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|DHDMST|demethyldihydrosterigmatocystin|dihydro-6-demethylsterigmatocystin (3aR,12cS)-6,8-dihydroxy-1,2,3a,12c-tetrahydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one (3S,7R)-11,15-dihydroxy-6,8,20-trioxapentacyclo[10.8.0.0(2,9).0(3,7).0(14,19)]icosa-1(12),2(9),10,14,16,18-hexaen-13-one|(3aR,12cS)-1,2,3a,12c-tetrahydro-6,8-dihydroxy-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|(3aR,12cS)-6,8-dihydroxy-1,2,3a,12c-tetrahydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one|DHDMST|demethyldihydrosterigmatocystin|dihydro-6-demethylsterigmatocystin http://purl.obolibrary.org/obo/CHEBI_190744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19092 biolink:ChemicalEntity 1-pyrroline beilstein:103165|cas:5724-81-2|gmelin:485825|kegg.compound:C15668 Graph 1-pyrroline|3,4-Dihydro-2H-pyrrole|3,4-dihydro-2H-pyrrole|Delta(1)-pyrroline 3,4-dihydro-2H-pyrrole 1-pyrroline|3,4-Dihydro-2H-pyrrole|3,4-dihydro-2H-pyrrole|Delta(1)-pyrroline http://purl.obolibrary.org/obo/CHEBI_19092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:190973 biolink:ChemicalEntity 2''-galloylhyperin cas:53209-27-1|chemspider:4955742 Graph [(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate [(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate [(2S,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_190973 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19098 biolink:ChemicalEntity 1-pyrrolinecarboxylic acid Graph 1-pyrrolinecarboxylic acids 1-pyrrolinecarboxylic acids http://purl.obolibrary.org/obo/CHEBI_19098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191001 biolink:ChemicalEntity 5-nitroso-8-quinolinol cas:3565-26-2|chemspider:18030|kegg.drug:D94646|lincs.smallmolecule:LSM-2275 Graph 5-nitrosoquinolin-8-ol 5-nitrosoquinolin-8-ol 5-nitrosoquinolin-8-ol http://purl.obolibrary.org/obo/CHEBI_191001 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191155 biolink:ChemicalEntity Picroside ii chemspider:2339083 Graph [2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate [2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate [2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate http://purl.obolibrary.org/obo/CHEBI_191155 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191156 biolink:ChemicalEntity Podocarpusflavone a cas:22136-74-9|chemspider:4478676 Graph 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one http://purl.obolibrary.org/obo/CHEBI_191156 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191177 biolink:ChemicalEntity Ser-Asp-Lys-Pro A tetrapeptide composed of L-serine, L-aspartic acid, L-lysine, and L-proline joined in sequence by peptide linkages. chemspider:8401015|pubmed:2374142 Graph H-Ser-Asp-Lys-Pro-OH|L-Ser-L-Asp-L-Lys-L-Pro|L-Ser-L-Asp-L-Lys-L-Pro-OH|L-seryl-L-alpha-aspartyl-L-lysyl-L-proline|S-D-K-P|SDKP L-seryl-L-alpha-aspartyl-L-lysyl-L-proline H-Ser-Asp-Lys-Pro-OH|L-Ser-L-Asp-L-Lys-L-Pro|L-Ser-L-Asp-L-Lys-L-Pro-OH|L-seryl-L-alpha-aspartyl-L-lysyl-L-proline|S-D-K-P|SDKP http://purl.obolibrary.org/obo/CHEBI_191177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191178 biolink:ChemicalEntity goralatide A tetrapeptide that is Ser-Asp-Lys-Pro in which the N-terminal amino group carries an acetyl group. It is selective inhibitor of primitive haematopoietic cell proliferation and exhibits anti-inflammatory, anti-fibrotic, and pro-angiogenic properties. cas:120081-14-3|chemspider:59343|hmdb:HMDB0062552|pubmed:15256375|pubmed:23351021|pubmed:23833979|pubmed:25331328|pubmed:26048023|pubmed:26324505|pubmed:26350537|pubmed:26656271|pubmed:27425816|pubmed:27577858|pubmed:28075040|pubmed:28164637|pubmed:28245754|pubmed:28771231|pubmed:2915977|pubmed:29269295|pubmed:29620193|pubmed:29684394|pubmed:29722788|pubmed:29990624|pubmed:30403163|pubmed:30826375|pubmed:30900390|pubmed:30949886|pubmed:30972974|pubmed:30998852|pubmed:31290182|pubmed:31387512|pubmed:31997585|pubmed:32352559|pubmed:32435194|pubmed:33135306|pubmed:33694311|pubmed:33948088|pubmed:34347311|pubmed:34508023|pubmed:34576239|pubmed:34608942|pubmed:34921949|pubmed:35101843|pubmed:35255573|pubmed:35750251 Graph (2S)-1-[(2S)-2-{[(2S)-2-{[(2S)-2-acetamido-3-hydroxypropanoyl]amino}-3-carboxypropanoyl]amino}-6-aminohexanoyl]pyrrolidine-2-carboxylic acid|Ac-L-Ser-L-Asp-L-Lys-L-Pro|Ac-SDKP|Ac-Ser-Asp-Lys-Pro|Ac-Ser-Asp-Lys-Pro-OH|AcSDKP|N-acetyl-L-Ser-L-Asp-L-Lys-L-Pro|N-acetyl-L-seryl-L-alpha-aspartyl-L-lysyl-L-proline|N-acetyl-Ser-Asp-Lys-Pro|N-acetyl-seryl-aspartyl-lysyl-proline|NAcSerAspLysPro|acetyl-N-Ser-Asp-Lys-Pro|acetyl-seryl-aspartyl-lysyl-proline|goralatida|goralatide|goralatidum|seraspenide N-acetyl-L-seryl-L-alpha-aspartyl-L-lysyl-L-proline (2S)-1-[(2S)-2-{[(2S)-2-{[(2S)-2-acetamido-3-hydroxypropanoyl]amino}-3-carboxypropanoyl]amino}-6-aminohexanoyl]pyrrolidine-2-carboxylic acid|Ac-L-Ser-L-Asp-L-Lys-L-Pro|Ac-SDKP|Ac-Ser-Asp-Lys-Pro|Ac-Ser-Asp-Lys-Pro-OH|AcSDKP|N-acetyl-L-Ser-L-Asp-L-Lys-L-Pro|N-acetyl-L-seryl-L-alpha-aspartyl-L-lysyl-L-proline|N-acetyl-Ser-Asp-Lys-Pro|N-acetyl-seryl-aspartyl-lysyl-proline|NAcSerAspLysPro|acetyl-N-Ser-Asp-Lys-Pro|acetyl-seryl-aspartyl-lysyl-proline|goralatida|goralatide|goralatidum|seraspenide http://purl.obolibrary.org/obo/CHEBI_191178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191197 biolink:ChemicalEntity branched-chain keto acid An oxo carboxylic acid in which the parent hydrocarbon chain has one or more alkyl substituents. Derivatives formed from the first step in the metabolism of branched-chain amino acids and can provide important information on animal health and disease. pmc:PMC8181598|pubmed:23684523|pubmed:29324714|pubmed:31092703|pubmed:31416902|pubmed:31504096|pubmed:32784821|pubmed:32878988|pubmed:33522397|pubmed:34798641|pubmed:35075301 Graph BCKA|BCKAs|branched-chain keto acids|branched-chain ketoacid|branched-chain ketoacids BCKA|BCKAs|branched-chain keto acids|branched-chain ketoacid|branched-chain ketoacids http://purl.obolibrary.org/obo/CHEBI_191197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191200 biolink:ChemicalEntity medium-chain (3S)-hydroxy fatty acyl-CoA(4-) A (3S)-3-hydroxyacyl-CoA arising from deprotonation of the phosphate and diphosphate OH groups of any medium-chain (3S)-hydroxy fatty acyl-CoA; major species at pH 7.3. Graph (3S)-medium-chain hydroxy fatty acyl-CoA(4-)|a medium-chain (3S)-3-hydroxyacyl-CoA (3S)-medium-chain hydroxy fatty acyl-CoA(4-)|a medium-chain (3S)-3-hydroxyacyl-CoA http://purl.obolibrary.org/obo/CHEBI_191200 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191201 biolink:ChemicalEntity branched-chain keto acid anion An oxo carboxylic acid anion that is the conjugate base of branched-chain keto acid resulting from the deprotonation of the carboxy group. Graph BCKA anion|BCKA anions|branched-chain keto acid anions|branched-chain ketoacid anion|branched-chain ketoacid anions BCKA anion|BCKA anions|branched-chain keto acid anions|branched-chain ketoacid anion|branched-chain ketoacid anions http://purl.obolibrary.org/obo/CHEBI_191201 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191214 biolink:ChemicalEntity dilevalol(1+) A secondary ammonium ion that is the conjugate acid of (R,R)-labetalol resulting from the protonation of the secondary amino group; major species at pH 7.3. Graph (2R)-N-[(2R)-2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]-4-phenylbutan-2-aminium|(R,R)-labetalol cation|(R,R)-labetalol(1+)|dilevalol cation (2R)-N-[(2R)-2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]-4-phenylbutan-2-aminium (2R)-N-[(2R)-2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]-4-phenylbutan-2-aminium|(R,R)-labetalol cation|(R,R)-labetalol(1+)|dilevalol cation http://purl.obolibrary.org/obo/CHEBI_191214 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191220 biolink:ChemicalEntity (2S)-methylsuccinate(2-) The dicarboxylate anion of (S)-methylsuccinic acid; major species at pH 7.3. Graph (2S)-methylsuccinate (2S)-methylsuccinate http://purl.obolibrary.org/obo/CHEBI_191220 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19129 biolink:ChemicalEntity 11alpha-hydroxy steroid Graph 11alpha-hydroxy steroids|a 11-alpha-hydroxy steroid 11alpha-hydroxy steroids|a 11-alpha-hydroxy steroid http://purl.obolibrary.org/obo/CHEBI_19129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19138 biolink:ChemicalEntity 12-HETE A HETE that is icosa-5,8,10,14-tetraenoic acid substituted by a hydroxy group at position 12. It is a metabolite of arachidonic acid. hmdb:HMDB0006111|pubmed:24685839|pubmed:8207335 Graph 12-hydroxy-5,8,10,14-eicosatetraenoic acid|12-hydroxy-5,8,10,14-icosatetraenoic acid 12-hydroxy-5,8,10,14-eicosatetraenoic acid|12-hydroxy-5,8,10,14-icosatetraenoic acid http://purl.obolibrary.org/obo/CHEBI_19138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191398 biolink:ChemicalEntity N(tele)-(ADP-D-ribosyl)-L-histidyl(2-) residue An organic anionic group obtained by deprotonation of the diphosphate OH groups of Nτ-(ADP-D-ribosyl)-L-histidyl residue; major microspeciess at pH 7.3. pubmed:35393539 Graph N(tele)-(ADP-D-ribosyl)-L-histidyl residue N(tele)-(ADP-D-ribosyl)-L-histidyl residue http://purl.obolibrary.org/obo/CHEBI_191398 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191408 biolink:ChemicalEntity ADP-alpha-D-ribose An ADP-D-ribose with β configuration at the anomeric centre. chemspider:394252|drugbank:DB02059|pdb-ccd:AR6|pubmed:11825615|pubmed:19211509|pubmed:20388721|pubmed:22248391|pubmed:26009185|pubmed:28515263|pubmed:32903769|pubmed:33352458|pubmed:7599921|pubmed:8327504 Graph [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate|adenosine 5'-[3-(alpha-D-ribofuranos-5-O-yl) dihydrogen diphosphate] adenosine 5'-[3-(alpha-D-ribofuranos-5-O-yl) dihydrogen diphosphate] [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate|adenosine 5'-[3-(alpha-D-ribofuranos-5-O-yl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_191408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191503 biolink:ChemicalEntity 4-Methoxy-1-naphthol cas:84-85-5|chemspider:59913|hmdb:HMDB0032727 Graph 4-methoxynaphthalen-1-ol 4-methoxynaphthalen-1-ol 4-methoxynaphthalen-1-ol http://purl.obolibrary.org/obo/CHEBI_191503 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19168 biolink:ChemicalEntity 17-oxo steroid Any oxo steroid carrying the oxo group at position 17. Graph 17-keto steroid|17-keto steroids|17-ketosteroid|17-ketosteroids|17-oxo steroids|17-oxosteroid|17-oxosteroids|a 17-oxo steroid 17-keto steroid|17-keto steroids|17-ketosteroid|17-ketosteroids|17-oxo steroids|17-oxosteroid|17-oxosteroids|a 17-oxo steroid http://purl.obolibrary.org/obo/CHEBI_19168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191853 biolink:ChemicalEntity 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid A cyclopentanone that is cyclopentane substituted by a 7-carboxyheptyl, (2Z)-pent-2-en-1-yl, and oxo groups at positions 1, 2, and 3, respectively. chemspider:21377986|pubmed:16963437 Graph 3-oxo-2-(2'-[Z]-pentenyl)cyclopentane-1-octanoic acid|3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoic acid|8-[2-[(Z)-2-pentenyl]-3-oxocyclopentyl]octanoic acid|8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid 3-oxo-2-(2'-[Z]-pentenyl)cyclopentane-1-octanoic acid|3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-octanoic acid|8-[2-[(Z)-2-pentenyl]-3-oxocyclopentyl]octanoic acid|8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid http://purl.obolibrary.org/obo/CHEBI_191853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191854 biolink:ChemicalEntity arachidonyl-2'-chloroethylamide A fatty amide obtained by the formal condensation of arachidonic acid with 2-chloroethanamine. It is a potent agonist of the CB1 receptor (Ki = 1.4 nM) and also has a low affinity for the CB2 receptor (Ki = 3100 nM). cas:220556-69-4|chemspider:4470547|hmdb:HMDB0247891|pubmed:10336536|pubmed:12095655|pubmed:15006899|pubmed:15277316|pubmed:15493300|pubmed:16649551|pubmed:16930590|pubmed:18362599|pubmed:19751793|pubmed:25881484|pubmed:25904357|pubmed:26820679|pubmed:27663280|pubmed:28441341|pubmed:28859122|pubmed:30552944|pubmed:30607903|pubmed:32413434|pubmed:33083022|pubmed:33220269|pubmed:34090883|pubmed:35189809|wikipedia.en:Arachidonyl-2'-chloroethylamide Graph (5Z,8Z,11Z,14Z)-N-(2-chloroethyl)-5,8,11,14-eicosatetraenamide|(5Z,8Z,11Z,14Z)-N-(2-chloroethyl)icosa-5,8,11,14-tetraenamide|ACEA|N-(2-chloroethyl)-5Z,8Z,11Z,14Z-eicosatetraenamide|arachidonyl-2-chloroethylamide (5Z,8Z,11Z,14Z)-N-(2-chloroethyl)icosa-5,8,11,14-tetraenamide (5Z,8Z,11Z,14Z)-N-(2-chloroethyl)-5,8,11,14-eicosatetraenamide|(5Z,8Z,11Z,14Z)-N-(2-chloroethyl)icosa-5,8,11,14-tetraenamide|ACEA|N-(2-chloroethyl)-5Z,8Z,11Z,14Z-eicosatetraenamide|arachidonyl-2-chloroethylamide http://purl.obolibrary.org/obo/CHEBI_191854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191855 biolink:ChemicalEntity 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate An oxo monocarboxylic acid anion that is the conjugate base of 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid resulting from the deprotonation of the carboxy group; major species at pH 7.3. metacyc.compound:CPD-730 Graph (1S,2S)-OPC-8|(1S,2S)-OPC8 anion|8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate|8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate|OPC-8:0(1-) 8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate (1S,2S)-OPC-8|(1S,2S)-OPC8 anion|8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate|8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate|OPC-8:0(1-) http://purl.obolibrary.org/obo/CHEBI_191855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191856 biolink:ChemicalEntity helioxanthin A furonaphthodioxole that is furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one substituted by a 1,3-benzodioxol-5-yl group at posiiton 10. It is a inhibitor of HBV, HCV and HSV-1 viruses. cas:18920-47-3|chemspider:154166|knapsack:C00007211|patent:US6306899|pubmed:12392817|pubmed:15658867|pubmed:16004082|pubmed:17488817|pubmed:18249449|pubmed:18789903|pubmed:20061158|pubmed:21107018|pubmed:22497733|pubmed:23465436|pubmed:26047161|pubmed:26464283|pubmed:33668694 Graph 10-(1,3-benzodioxol-5-yl)-9H-[2]benzofuro[6,5-g][1,3]benzodioxol-7-one|10-(1,3-benzodioxol-5-yl)furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one|10-(2H-1,3-benzodioxol-5-yl)-2H-furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one|HE-145 10-(1,3-benzodioxol-5-yl)furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one 10-(1,3-benzodioxol-5-yl)-9H-[2]benzofuro[6,5-g][1,3]benzodioxol-7-one|10-(1,3-benzodioxol-5-yl)furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one|10-(2H-1,3-benzodioxol-5-yl)-2H-furo[3',4':6,7]naphtho[1,2-d][1,3]dioxol-7(9H)-one|HE-145 http://purl.obolibrary.org/obo/CHEBI_191856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191864 biolink:ChemicalEntity cholesterol ester 16:0 Graph CE 16:0|CE(16:0) CE 16:0|CE(16:0) http://purl.obolibrary.org/obo/CHEBI_191864 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:191874 biolink:ChemicalEntity fatty acid 26:0 A saturated fatty acid containing 26 carbons and 0 double bonds. Graph FA 26:0|FA(26:0) FA 26:0|FA(26:0) http://purl.obolibrary.org/obo/CHEBI_191874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191931 biolink:ChemicalEntity dextran sulfate anion An organosulfate oxoanion resulting from the deprotonation of the sulfo groups of dextran sulfate; major species at pH 7.3. Graph dextran polysulfate anion|dextran sulfate polyanion|dextran sulphate anion dextran polysulfate anion|dextran sulfate polyanion|dextran sulphate anion http://purl.obolibrary.org/obo/CHEBI_191931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:191939 biolink:ChemicalEntity ponatinib(1+) A tertiary ammonium ion that is the conjugate acid of ponatinib resulting from the protonation of the piperazine nitrogen. Major microspecies at pH 7.3. Graph 4-{4-[3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido]-2-(trifluoromethyl)benzyl}-1-methylpiperazin-1-ium|4-{[4-{3-[(imidazo[1,2-b]pyridazin-3-yl)ethynyl]-4-methylbenzamido}-2-(trifluoromethyl)phenyl]methyl}-1-methylpiperazin-1-ium 4-{4-[3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido]-2-(trifluoromethyl)benzyl}-1-methylpiperazin-1-ium 4-{4-[3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido]-2-(trifluoromethyl)benzyl}-1-methylpiperazin-1-ium|4-{[4-{3-[(imidazo[1,2-b]pyridazin-3-yl)ethynyl]-4-methylbenzamido}-2-(trifluoromethyl)phenyl]methyl}-1-methylpiperazin-1-ium http://purl.obolibrary.org/obo/CHEBI_191939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19203 biolink:ChemicalEntity 1H-pyrrole A tautomer of pyrrole that has the double bonds at positions 2 and 4. beilstein:1159|cas:109-97-7|gmelin:1705|pubmed:1556177|pubmed:2917974 Graph 1-aza-2,4-cyclopentadiene|1H-pyrrole|Pyrrol|divinyleneimine|divinylenimine|imidole|monopyrrole|pyrrole 1H-pyrrole 1-aza-2,4-cyclopentadiene|1H-pyrrole|Pyrrol|divinyleneimine|divinylenimine|imidole|monopyrrole|pyrrole http://purl.obolibrary.org/obo/CHEBI_19203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192089 biolink:ChemicalEntity 3-methoxytyraminium A primary ammonium ion that is the conjugate acid of 3-methoxytyramine resulting from the protonation of the primary amino group; Major microspecies at pH 7.3. metacyc.compound:CPD-7650|pubmed:7082642|pubmed:7703232 Graph 2-(4-hydroxy-3-methoxyphenyl)ethan-1-aminium|2-(4-hydroxy-3-methoxyphenyl)ethanaminium|3-MT(1+)|3-methoxy-p-tyraminium|3-methoxytyramine|3-methoxytyramine cation|3-methoxytyramine(1+) 2-(4-hydroxy-3-methoxyphenyl)ethanaminium 2-(4-hydroxy-3-methoxyphenyl)ethan-1-aminium|2-(4-hydroxy-3-methoxyphenyl)ethanaminium|3-MT(1+)|3-methoxy-p-tyraminium|3-methoxytyramine|3-methoxytyramine cation|3-methoxytyramine(1+) http://purl.obolibrary.org/obo/CHEBI_192089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:1921 biolink:ChemicalEntity 4-oxocyclohexanecarboxylic acid A 5-oxo monocarboxylic acid that is cyclohexanone in which one of the hydrogens at position 4 is substituted by a carboxylic acid group. cas:874-61-3|kegg.compound:C03767|pubmed:14767139|pubmed:16789736|pubmed:3292236|pubmed:4831062|pubmed:8281951|reaxys:1635956 Graph 1-cyclohexanone-4-carboxylic acid|4-Ketocyclohexanecarboxylic acid|4-oxocyclohexanecarboxylic acid|cyclohexanone-4-carboxylic acid 4-oxocyclohexanecarboxylic acid 1-cyclohexanone-4-carboxylic acid|4-Ketocyclohexanecarboxylic acid|4-oxocyclohexanecarboxylic acid|cyclohexanone-4-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_1921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192164 biolink:ChemicalEntity 7-Dehydrocholesterol 5,6-oxide cas:95841-71-7|chemspider:111932|lipidmaps:LMST03020672 Graph (1S,2R,5S,7S,9R,12R,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-10-en-5-ol (1S,2R,5S,7S,9R,12R,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-10-en-5-ol (1S,2R,5S,7S,9R,12R,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-10-en-5-ol http://purl.obolibrary.org/obo/CHEBI_192164 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19217 biolink:ChemicalEntity 2',3'-cyclic purine nucleotide Graph 2',3'-cyclic purine nucleotides 2',3'-cyclic purine nucleotides http://purl.obolibrary.org/obo/CHEBI_19217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192269 biolink:ChemicalEntity CB1 receptor agonist A cannabinoid receptor agonist that binds to and activates type 1 cannabinoid receptors. wikipedia.en:Cannabinoid_receptor_type_1 Graph CB1 receptor agonist|CB1 receptor agonists|CB1R agonist|CB1R agonists|cannabinoid receptor 1 agonist|cannabinoid receptor 1 agonists|cannabinoid receptor type 1 agonist|cannabinoid receptor type 1 agonists|type 1 cannabinoid receptor agonist|type 1 cannabinoid receptor agonists CB1 receptor agonist|CB1 receptor agonists|CB1R agonist|CB1R agonists|cannabinoid receptor 1 agonist|cannabinoid receptor 1 agonists|cannabinoid receptor type 1 agonist|cannabinoid receptor type 1 agonists|type 1 cannabinoid receptor agonist|type 1 cannabinoid receptor agonists http://purl.obolibrary.org/obo/CHEBI_192269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19237 biolink:ChemicalEntity 2'-deoxyadenosine 5'-phosphate Graph 2'-deoxyadenosine 5'-phosphates 2'-deoxyadenosine 5'-phosphates http://purl.obolibrary.org/obo/CHEBI_19237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192377 biolink:ChemicalEntity 2,4-dihydroxypyrimidine-5-carboxylic acid A hydroxypyrimidine that is pyrimidine-2,4-diol carrying a carboxy group at position 5. cas:23945-44-0 Graph 2,4-dihydroxy-5-pyrimidinecarboxylic acid|2,4-dihydroxypyrimidine-5-carboxylic acid|uracil-5-carboxylic acid (enol form) 2,4-dihydroxypyrimidine-5-carboxylic acid 2,4-dihydroxy-5-pyrimidinecarboxylic acid|2,4-dihydroxypyrimidine-5-carboxylic acid|uracil-5-carboxylic acid (enol form) http://purl.obolibrary.org/obo/CHEBI_192377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19239 biolink:ChemicalEntity 2'-deoxyadenosine phosphate Graph 2'-deoxyadenosine phosphates 2'-deoxyadenosine phosphates http://purl.obolibrary.org/obo/CHEBI_19239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192461 biolink:ChemicalEntity toosendanin chemspider:24534091 Graph [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(uran-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(uran-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(uran-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate http://purl.obolibrary.org/obo/CHEBI_192461 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192484 biolink:ChemicalEntity ciprofloxacin zwitterion A zwitterion formed from ciprofloxacin by transfer of a proton from the carboxy to the amino group; major species at pH 7.3. metacyc.compound:CPD-12843|pubmed:11202360|pubmed:12084502|pubmed:21368411|pubmed:9303400 Graph 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-4-ium-1-yl)-1,4-dihydroquinoline-3-carboxylate 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-4-ium-1-yl)-1,4-dihydroquinoline-3-carboxylate 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-4-ium-1-yl)-1,4-dihydroquinoline-3-carboxylate http://purl.obolibrary.org/obo/CHEBI_192484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192486 biolink:ChemicalEntity ciprofloxacin(1+) A secondary ammonium ion that is the conjugate acid of ciprofloxacin resulting from the protonation of the NH group; major species at acidic pH. pubmed:35371545 Graph 4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinolin-7-yl)piperazin-1-ium|ciprofloxacin cation 4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinolin-7-yl)piperazin-1-ium 4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinolin-7-yl)piperazin-1-ium|ciprofloxacin cation http://purl.obolibrary.org/obo/CHEBI_192486 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192499 biolink:ChemicalEntity anthoxanthin are a type of flavonoid pigments in plants. Anthoxanthins are water-soluble pigments which range in color from white or colorless to a creamy to yellow, often on petals of flowers. wikipedia.en:https://en.wikipedia.org/wiki/Anthoxanthin Graph http://purl.obolibrary.org/obo/CHEBI_192499 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192500 biolink:ChemicalEntity flavanonol a class of flavonoids that use the 3-hydroxy-2,3-dihydro-2-phenylchromen-4-one (IUPAC name) backbone. wikipedia.en:https://en.wikipedia.org/wiki/Flavanonol Graph http://purl.obolibrary.org/obo/CHEBI_192500 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192504 biolink:ChemicalEntity elicitor A chemical or biochemical compound that is introduced in small concentrations to a living system to promote the biosynthesis of the target bioactive compound. pubmed:25969762|wikipedia.en:Elicitor Graph elicitors elicitors http://purl.obolibrary.org/obo/CHEBI_192504 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19252 biolink:ChemicalEntity 2'-deoxyribonucleoside 3'-monophosphate Graph 2'-deoxyribonucleoside 3'-monophosphates 2'-deoxyribonucleoside 3'-monophosphates http://purl.obolibrary.org/obo/CHEBI_19252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192527 biolink:ChemicalEntity ochratoxin alpha(1-) Conjugate base of ochratoxin α; major species at pH 7.3. metacyc.compound:CPD-22713 Graph ochratoxin alpha ochratoxin alpha http://purl.obolibrary.org/obo/CHEBI_192527 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192536 biolink:ChemicalEntity cyanidin 3-O-[6-O-(p-coumaroyl)-2-O-(beta-D-xylosyl)-beta-D-glucosyl]-5-O-beta-D-glucoside pubmed:17425720 Graph anthocyanin A3 anthocyanin A3 http://purl.obolibrary.org/obo/CHEBI_192536 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192537 biolink:ChemicalEntity cyanidin 3-O-[6-O-(p-coumaroyl)-2-O-(beta-D-xylosyl)-beta-D-glucosyl]-5-O-(6-O-malonyl-beta-D-glucoside)(1-) pubmed:17425720 Graph anthocyanin A5 anthocyanin A5 http://purl.obolibrary.org/obo/CHEBI_192537 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19254 biolink:ChemicalEntity purine 2'-deoxyribonucleoside A 2'-deoxyribonucleoside that has a purine moiety as the nucleobase (the R group in the illustration). Graph purine 2'-deoxyribonucleosides purine 2'-deoxyribonucleosides http://purl.obolibrary.org/obo/CHEBI_19254 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192545 biolink:ChemicalEntity LY 379268 An organic heterobicyclic compound that is (1R,5S)-2-oxabicyclo[3.1.0]hexane carrying amino, carboxy, and carboxy groups at positions 4R, 4R and 6R, respectively. It is a potent agonist of group II metabotropic glutamate receptors mGluR2 and mGluR3 (EC50 = 2.69 nM and 4.48 nM, respectively) that exhibits antipsychotic-like action in animal models of schizophrenia. cas:191471-52-0|pubmed:10090786|pubmed:21139059|pubmed:21477044|pubmed:22659409|pubmed:22820300|pubmed:23593498|pubmed:23624743|pubmed:23769742|pubmed:23827202|pubmed:23948211|pubmed:23953655|pubmed:24631484|pubmed:24859609|pubmed:25063582|pubmed:25158962|pubmed:26044619|pubmed:26149611|pubmed:26241341|pubmed:26317098|pubmed:26861891|pubmed:26955838|pubmed:27394931|pubmed:29462112|pubmed:29562588|pubmed:29858599|pubmed:30909243|pubmed:31306647|pubmed:31536785|pubmed:31580222|pubmed:31705165|pubmed:33763176|pubmed:34330748|pubmed:34416343|pubmed:35772967|wikipedia.en:LY-379,268 Graph (1R,4R,5S,6R)-4-amino-2-oxabicyclo[3.1.0]hexane-4,6-dicarboxylic acid|LY-379,268|LY-379268|LY379268 (1R,4R,5S,6R)-4-amino-2-oxabicyclo[3.1.0]hexane-4,6-dicarboxylic acid (1R,4R,5S,6R)-4-amino-2-oxabicyclo[3.1.0]hexane-4,6-dicarboxylic acid|LY-379,268|LY-379268|LY379268 http://purl.obolibrary.org/obo/CHEBI_192545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19255 biolink:ChemicalEntity pyrimidine 2'-deoxyribonucleoside Graph pyrimidine 2'-deoxyribonucleosides pyrimidine 2'-deoxyribonucleosides http://purl.obolibrary.org/obo/CHEBI_19255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192560 biolink:ChemicalEntity N(tele)-methyl-L-histidine zwitterion A L-histidine zwitterion in which the methyl group is at Nτ-position; major microspecies at pH 7.3. pubmed:35758414 Graph N(tele)-methyl-L-histidine N(tele)-methyl-L-histidine http://purl.obolibrary.org/obo/CHEBI_192560 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19257 biolink:ChemicalEntity 2'-deoxyribonucleoside monophosphate Graph 2'-deoxyribonucleoside monophosphates 2'-deoxyribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_19257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19260 biolink:ChemicalEntity 2'-deoxyribonucleotide Graph 2'-deoxyribonucleotides 2'-deoxyribonucleotides http://purl.obolibrary.org/obo/CHEBI_19260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192700 biolink:ChemicalEntity genkwanin(1-) Graph genkwanin genkwanin http://purl.obolibrary.org/obo/CHEBI_192700 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192701 biolink:ChemicalEntity scutellarein 7-methyl ether metacyc.compound:CPD-15630 Graph scutellarein 7-methyl ether scutellarein 7-methyl ether http://purl.obolibrary.org/obo/CHEBI_192701 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192702 biolink:ChemicalEntity ladanein A dimethoxyflavone that is scutellarein in which the hydroxy groups at positions 4' and 7 are replaced by methoxy groups. It is an effective anti-HCV agent. agr:IND601124298|cas:10176-71-3|knapsack:C00003839|lipidmaps:LMPK12111165|metacyc.compound:CPD-15632|pubmed:11086900|pubmed:12677524|pubmed:17342612|pubmed:17639984|pubmed:19361824|pubmed:19644796|pubmed:20397728|pubmed:21108116|pubmed:22465429|pubmed:24250614|pubmed:25002815|pubmed:26197515|pubmed:26357892|pubmed:26969331|pubmed:31013747|pubmed:31459671|pubmed:31678632 Graph 4',7-dimethylscutellarein|5,6-dihydroxy-7,4'-dimethoxyflavone|5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|BJ486K|ladanein 5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 4',7-dimethylscutellarein|5,6-dihydroxy-7,4'-dimethoxyflavone|5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|BJ486K|ladanein http://purl.obolibrary.org/obo/CHEBI_192702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192703 biolink:ChemicalEntity salvigenin A trimethoxyflavone that is scutellarein in which the hydroxy groups at positions 4', 6, and 7 are replaced by methoxy groups. cas:19103-54-9|foodb.food:FDB006184|hmdb:HMDB0128577|knapsack:C00003840|lipidmaps:LMPK12111166|metacyc.compound:CPD-15477|pubmed:12562087|pubmed:22017660|pubmed:22899171|pubmed:24270218|pubmed:25972379|pubmed:26035635|pubmed:26669105|pubmed:28990868|pubmed:29373904|pubmed:31161797|pubmed:32024626|pubmed:32660058|pubmed:33395575|pubmed:33440186|pubmed:33524860|pubmed:33715562|pubmed:34209510|pubmed:34440504|pubmed:34630118|pubmed:34839965|pubmed:34901489|pubmed:35448815|pubmed:35846999|pubmed:840933 Graph 5-hydroxy-4',6,7-trimethoxyflavone|5-hydroxy-6,7,4'-trimethoxy-flavone|5-hydroxy-6,7,4'-trimethoxyflavone|5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|7-O-methylpectolinarigenin|psathyrotin|salvigenin 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one 5-hydroxy-4',6,7-trimethoxyflavone|5-hydroxy-6,7,4'-trimethoxy-flavone|5-hydroxy-6,7,4'-trimethoxyflavone|5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one|7-O-methylpectolinarigenin|psathyrotin|salvigenin http://purl.obolibrary.org/obo/CHEBI_192703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192706 biolink:ChemicalEntity rhamnetin-3-olate pubmed:14697269 Graph 7-methylquercetin-3-olate|rhamnetin 7-methylquercetin-3-olate|rhamnetin http://purl.obolibrary.org/obo/CHEBI_192706 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192710 biolink:ChemicalEntity SM-164 A potent cell-permeable and bivalent Smac mimetic which binds to XIAP, cIAP-1 and cIAP-2 proteins (Ki = 0.56 nM, 0.31 nM and 1.1 nM, respectively). It induces apoptosis and tumor regression in cancer xenograft models. cas:957135-43-2|pubmed:17999504|pubmed:19010913|pubmed:21282353|pubmed:21372226|pubmed:21462933|pubmed:21901386|pubmed:22148838|pubmed:23142291|pubmed:23240027|pubmed:23699656|pubmed:31059038|pubmed:32332865|pubmed:35525732 Graph (3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-N-[(S)-(1-{4-[4-(4-{4-[(S)-({[(3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-5-oxodecahydropyrrolo[1,2-a]azocin-3-yl]carbonyl}amino)(phenyl)methyl]-1H-1,2,3-triazol-1-yl}butyl)phenyl]butyl}-1H-1,2,3-triazol-4-yl)(phenyl)methyl]-5-oxodecahydropyrrolo[1,2-a]azocine-3-carboxamide|SM 164|SM164 (3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-N-[(S)-(1-{4-[4-(4-{4-[(S)-({[(3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-5-oxodecahydropyrrolo[1,2-a]azocin-3-yl]carbonyl}amino)(phenyl)methyl]-1H-1,2,3-triazol-1-yl}butyl)phenyl]butyl}-1H-1,2,3-triazol-4-yl)(phenyl)methyl]-5-oxodecahydropyrrolo[1,2-a]azocine-3-carboxamide (3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-N-[(S)-(1-{4-[4-(4-{4-[(S)-({[(3S,6S,10aS)-6-{[(2S)-2-(methylamino)propanoyl]amino}-5-oxodecahydropyrrolo[1,2-a]azocin-3-yl]carbonyl}amino)(phenyl)methyl]-1H-1,2,3-triazol-1-yl}butyl)phenyl]butyl}-1H-1,2,3-triazol-4-yl)(phenyl)methyl]-5-oxodecahydropyrrolo[1,2-a]azocine-3-carboxamide|SM 164|SM164 http://purl.obolibrary.org/obo/CHEBI_192710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192714 biolink:ChemicalEntity an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue metacyc.compound:High-Mannose-N-Glycans Graph an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue http://purl.obolibrary.org/obo/CHEBI_192714 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19274 biolink:ChemicalEntity 2'-deoxymugineic acid beilstein:5301911|beilstein:5301912|cas:74235-24-8|kegg.compound:C15485 Graph (2S)-1-[(3S)-3-carboxy-3-{[(3S)-3-carboxy-3-hydroxypropyl]amino}propyl]azetidine-2-carboxylic acid (2S)-1-[(3S)-3-carboxy-3-{[(3S)-3-carboxy-3-hydroxypropyl]amino}propyl]azetidine-2-carboxylic acid (2S)-1-[(3S)-3-carboxy-3-{[(3S)-3-carboxy-3-hydroxypropyl]amino}propyl]azetidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_19274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192749 biolink:ChemicalEntity diosmetin-7-olate A flavonoid oxoanion obtained by deprotonation of the 7-hydroxy group of diosmetin; major microspecies at pH 7.3. Graph 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-olate|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-olate|diosmetin 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-olate 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-olate|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-olate|diosmetin http://purl.obolibrary.org/obo/CHEBI_192749 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192768 biolink:ChemicalEntity rhamnacene-3-olate A flavonol oxoanion that is the conjugate base of rhamnacene resulting from the deprotonation of the 3-hydroxy group; Major species at pH.7.3. Graph 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-3-olate|5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-olate|rhamnacene 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-olate 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-3-olate|5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-olate|rhamnacene http://purl.obolibrary.org/obo/CHEBI_192768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192773 biolink:ChemicalEntity 3-oxociprofloxacin metabolite of ciprofloxacin cas:103237-52-1|pubmed:2549606|pubmed:3790196 Graph http://purl.obolibrary.org/obo/CHEBI_192773 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192797 biolink:ChemicalEntity carcininium A primary ammonium ion obtained by protonation of the primary amino group of carcinine; major species at pH 7.3. pubmed:25229196 Graph 3-{[2-(1H-imidazol-4-yl)ethyl]amino}-3-oxopropan-1-aminium|carcinine|carcinine cation|carcinine(1+) 3-{[2-(1H-imidazol-4-yl)ethyl]amino}-3-oxopropan-1-aminium 3-{[2-(1H-imidazol-4-yl)ethyl]amino}-3-oxopropan-1-aminium|carcinine|carcinine cation|carcinine(1+) http://purl.obolibrary.org/obo/CHEBI_192797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192798 biolink:ChemicalEntity sulfociprofloxacin An organosulfonic acid that is ciprofloxacin carrying a sulfo group at position 4 of the piperazine ring. It is a metabolite of ciprofloxacin. cas:105093-21-8|hmdb:HMDB0242136|pubmed:1937996|pubmed:2612228|pubmed:2731404|pubmed:3292209|pubmed:34624141|pubmed:3758059|pubmed:3790196 Graph 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(4-sulfopiperazino)-3-quinolinecarboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-(4-sulfopiperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|BAY-s-9435|Bay s 9435|Bay-s 9435|ciprofloxacin piperazinyl-N(4)-sulfate|sulfo-ciprofloxacin 1-cyclopropyl-6-fluoro-4-oxo-7-(4-sulfopiperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(4-sulfopiperazino)-3-quinolinecarboxylic acid|1-cyclopropyl-6-fluoro-4-oxo-7-(4-sulfopiperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid|BAY-s-9435|Bay s 9435|Bay-s 9435|ciprofloxacin piperazinyl-N(4)-sulfate|sulfo-ciprofloxacin http://purl.obolibrary.org/obo/CHEBI_192798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192799 biolink:ChemicalEntity beta-alanyl-dopaminium(1+) Conjugate acid of β-alanyl-dopamine; major microspecies at pH 7.3. pubmed:12900414 Graph beta-alanyl-dopamine beta-alanyl-dopamine http://purl.obolibrary.org/obo/CHEBI_192799 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19281 biolink:ChemicalEntity 2,2'-bithiophenes A ring assembly that consists of two thiophene rings connected by a single covalent bond. Graph http://purl.obolibrary.org/obo/CHEBI_19281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192815 biolink:ChemicalEntity (2S)-carthamidin-7-methyl ether metacyc.compound:CPD-15634|pubmed:23184958 Graph (2S)-7-methylcarthamidin (2S)-7-methylcarthamidin http://purl.obolibrary.org/obo/CHEBI_192815 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192830 biolink:ChemicalEntity (Z)-omega-(methylsulfanyl)alkyl desulfoglucosinolate A ω-(methylsulfanyl)alkyl desulfoglucosinolate in which the double bond adopts a Z-configuration. Graph (Z)-omega-(methylsulfanyl)alkyl desulfoglucosinolate|alpha-(methylsulfanyl)-omega-[(3Z)-3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl alpha-(methylsulfanyl)-omega-[(3Z)-3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl (Z)-omega-(methylsulfanyl)alkyl desulfoglucosinolate|alpha-(methylsulfanyl)-omega-[(3Z)-3-(hydroxyimino)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]sulfanyl}propyl]polymethanediyl http://purl.obolibrary.org/obo/CHEBI_192830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:192831 biolink:ChemicalEntity (E,E)-piperate pubmed:33435446 Graph (E,E)-piperate (E,E)-piperate http://purl.obolibrary.org/obo/CHEBI_192831 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192842 biolink:ChemicalEntity Methoxyamine cas:67-62-9|chemspider:3970 Graph O-methylhydroxylamine O-methylhydroxylamine O-methylhydroxylamine http://purl.obolibrary.org/obo/CHEBI_192842 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192955 biolink:ChemicalEntity Fluphenazine Sulfoxide cas:1674-76-6|chemspider:2300812 Graph 2-[4-[3-[5-oxo-2-(triluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanol 2-[4-[3-[5-oxo-2-(triluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanol 2-[4-[3-[5-oxo-2-(triluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanol http://purl.obolibrary.org/obo/CHEBI_192955 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:192979 biolink:ChemicalEntity nystatin A2 cas:65086-32-0|pubmed:15504830 Graph (1R,3S,7R,9R,11R,15S,16R,17R,18S,19E,21E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,7,9,11,17,37-heptahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid|nystatin A2 (1R,3S,7R,9R,11R,15S,16R,17R,18S,19E,21E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,7,9,11,17,37-heptahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid (1R,3S,7R,9R,11R,15S,16R,17R,18S,19E,21E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,7,9,11,17,37-heptahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,25,27,29,31-hexaene-36-carboxylic acid|nystatin A2 http://purl.obolibrary.org/obo/CHEBI_192979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:193017 biolink:ChemicalEntity 6-Methoxyflavone cas:26964-24-9|chemspider:129764|kegg.drug:D81756|lipidmaps:LMPK12110100 Graph 6-methoxy-2-phenylchromen-4-one 6-methoxy-2-phenylchromen-4-one 6-methoxy-2-phenylchromen-4-one http://purl.obolibrary.org/obo/CHEBI_193017 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193059 biolink:ChemicalEntity psilocinium Conjugate acid of psilocin; major microspecies at pH 7.3. metacyc.compound:CPD-20617|pubmed:35583969 Graph psilocin psilocin http://purl.obolibrary.org/obo/CHEBI_193059 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193068 biolink:ChemicalEntity an L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) metacyc.compound:CPD-24513 Graph an L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A an L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A http://purl.obolibrary.org/obo/CHEBI_193068 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193069 biolink:ChemicalEntity an L-alpha-D-Hep-(1->3)-L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) metacyc.compound:CPD-24514 Graph an L-alpha-D-Hep-(1->3)-L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A an L-alpha-D-Hep-(1->3)-L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A http://purl.obolibrary.org/obo/CHEBI_193069 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193072 biolink:ChemicalEntity (-)-beta-barbatene metacyc.compound:CPD-20169|pubmed:31621716 Graph (-)-beta-barbatene (-)-beta-barbatene http://purl.obolibrary.org/obo/CHEBI_193072 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193089 biolink:ChemicalEntity phenyl phosphate(2-) metacyc.compound:PHENOL-PHOSPHATE Graph phenyl phosphate phenyl phosphate http://purl.obolibrary.org/obo/CHEBI_193089 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193091 biolink:ChemicalEntity menaquinol-4 A menaquinol whose structure comprises a 2-methylbenzohydroquinone nucleus and a side chain of four isoprenoid units. metacyc.compound:CPD-21305 Graph menaquinol-4 menaquinol-4 http://purl.obolibrary.org/obo/CHEBI_193091 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193092 biolink:ChemicalEntity O-phospho-3-sulfolactate(4-) A quadruply-charged carboxyalkyl phosphate oxoanion resulting from global deprotonation of O-phospho-3-sulfolactic acid; major microspecies at pH 7.3. metacyc.compound:CPD-11803|pubmed:36037354 Graph O-phospho-3-sulfolactate O-phospho-3-sulfolactate http://purl.obolibrary.org/obo/CHEBI_193092 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193101 biolink:ChemicalEntity petunidin(1-) pubmed:35651780 Graph petunidin petunidin http://purl.obolibrary.org/obo/CHEBI_193101 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193107 biolink:ChemicalEntity N(6),N(6)-dimethyl-L-lysinium pubmed:31885262 Graph N(6),N(6)-dimethyl-L-lysine N(6),N(6)-dimethyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_193107 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193111 biolink:ChemicalEntity methylcarbamate The conjugate base of methylcarbamic acid; major microspecies at pH 7.3. metacyc.compound:CPD-22706 Graph N-methyl carbamate|N-methylcarbamate|methylcarbamate methylcarbamate N-methyl carbamate|N-methylcarbamate|methylcarbamate http://purl.obolibrary.org/obo/CHEBI_193111 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193124 biolink:ChemicalEntity N,N-dimethyltryptaminium Graph N,N-dimethyltryptamine N,N-dimethyltryptamine http://purl.obolibrary.org/obo/CHEBI_193124 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193141 biolink:ChemicalEntity a lipid A(4-) pubmed:11013210 Graph a lipid A a lipid A http://purl.obolibrary.org/obo/CHEBI_193141 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193149 biolink:ChemicalEntity an acyl-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(6-) pubmed:10092655|pubmed:11830594 Graph an acyl-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA an acyl-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA http://purl.obolibrary.org/obo/CHEBI_193149 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193151 biolink:ChemicalEntity D-isoleucine zwitterion An α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of D-isoleucine; major species at pH 7.3. pubmed:23426681 Graph D-isoleucine D-isoleucine http://purl.obolibrary.org/obo/CHEBI_193151 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19324 biolink:ChemicalEntity 2,3-bisphosphoglycerate Graph 2,3-bis(phosphonatooxy)propanoate|2,3-diphosphoglycerate 2,3-bis(phosphonatooxy)propanoate 2,3-bis(phosphonatooxy)propanoate|2,3-diphosphoglycerate http://purl.obolibrary.org/obo/CHEBI_19324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19331 biolink:ChemicalEntity (2,4,5-trichlorophenoxy)acetate A chlorophenoxyacetate anion obtained by deprotonation of the carboxy group of (2,4,5-trichlorophenoxy)acetic acid. gmelin:434053|metacyc.compound:CPD-10896|umbbd.compound:c0361 Graph (2,4,5-trichlorophenoxy)acetate|2,4,5-trichlorophenoxyacetate (2,4,5-trichlorophenoxy)acetate (2,4,5-trichlorophenoxy)acetate|2,4,5-trichlorophenoxyacetate http://purl.obolibrary.org/obo/CHEBI_19331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19333 biolink:ChemicalEntity 2,4,6-trichloroanisole A monomethoxybenzene that is 1,3,5-trichlorobenzene in which one of the hydrogens is replaced by a methoxy group. cas:87-40-1|kegg.compound:C11510 Graph 1,3,5-Trichloro-2-methoxybenzene|1,3,5-trichloro-2-methoxybenzene|2,4,6-trichloroanisole|Methyl 2,4,6-trichlorophenyl ether|Tyrene 1,3,5-trichloro-2-methoxybenzene 1,3,5-Trichloro-2-methoxybenzene|1,3,5-trichloro-2-methoxybenzene|2,4,6-trichloroanisole|Methyl 2,4,6-trichlorophenyl ether|Tyrene http://purl.obolibrary.org/obo/CHEBI_19333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:193350 biolink:ChemicalEntity ferulic acid A member of the class of ferulic acids that is cinnamic acid substituted by a methoxy and a hydroxy group at positions 3 and 4 of the phenyl ring. cas:1135-24-6|pubmed:37615264|pubmed:37752317|pubmed:38604452|pubmed:38887323|pubmed:39280296 Graph 3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid|3-(4-hydroxy-3-methoxyphenyl)acrylic acid|3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid|3-methoxy-4-hydroxycinnamic acid|4'-hydroxy-3'-methoxycinnamic acid|4-hydroxy-3-methoxycinnamic acid|coniferic acid|ferulaic acid 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid 3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid|3-(4-hydroxy-3-methoxyphenyl)acrylic acid|3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid|3-methoxy-4-hydroxycinnamic acid|4'-hydroxy-3'-methoxycinnamic acid|4-hydroxy-3-methoxycinnamic acid|coniferic acid|ferulaic acid http://purl.obolibrary.org/obo/CHEBI_193350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19351 biolink:ChemicalEntity (2,4-dichlorophenoxy)acetate A chlorophenoxyacetate anion that is the conjugate base of (2,4-dichlorophenoxy)acetic acid, obtained by deprotonation of the carboxy group. beilstein:3614847|gmelin:330841|metacyc.compound:CPD-9009|umbbd.compound:c0288 Graph (2,4-dichlorophenoxy)acetate|2,4-D|2,4-dichlorophenoxyacetate (2,4-dichlorophenoxy)acetate (2,4-dichlorophenoxy)acetate|2,4-D|2,4-dichlorophenoxyacetate http://purl.obolibrary.org/obo/CHEBI_19351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:193570 biolink:ChemicalEntity 5(R)-HPETE(1-) pubmed:23242647 Graph (5R)-hydroperoxy-(6E,8Z,11Z,14Z)-eicosatetraenoate|5(R)-HPETE anion (5R)-hydroperoxy-(6E,8Z,11Z,14Z)-eicosatetraenoate|5(R)-HPETE anion http://purl.obolibrary.org/obo/CHEBI_193570 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193571 biolink:ChemicalEntity epi-leukotriene A4(1-) pubmed:23242647 Graph (7E,9E,11Z,14Z)-(5R,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate(1-)|epi-LTA4 anion|epi-leukotriene A4 (7E,9E,11Z,14Z)-(5R,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate(1-)|epi-LTA4 anion|epi-leukotriene A4 http://purl.obolibrary.org/obo/CHEBI_193571 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193572 biolink:ChemicalEntity protectin Docosanoids characterized by the presence of a conjugated system of double bonds. pubmed:24172820 Graph http://purl.obolibrary.org/obo/CHEBI_193572 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193574 biolink:ChemicalEntity eoxin Oxylipins that derive from eicosanoids. pubmed:19130894 Graph http://purl.obolibrary.org/obo/CHEBI_193574 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:193594 biolink:ChemicalEntity 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid A plasmalogen that has no fatty acyl chain at sn-2 and where the glycerolipid is not defined, R3 can be H or a phospholipid. pubmed:10085103 Graph a 1-(1Z-alkenyl)-sn-glycerolipid|lysoplasmalogen a 1-(1Z-alkenyl)-sn-glycerolipid|lysoplasmalogen http://purl.obolibrary.org/obo/CHEBI_193594 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19391 biolink:ChemicalEntity 2,6-dibromophenol A dibromophenol that is phenol in which both of the hydrogens that are ortho to the phenolic hydroxy group have been replaced by bromines. beilstein:2043614|cas:608-33-3|gmelin:1006446|kegg.compound:C16247|umbbd.compound:c0533 Graph 2,6-dibromophenol 2,6-dibromophenol 2,6-dibromophenol http://purl.obolibrary.org/obo/CHEBI_19391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194019 biolink:ChemicalEntity fumagillin(1-) metacyc.compound:CPD0-1436 Graph fumagillin fumagillin http://purl.obolibrary.org/obo/CHEBI_194019 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194063 biolink:ChemicalEntity 3,3'-O-dimethylquercetin pubmed:21343428 Graph 3,3'-O-dimethylquercetin 3,3'-O-dimethylquercetin http://purl.obolibrary.org/obo/CHEBI_194063 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194065 biolink:ChemicalEntity 7-O-methylmyricetin 5-olate pubmed:21343428 Graph 7-O-methylmyricetin 7-O-methylmyricetin http://purl.obolibrary.org/obo/CHEBI_194065 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194067 biolink:ChemicalEntity 7,4'-O-dimethylkaempferol 3-olate pubmed:21343428 Graph 7,4'-O-dimethylkaempferol 7,4'-O-dimethylkaempferol http://purl.obolibrary.org/obo/CHEBI_194067 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194068 biolink:ChemicalEntity 7,4'-O-dimethylquercetin 3-olate pubmed:21343428 Graph 7,4'-O-dimethylquercetin|ombuin 3-olate 7,4'-O-dimethylquercetin|ombuin 3-olate http://purl.obolibrary.org/obo/CHEBI_194068 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194069 biolink:ChemicalEntity 7,3',5'-O-trimethylmyricetin 3-olate pubmed:21343428 Graph 7,3',5'-O-trimethylmyricetin 7,3',5'-O-trimethylmyricetin http://purl.obolibrary.org/obo/CHEBI_194069 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194070 biolink:ChemicalEntity 3',4',5'-O-trimethylmyricetin 3,7-diolate pubmed:21343428 Graph 3',4',5'-O-trimethylmyricetin 3',4',5'-O-trimethylmyricetin http://purl.obolibrary.org/obo/CHEBI_194070 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194071 biolink:ChemicalEntity 7,3',4',5'-O-tetramethylmyricetin 3-olate pubmed:21343428 Graph 7,3',4',5'-O-tetramethylmyricetin 7,3',4',5'-O-tetramethylmyricetin http://purl.obolibrary.org/obo/CHEBI_194071 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194073 biolink:ChemicalEntity 3-O-methylkaempferol 7-olate pubmed:22711283 Graph 3-O-methylkaempferol 3-O-methylkaempferol http://purl.obolibrary.org/obo/CHEBI_194073 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194074 biolink:ChemicalEntity 3,4'-O-dimethylkaempferol 7-olate pubmed:22711283 Graph 3,4'-O-dimethylkaempferol 3,4'-O-dimethylkaempferol http://purl.obolibrary.org/obo/CHEBI_194074 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194075 biolink:ChemicalEntity 3,3',5'-O-trimethylmyricetin 7-olate pubmed:22711283 Graph 3,3',5'-O-trimethylmyricetin 3,3',5'-O-trimethylmyricetin http://purl.obolibrary.org/obo/CHEBI_194075 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194076 biolink:ChemicalEntity 3,3',4',5'-O-tetramethylmyricetin 7-olate pubmed:22711283 Graph 3,3',4',5'-O-tetramethylmyricetin 3,3',4',5'-O-tetramethylmyricetin http://purl.obolibrary.org/obo/CHEBI_194076 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194095 biolink:ChemicalEntity mitomycin C(1-) pubmed:17461583 Graph mitomycin C mitomycin C http://purl.obolibrary.org/obo/CHEBI_194095 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1941 biolink:ChemicalEntity 4-(trimethylammonio)butanoic acid A quaternary ammonium ion that is the conjugate acid of 4-(trimethylammonio)butanoate. hmdb:HMDB0001161|kegg.compound:C01181|pdb-ccd:NM2|reaxys:1765273 Graph 3-carboxy-N,N,N-trimethylpropan-1-aminium|4-Trimethylammoniobutanoate|Butyrobetaine|gamma-Butyrobetaine|gamma-butyrobetaine 3-carboxy-N,N,N-trimethylpropan-1-aminium 3-carboxy-N,N,N-trimethylpropan-1-aminium|4-Trimethylammoniobutanoate|Butyrobetaine|gamma-Butyrobetaine|gamma-butyrobetaine http://purl.obolibrary.org/obo/CHEBI_1941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194135 biolink:ChemicalEntity 9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid An oxazinoquinoline that is 2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinolin-7-one substituted by methyl, carboxy, fluoro, and 4-methylpiperazin-1-yl groups at positions 3, 6, 9, and 10, respectively. Graph 9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid 9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid 9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_194135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194137 biolink:ChemicalEntity neurokinin-1 receptor agonist An agonist at the neurokinin-1 receptor. Graph NK-1 receptor agonist|NK-1 receptor agonists|NK1 receptor agonist|NK1 receptor agonists|neurokinin-1 receptor agonists NK-1 receptor agonist|NK-1 receptor agonists|NK1 receptor agonist|NK1 receptor agonists|neurokinin-1 receptor agonists http://purl.obolibrary.org/obo/CHEBI_194137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194147 biolink:ChemicalEntity aristolochic acids Organic heterotetracyclic compounds which are a group of nitro phenanthrene organic acids, naturally found in many kinds of plants, such as Aristolochia and Asarum, and widely cultivated in Asia.They are identified as a class 1 human carcinogen by the International Agency for Research on Cancer owing to their carcinogenicity and nephrotoxicity and can pose a significant hazard to food safety and human health. pubmed:36347294|wikipedia.en:Aristolochic_acid Graph http://purl.obolibrary.org/obo/CHEBI_194147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194156 biolink:ChemicalEntity adenosine 2',5'-bisphosphate(4-) metacyc.compound:CPD0-1187 Graph adenosine 2',5'-bisphosphate adenosine 2',5'-bisphosphate http://purl.obolibrary.org/obo/CHEBI_194156 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19418 biolink:ChemicalEntity 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2-) A dicarboxylic acid dianion obtained by removal of a proton from both of the carboxylic acid groups of 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid. Graph 2-(acetamidomethylene)-3-(hydroxymethyl)butanedioate|2-(acetamidomethylene)-3-(hydroxymethyl)succinate|2-(hydroxymethyl)-3-(acetamidomethylene)succinate 2-(acetamidomethylene)-3-(hydroxymethyl)butanedioate 2-(acetamidomethylene)-3-(hydroxymethyl)butanedioate|2-(acetamidomethylene)-3-(hydroxymethyl)succinate|2-(hydroxymethyl)-3-(acetamidomethylene)succinate http://purl.obolibrary.org/obo/CHEBI_19418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194216 biolink:ChemicalEntity mangiferin(1-) pubmed:34583991 Graph mangiferin mangiferin http://purl.obolibrary.org/obo/CHEBI_194216 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194240 biolink:ChemicalEntity omega-methyl-medium-chain fatty acid anion A medium-chain fatty acid anion obtained by deprotonation of the carboxy group of any ω-methyl fatty acid; major species at pH 7.3. pubmed:17213671 Graph an omega-methyl-medium-chain fatty acid|omega-methyl-medium-chain fatty acid(1-) an omega-methyl-medium-chain fatty acid|omega-methyl-medium-chain fatty acid(1-) http://purl.obolibrary.org/obo/CHEBI_194240 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194241 biolink:ChemicalEntity omega-hydroxy-medium-chain fatty acid anion An ω-hydroxy fatty acid anion obtained by deprotonation of the carboxy group of any ω-hydroxy-medium-chain fatty acid; major species at pH 7.3. pubmed:17213671 Graph an omega-hydroxy-medium-chain fatty acid|omega-hydroxy medium-chain fatty acid anion|omega-hydroxy medium-chain fatty acid anions|omega-hydroxy-medium-chain fatty acid anions|omega-hydroxy-medium-chain fatty acid(1-) an omega-hydroxy-medium-chain fatty acid|omega-hydroxy medium-chain fatty acid anion|omega-hydroxy medium-chain fatty acid anions|omega-hydroxy-medium-chain fatty acid anions|omega-hydroxy-medium-chain fatty acid(1-) http://purl.obolibrary.org/obo/CHEBI_194241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194303 biolink:ChemicalEntity omega-hydroxy-medium-chain fatty acid A ω-hydroxy-fatty acid with a chain length ranging from C6 to C12. Graph medium-chain omega-hydroxy-fatty acid|medium-chain omega-hydroxy-fatty acids|omega-hydroxy medium-chain fatty acid|omega-hydroxy medium-chain fatty acids|omega-hydroxy-medium-chain fatty acids medium-chain omega-hydroxy-fatty acid|medium-chain omega-hydroxy-fatty acids|omega-hydroxy medium-chain fatty acid|omega-hydroxy medium-chain fatty acids|omega-hydroxy-medium-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_194303 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194304 biolink:ChemicalEntity omega-hydroxy-very-long-chain fatty acid A ω-hydroxy-fatty acid with a chain length ranging from C23 to C26. Graph omega-hydroxy very-long-chain fatty acid|omega-hydroxy very-long-chain fatty acids|omega-hydroxy-very-long-chain fatty acids|very-long-chain omega-hydroxy-fatty acid|very-long-chain omega-hydroxy-fatty acids omega-hydroxy very-long-chain fatty acid|omega-hydroxy very-long-chain fatty acids|omega-hydroxy-very-long-chain fatty acids|very-long-chain omega-hydroxy-fatty acid|very-long-chain omega-hydroxy-fatty acids http://purl.obolibrary.org/obo/CHEBI_194304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194306 biolink:ChemicalEntity omega-hydroxy-short-chain fatty acid A ω-hydroxy-fatty acid with a chain length of less than C6. Graph omega-hydroxy short-chain fatty acid|omega-hydroxy short-chain fatty acids|omega-hydroxy-short-chain fatty acids|short-chain omega-hydroxy-fatty acid|short-chain omega-hydroxy-fatty acids omega-hydroxy short-chain fatty acid|omega-hydroxy short-chain fatty acids|omega-hydroxy-short-chain fatty acids|short-chain omega-hydroxy-fatty acid|short-chain omega-hydroxy-fatty acids http://purl.obolibrary.org/obo/CHEBI_194306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194314 biolink:ChemicalEntity N-formyl-L-methionyl-L-leucyl-L-phenylalaninate A peptide anion obtained by deprotonation of the carboxy group of N-formyl-L-methionyl-L-leucyl-L-phenylalanine; major species at pH 7.3. pubmed:11375948|pubmed:9835627 Graph F-Met-Leu-Phe anion|N(alpha)-formyl-L-methionyl-L-leucyl-L-phenylalanine|N-formyl-L-Met-L-Leu-L-Phe(1-)|N-formyl-L-methionyl-L-leucyl-L-phenylalanine(1-)|N-formyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-leucinamide|N-formyl-Met-Leu-Phe(1-)|fMLF(1-)|fMLP(1-) N-formyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-leucinamide F-Met-Leu-Phe anion|N(alpha)-formyl-L-methionyl-L-leucyl-L-phenylalanine|N-formyl-L-Met-L-Leu-L-Phe(1-)|N-formyl-L-methionyl-L-leucyl-L-phenylalanine(1-)|N-formyl-L-methionyl-N-[(1S)-1-carboxylato-2-phenylethyl]-L-leucinamide|N-formyl-Met-Leu-Phe(1-)|fMLF(1-)|fMLP(1-) http://purl.obolibrary.org/obo/CHEBI_194314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19432 biolink:ChemicalEntity 2-acetamidofluorenes An ortho-fused polycyclic arene, or derivative thereof, that consists of 9H-fluorene bearing an acetamido substituent at position 2. Graph http://purl.obolibrary.org/obo/CHEBI_19432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194321 biolink:ChemicalEntity hydroperoxy unsaturated fatty acid Any unsaturated fatty acid carrying one or more hydroperoxy substituents. Graph hydroperoxy unsaturated fatty acids hydroperoxy unsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_194321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194338 biolink:ChemicalEntity T-type calcium channel blocker Any agent that interferes with the activity of T-type calcium channels. pubmed:30372652|pubmed:36738196|wikipedia.en:T-type_calcium_channel Graph T-type calcium channel antagonist|T-type calcium channel antagonists|T-type calcium channel blockers T-type calcium channel antagonist|T-type calcium channel antagonists|T-type calcium channel blockers http://purl.obolibrary.org/obo/CHEBI_194338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194371 biolink:ChemicalEntity queuosine 5'-phosphate(2-) pubmed:36610787 Graph queuosine 5'-phosphate queuosine 5'-phosphate http://purl.obolibrary.org/obo/CHEBI_194371 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194387 biolink:ChemicalEntity Eglumetad chemspider:184747|kegg.drug:D08908 Graph (1S,2S,5R,6S)-2-aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid (1S,2S,5R,6S)-2-aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid (1S,2S,5R,6S)-2-aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_194387 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194423 biolink:ChemicalEntity aquaretic A class of diuretics which promote aquaresis (the excretion of water without electrolyte loss). pubmed:12107918|pubmed:17430186|pubmed:21088744|pubmed:24853354|pubmed:28194573|pubmed:28652798|pubmed:29259382|pubmed:36156485|pubmed:8738740|pubmed:8998673|wikipedia.en:Aquaretic Graph aquaretic agent|aquaretic agents|aquaretics aquaretic agent|aquaretic agents|aquaretics http://purl.obolibrary.org/obo/CHEBI_194423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194428 biolink:ChemicalEntity (S)-mevalonolactone A 4-hydroxy-4-methyloxan-2-one that has (S)-configuration. cas:19022-60-7 Graph (+)-(S)-mevalonic acid lactone|(+)-(S)-mevalonolactone|(+)-mevalolactone|(+)-mevalonolactone|(4S)-4-hydroxy-4-methyloxan-2-one|(4S)-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|(4S)-tetrahydro-4-hydroxy-4-methyl-2H-pyran-2-one|(S)-(+)-mevalolactone|L-mevalonolactone|S-mevalonolactone (4S)-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one (+)-(S)-mevalonic acid lactone|(+)-(S)-mevalonolactone|(+)-mevalolactone|(+)-mevalonolactone|(4S)-4-hydroxy-4-methyloxan-2-one|(4S)-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|(4S)-tetrahydro-4-hydroxy-4-methyl-2H-pyran-2-one|(S)-(+)-mevalolactone|L-mevalonolactone|S-mevalonolactone http://purl.obolibrary.org/obo/CHEBI_194428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194429 biolink:ChemicalEntity mevalonolactone A racemate comprising equimolar amounts of (R)-mevalonolactone and (S)-mevalonolactone. cas:674-26-0|hmdb:HMDB0006024|knapsack:C00062661|lincs.smallmolecule:LSM-6380|pubmed:11522061|pubmed:12481687|pubmed:36745799|pubmed:9208099 Graph (+-)-mevalolactone|(+-)-mevalonolactone|(4RS)-4-hydroxy-4-methyloxan-2-one|(4RS)-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|(RS)-mevalonolactone|DL-mevalonic acid delta-lactone|DL-mevalonic acid lactone|DL-mevalonolactone|R,S-mevalonolactone|RS-mevalonolactone|mevalolactone|mevalonic acid delta-lactone|mevalonic acid lactone|mevalonic lactone|rac-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|rac-mevalonolactone|racemic mevalonolactone rac-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one (+-)-mevalolactone|(+-)-mevalonolactone|(4RS)-4-hydroxy-4-methyloxan-2-one|(4RS)-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|(RS)-mevalonolactone|DL-mevalonic acid delta-lactone|DL-mevalonic acid lactone|DL-mevalonolactone|R,S-mevalonolactone|RS-mevalonolactone|mevalolactone|mevalonic acid delta-lactone|mevalonic acid lactone|mevalonic lactone|rac-4-hydroxy-4-methyltetrahydro-2H-pyran-2-one|rac-mevalonolactone|racemic mevalonolactone http://purl.obolibrary.org/obo/CHEBI_194429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194430 biolink:ChemicalEntity antimyopathic agent A drug used to treat myopathy. wikipedia.en:Myopathy Graph antimyopathic agents|antimyopathic drug|antimyopathic drugs antimyopathic agents|antimyopathic drug|antimyopathic drugs http://purl.obolibrary.org/obo/CHEBI_194430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194431 biolink:ChemicalEntity queuosine 5'-phosphate(1-) residue A negatively charged group obtained by removal of a proton from the phosphate group of queuosine 5'-phosphate residue. Major species at pH 7.3. Graph queuosine 5'-phosphate residue queuosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_194431 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194442 biolink:ChemicalEntity alpha-D-mannosyl-4''-O-queuosine 5'-phosphate(1-) residue Graph alpha-D-mannosyl-4''-O-queuosine 5'-phosphate residue alpha-D-mannosyl-4''-O-queuosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_194442 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194443 biolink:ChemicalEntity epoxyqueuosine 5'-phosphate(1-) residue Graph epoxyqueuosine 5'-phosphate residue epoxyqueuosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_194443 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194466 biolink:ChemicalEntity L-Lysine zwitterion Primary zwitterion of L-Lysine present at the isoelectric point Graph http://purl.obolibrary.org/obo/CHEBI_194466 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194467 biolink:ChemicalEntity NOD1 agonist An agonist that activates NOD1 receptors. wikipedia.en:NOD1 Graph CARD4 agonist|CARD4 agonists|CLR7.1 agonist|CLR7.1 agonists|NOD1 agonists|caspase recruitment domain-containing protein 4 agonist|caspase recruitment domain-containing protein 4 agonists|nucleotide binding oligomerization domain containing 1 agonist|nucleotide binding oligomerization domain containing 1 agonists|nucleotide-binding oligomerization domain-containing protein 1 agonist|nucleotide-binding oligomerization domain-containing protein 1 agonists CARD4 agonist|CARD4 agonists|CLR7.1 agonist|CLR7.1 agonists|NOD1 agonists|caspase recruitment domain-containing protein 4 agonist|caspase recruitment domain-containing protein 4 agonists|nucleotide binding oligomerization domain containing 1 agonist|nucleotide binding oligomerization domain containing 1 agonists|nucleotide-binding oligomerization domain-containing protein 1 agonist|nucleotide-binding oligomerization domain-containing protein 1 agonists http://purl.obolibrary.org/obo/CHEBI_194467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194473 biolink:ChemicalEntity 4-carboxyanilinium A primary ammonium ion that is the conjugate acid of 4-aminobenzoic acid resulting from the protonation of the amino group. Graph (4-carboxyphenyl)azanium|4-amniobenzoic acid cation|4-amniobenzoic acid(1+)|4-carboxyanilinium 4-carboxyanilinium (4-carboxyphenyl)azanium|4-amniobenzoic acid cation|4-amniobenzoic acid(1+)|4-carboxyanilinium http://purl.obolibrary.org/obo/CHEBI_194473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194474 biolink:ChemicalEntity 4-ammoniobenzoate A zwitterion obtained by transfer of a proton from the carboxy to the amino group of 4-aminobenzoic acid. Graph 4-aminobenzoic acid zwitterion|4-azaniumylbenzoate 4-azaniumylbenzoate 4-aminobenzoic acid zwitterion|4-azaniumylbenzoate http://purl.obolibrary.org/obo/CHEBI_194474 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19448 biolink:ChemicalEntity 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid An oxo dicarboxylic acid that is but-2-enedioic acid substituted by an amino group at position 2 and a 3-oxoprop-1-enyl group at position 3. beilstein:1950054|hmdb:HMDB0001330 Graph 2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioic acid 2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioic acid 2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioic acid http://purl.obolibrary.org/obo/CHEBI_19448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194491 biolink:ChemicalEntity N-acetyl-beta-D-muramoyl-L-alanyl-D-isoglutamine(1-) Conjugate base of muramyl dipeptide. Major species at pH 7.3. pubmed:36002575 Graph N-acetyl-beta-D-muramoyl-L-alanyl-D-isoglutamine|muramyl dipeptide(1-) N-acetyl-beta-D-muramoyl-L-alanyl-D-isoglutamine|muramyl dipeptide(1-) http://purl.obolibrary.org/obo/CHEBI_194491 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194492 biolink:ChemicalEntity 6-O-phospho-N-acetylmuramoyl-L-alanyl-D-isoglutamine(3-) pubmed:36002575 Graph 6-O-phospho-MDP|6-O-phospho-N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine|6-O-phospho-muramyl dipeptide 6-O-phospho-MDP|6-O-phospho-N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine|6-O-phospho-muramyl dipeptide http://purl.obolibrary.org/obo/CHEBI_194492 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194495 biolink:ChemicalEntity 3-aminopropanesulfonic acid zwitterion Zwitterionic form of 3-aminopropanesulfonic acid arising from transfer of a proton from the sulfo to the amino group; major species at pH 7.3. metacyc.compound:CPD-11725|pubmed:36543883|pubmed:6319409 Graph 3-aminopropane sulfonate|3-ammoniopropane-1-sulfonate|3-azaniumylpropane-1-sulfonate 3-azaniumylpropane-1-sulfonate 3-aminopropane sulfonate|3-ammoniopropane-1-sulfonate|3-azaniumylpropane-1-sulfonate http://purl.obolibrary.org/obo/CHEBI_194495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194499 biolink:ChemicalEntity oripavine(1+) The trialkylammonium ion resulting from the protonation of the amino group of oripavine; Major species at pH 7.3. metacyc.compound:CPD-7713|pubmed:23928311 Graph 3-O-demethylthebaine cation|3-O-demethylthebaine(1+)|3-hydroxy-6-methoxy-17-methyl-5alpha-6,7,8,14-tetradehydro-4,5-epoxymorphinan-17-ium|oripavine|oripavine cation 3-hydroxy-6-methoxy-17-methyl-5alpha-6,7,8,14-tetradehydro-4,5-epoxymorphinan-17-ium 3-O-demethylthebaine cation|3-O-demethylthebaine(1+)|3-hydroxy-6-methoxy-17-methyl-5alpha-6,7,8,14-tetradehydro-4,5-epoxymorphinan-17-ium|oripavine|oripavine cation http://purl.obolibrary.org/obo/CHEBI_194499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194507 biolink:ChemicalEntity argipressin(2+) A peptide cation that is the conjugate acid of argipressin, arising from the protonation of the N-terminal amino group and the guanidino group; major species at pH 7.3. pubmed:16971491 Graph 8-L-arginine vasopressin(2+)|argipressin 8-L-arginine vasopressin(2+)|argipressin http://purl.obolibrary.org/obo/CHEBI_194507 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194508 biolink:ChemicalEntity (11R)-carlactone pubmed:34586497 Graph (11R)-carlactone (11R)-carlactone http://purl.obolibrary.org/obo/CHEBI_194508 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194518 biolink:ChemicalEntity reticuline(1+) Graph reticuline reticuline http://purl.obolibrary.org/obo/CHEBI_194518 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194519 biolink:ChemicalEntity 3,5-dihydroxy-3-methylpentanoic acid A dihydroxy monocarboxylic acid comprising valeric acid having two hydroxy groups at the 3- and 5-positions together with a methyl group at the 3-position. pubmed:3540738 Graph 2,4-dideoxy-3-C-methylpentonic acid|3,5-dihydroxy-3-methylpentanoic acid|3,5-dihydroxy-3-methylvaleric acid|beta,delta-dihydroxy-beta-methylvaleric acid 3,5-dihydroxy-3-methylpentanoic acid 2,4-dideoxy-3-C-methylpentonic acid|3,5-dihydroxy-3-methylpentanoic acid|3,5-dihydroxy-3-methylvaleric acid|beta,delta-dihydroxy-beta-methylvaleric acid http://purl.obolibrary.org/obo/CHEBI_194519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194520 biolink:ChemicalEntity 3,5-dihydroxy-3-methylpentanoate A hydroxy monocarboxylic acid anion that is the conjugate base of 3,5-dihydroxy-3-methylpentanoic acid resulting from the deprotonation of the carboxy group; Major species at pH 7.3. Graph 2,4-dideoxy-3-C-methylpentonate|3,5-dihydroxy-3-methylpentanoate|3,5-dihydroxy-3-methylvalerate|beta,delta-dihydroxy-beta-methylvalerate 3,5-dihydroxy-3-methylpentanoate 2,4-dideoxy-3-C-methylpentonate|3,5-dihydroxy-3-methylpentanoate|3,5-dihydroxy-3-methylvalerate|beta,delta-dihydroxy-beta-methylvalerate http://purl.obolibrary.org/obo/CHEBI_194520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:194527 biolink:ChemicalEntity L-sepiapterin A sepiapterin with L configuration. Graph L-sepiapterin L-sepiapterin http://purl.obolibrary.org/obo/CHEBI_194527 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194528 biolink:ChemicalEntity an (S)-7,8,13,14-tetrahydroprotoberberine pubmed:19624470 Graph an (S)-7,8,13,14-tetrahydroprotoberberine an (S)-7,8,13,14-tetrahydroprotoberberine http://purl.obolibrary.org/obo/CHEBI_194528 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194529 biolink:ChemicalEntity an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine pubmed:19624470 Graph an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine http://purl.obolibrary.org/obo/CHEBI_194529 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:194548 biolink:ChemicalEntity 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol A catecholamine in which the aminoethyl side-chain is hydroxy-substituted at C-1 and methylated on nitrogen. Graph 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_194548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19471 biolink:ChemicalEntity 2-aminohexano-6-lactam An amino acid amide obtained by the intramolecular condensation of the terminal amino group with the carboxy group in lysine. beilstein:80945|cas:671-42-1 Graph 3-aminoazepan-2-one|3-aminohexahydro-2H-azepin-2-one 3-aminoazepan-2-one 3-aminoazepan-2-one|3-aminohexahydro-2H-azepin-2-one http://purl.obolibrary.org/obo/CHEBI_19471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19475 biolink:ChemicalEntity 2-aminopentanoic acid An α-amino acid that is valeric acid which is substituted at position 2 by an amino group. cas:760-78-1|drugbank:DB04185|reaxys:1721160|wikipedia.en:Norvaline Graph 2-Aminovaleric acid|2-aminopentanoic acids|2-aminovaleric acids|DL-Norvaline|DL-alpha-aminovaleric acid|Nva|alpha-DL-aminopentanoic acid|alpha-aminopentanoic acid|alpha-aminovaleric acid|norvaline|norvalines norvaline 2-Aminovaleric acid|2-aminopentanoic acids|2-aminovaleric acids|DL-Norvaline|DL-alpha-aminovaleric acid|Nva|alpha-DL-aminopentanoic acid|alpha-aminopentanoic acid|alpha-aminovaleric acid|norvaline|norvalines http://purl.obolibrary.org/obo/CHEBI_19475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19503 biolink:ChemicalEntity propachlor An anilide that consists of 2-chloroacetanilide bearing an N-isopropyl substituent. cas:1918-16-7|kegg.compound:C18759|pesticides:propachlor|ppdb:543|pubmed:22953837|pubmed:7272464|reaxys:2103903|umbbd.compound:c0653|wikipedia.en:Propachlor Graph 2-Chloro-N-(1-methylethyl)-N-phenylacetamide|2-chloro-N-isopropyl-N-phenylacetamide|2-chloro-N-isopropylacetanilide|Bexton 4L|Chloressigsaeure-N-isopropylanilid|Kartex A|N-isopropyl-2-chloroacetanilide|N-isopropyl-alpha-chloroacetanilide|Nitacid|Niticid|Propachlore|Ramrod 65|alpha-Chloro-N-isopropylacetanilide|alpha-chloro-N-isopropylacetanilid 2-chloro-N-isopropyl-N-phenylacetamide 2-Chloro-N-(1-methylethyl)-N-phenylacetamide|2-chloro-N-isopropyl-N-phenylacetamide|2-chloro-N-isopropylacetanilide|Bexton 4L|Chloressigsaeure-N-isopropylanilid|Kartex A|N-isopropyl-2-chloroacetanilide|N-isopropyl-alpha-chloroacetanilide|Nitacid|Niticid|Propachlore|Ramrod 65|alpha-Chloro-N-isopropylacetanilide|alpha-chloro-N-isopropylacetanilid http://purl.obolibrary.org/obo/CHEBI_19503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19511 biolink:ChemicalEntity 2-cis,6-cis-farnesyl diphosphate beilstein:11203892 Graph (2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate (2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate (2Z,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate http://purl.obolibrary.org/obo/CHEBI_19511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19515 biolink:ChemicalEntity 2-cis,6-trans-farnesyl diphosphate beilstein:7861509|kegg.compound:C16826 Graph (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate|(2Z,6E)-Farnesyl diphosphate (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate (2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate|(2Z,6E)-Farnesyl diphosphate http://purl.obolibrary.org/obo/CHEBI_19515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195187 biolink:ChemicalEntity tRNA 3'-terminal nucleotidyl-cytidyl-cytidyl-adenosyl-cytidyl-cytidyl-adenosine An organic anionic group obtained by deprotonation of the phosphate OH groups of any tRNA 3'-terminal nucleotidyl-cytidyl-cytidyl-adenosyl-cytidyl-cytidyl-adenosine residue; major species at pH 7.3. pubmed:22076379|pubmed:25640237 Graph a tRNA with a 3' CCACCA end a tRNA with a 3' CCACCA end http://purl.obolibrary.org/obo/CHEBI_195187 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195191 biolink:ChemicalEntity desferrioxamine B(1+) A primary aliphatic ammonium ion that is the conjugate acid of desferrioxamine B; major species at pH 7.3. pdb-ccd:KTY Graph desferrioxamine B|desferrioxaminium B desferrioxamine B|desferrioxaminium B http://purl.obolibrary.org/obo/CHEBI_195191 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195194 biolink:ChemicalEntity 5'-end 2'-deoxyribose-deoxyribonucleotide residue(3-) metacyc.compound:a-5-deoxyribose-5-phosphate-DNA|pubmed:9614142 Graph a 5'-end 2'-deoxyribose-deoxyribonucleotide residue a 5'-end 2'-deoxyribose-deoxyribonucleotide residue http://purl.obolibrary.org/obo/CHEBI_195194 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195195 biolink:ChemicalEntity (2E,4S)-4-hydroxypenten-2-al-5-phosphate(2-) metacyc.compound:CPD-22978|pubmed:9614142 Graph (2E,4S)-4-hydroxypenten-2-al-5-phosphate (2E,4S)-4-hydroxypenten-2-al-5-phosphate http://purl.obolibrary.org/obo/CHEBI_195195 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195196 biolink:ChemicalEntity Xaa-L-proline zwitterion A dipeptide with a C-terminal L-proline residue; major microspecies at pH 7.3. metacyc.compound:Dipeptides-With-Proline-Carboxy|pubmed:15313226 Graph Xaa-L-Pro dipeptide Xaa-L-Pro dipeptide http://purl.obolibrary.org/obo/CHEBI_195196 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195208 biolink:ChemicalEntity tat-BP(2-) A glycopeptide anion that is the conjugate base of tat-BP, arising from deprotonation of the three carboxy groups and protonation of the amino group; major species at pH 7.3. pubmed:16556841|pubmed:28539433|pubmed:37116499 Graph N-acetyl-D-glucosaminyl-1,6-anhydro-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-meso-diaminopimelyl-D-alanine(2-)|N-acetyl-beta-D-glucosaminyl-(1->4)-1,6-anhydro-N-acetyl-beta-D-muramoyl-L-alanyl-gamma-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanine|TCT(2-)|tracheal cytotoxic glycopeptide(2-) N-acetyl-D-glucosaminyl-1,6-anhydro-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-meso-diaminopimelyl-D-alanine(2-)|N-acetyl-beta-D-glucosaminyl-(1->4)-1,6-anhydro-N-acetyl-beta-D-muramoyl-L-alanyl-gamma-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanine|TCT(2-)|tracheal cytotoxic glycopeptide(2-) http://purl.obolibrary.org/obo/CHEBI_195208 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195215 biolink:ChemicalEntity glycoalkaloid A glycoside that is a compound containing one or more hydrophilic glycoside moieties combined with an alkaloid. Found in Solanaceae plants such as courgettes, paprika, aubergines, tomatoes and potatoes. pubmed:35161249|pubmed:35811507|pubmed:36260761|pubmed:36277854|pubmed:36675181|pubmed:36931584|pubmed:37164133|wikipedia.en:Glycoalkaloid Graph glycoalkaloids glycoalkaloids http://purl.obolibrary.org/obo/CHEBI_195215 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195233 biolink:ChemicalEntity diethyl 2-sulfanylbutanedioate A diester resulting from the formal condensation of the carboxy groups of thiomalic acid with ethanol. It is a metabolite of the insecticide malathion. agr:IND93002823|cas:23060-14-2|pubmed:18227961|pubmed:219925|pubmed:28013137|pubmed:29415099|pubmed:34060111|pubmed:6430230|pubmed:6612736|reaxys:1779749 Graph 1,4-diethyl 2-sulfanylbutanedioate|2-mercaptosuccinic acid diethyl ester|FEMA 4972|diethyl 2-mercaptobutanedioate|diethyl 2-mercaptosuccinate|diethyl 2-sulfanylbutanedioate|diethyl mercaptosuccinate|mercaptosuccinic acid diethyl ester diethyl 2-sulfanylbutanedioate 1,4-diethyl 2-sulfanylbutanedioate|2-mercaptosuccinic acid diethyl ester|FEMA 4972|diethyl 2-mercaptobutanedioate|diethyl 2-mercaptosuccinate|diethyl 2-sulfanylbutanedioate|diethyl mercaptosuccinate|mercaptosuccinic acid diethyl ester http://purl.obolibrary.org/obo/CHEBI_195233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195237 biolink:ChemicalEntity alkenylbenzene A member of the class of benzenes that is benzene substituted with one or more alkenyl groups. It is a group of naturally occurring compounds that are synthesized as secondary metabolites in various plants, including nutmeg and basil. pubmed:20863818|pubmed:28580843|pubmed:29913232|pubmed:32283503|pubmed:34071244|pubmed:34574258|pubmed:34861381|pubmed:35011249|pubmed:35804802|pubmed:36863505 Graph alkenyl benzene|alkenyl benzenes|alkenylbenzenes alkenyl benzene|alkenyl benzenes|alkenylbenzenes http://purl.obolibrary.org/obo/CHEBI_195237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195250 biolink:ChemicalEntity corn oil An oil extracted from the germ of Zea mays. Typical fatty acid composition is 52% linoleic acid, 31% oleic acid, 13% palmitic acid, 3% stearic acid, and 1% linolenic acid. It also contains significant amounts of vitamin E. agr:IND607556831|agr:IND607965787|cas:8001-30-7|kegg.drug:D03590|pubmed:35699154|pubmed:35789318|pubmed:36060572|pubmed:36139806|pubmed:36230300|pubmed:36236152|pubmed:36385114|pubmed:36621096|pubmed:36677028|pubmed:36731234|pubmed:36789040|pubmed:36942760|pubmed:36958465|pubmed:37075571|pubmed:37148511|wikipedia.en:Corn_oil Graph Bunge|Gold-N-Sweet pan spray|Lipomul|Maydol|Mazola oil|Semen Maydis oil|Zea mays oil|corn germ oil|fats and glyceridic oils, corn|germ oil of Semen Maydis|maise oil|maize oil|oils, corn|oils, glyceridic, corn Bunge|Gold-N-Sweet pan spray|Lipomul|Maydol|Mazola oil|Semen Maydis oil|Zea mays oil|corn germ oil|fats and glyceridic oils, corn|germ oil of Semen Maydis|maise oil|maize oil|oils, corn|oils, glyceridic, corn http://purl.obolibrary.org/obo/CHEBI_195250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195251 biolink:ChemicalEntity activator A substance that increases the rate of a chemical reaction. Graph activators activators http://purl.obolibrary.org/obo/CHEBI_195251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195252 biolink:ChemicalEntity enzyme activator An activator of an enzyme-catalysed reaction. wikipedia.en:Enzyme_activator Graph enzyme activators enzyme activators http://purl.obolibrary.org/obo/CHEBI_195252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195255 biolink:ChemicalEntity gentamicin X2 cation (4+) metacyc.compound:CPD-14214|pubmed:23679096|pubmed:29091410 Graph gentamicin X2 gentamicin X2 http://purl.obolibrary.org/obo/CHEBI_195255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195256 biolink:ChemicalEntity geneticin cation(4+) metacyc.compound:CPD-14209|pubmed:23679096|pubmed:29091410 Graph G418|geneticin G418|geneticin http://purl.obolibrary.org/obo/CHEBI_195256 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195260 biolink:ChemicalEntity N-acetyl-D-glutamate(2-) An N-acyl-D-α-amino acid anion resulting from deprotonation of both carboxy groups of N-acetyl-D-glutamic acid. Major microspecies at pH 7.3. metacyc.compound:CPD-26441|pubmed:36690779 Graph N-acetyl-D-Glu|N-acetyl-D-glutamate N-acetyl-D-Glu|N-acetyl-D-glutamate http://purl.obolibrary.org/obo/CHEBI_195260 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195274 biolink:ChemicalEntity N-acetyl-D-aspartate(2-) An N-acyl-D-α-amino acid anion resulting from deprotonation of both carboxy groups of N-acetyl-D-aspartic acid. Major microspecies at pH 7.3. pubmed:36690779 Graph N-acetyl-D-Asp|N-acetyl-D-aspartate N-acetyl-D-Asp|N-acetyl-D-aspartate http://purl.obolibrary.org/obo/CHEBI_195274 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195280 biolink:ChemicalEntity artemether An artemisinin derivative that is artemisinin in which the lactone has been converted to the corresponding lactol methyl ether. It is used in combination with lumefantrine as an antimalarial for the treatment of multi-drug resistant strains of falciparum malaria. beilstein:6569878|cas:71963-77-4|drugbank:DB06697|drugcentral:245|kegg.drug:D02483|lincs.smallmolecule:LSM-5519|pubmed:11141088|pubmed:12781185|pubmed:16033274|pubmed:17242150|pubmed:17404003|pubmed:18243702|pubmed:3279208|wikipedia.en:Artemether Graph (1R,4S,5R,8S,9R,10S,12R,13R)-10-methoxy-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0^{4,13}.0^{8,13}]hexadecane|(3R,5aS,6R,8aS,9R,10S,12R,12aR)-10-methoxy-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepine|10-methoxy-1,5,9-trimethyl-(1R,4S,5R,8S,9R,10S,12R,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane|artemetero|artemether|artemetherum|artemisininelactol methyl ether|beta-artemether|beta-dihydroartemisinin methyl ether|dihydroartemisinin methyl ether|methyl-dihydroartemisinine (3R,5aS,6R,8aS,9R,10S,12R,12aR)-10-methoxy-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepine (1R,4S,5R,8S,9R,10S,12R,13R)-10-methoxy-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0^{4,13}.0^{8,13}]hexadecane|(3R,5aS,6R,8aS,9R,10S,12R,12aR)-10-methoxy-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepine|10-methoxy-1,5,9-trimethyl-(1R,4S,5R,8S,9R,10S,12R,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane|artemetero|artemether|artemetherum|artemisininelactol methyl ether|beta-artemether|beta-dihydroartemisinin methyl ether|dihydroartemisinin methyl ether|methyl-dihydroartemisinine http://purl.obolibrary.org/obo/CHEBI_195280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195298 biolink:ChemicalEntity loganetin An iridoid monoterpenoid that is methyl (4aS,7aR)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate substituted at positions 1 and 6 by hydroxy groups and at postion 7 by a methyl group; the aglycone of loganin. cas:29748-10-5|kegg.compound:C22676|knapsack:C00036132|metacyc.compound:CPD-16441|pubmed:12943773|pubmed:19967996|pubmed:21799001|pubmed:22466563|pubmed:26749820|pubmed:27534097|pubmed:29276981|pubmed:30205569|pubmed:30706443|pubmed:33098378|pubmed:34692636|pubmed:37026980 Graph methyl (1R,4aS,6S,7R,7aS)-1,6-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate methyl (1R,4aS,6S,7R,7aS)-1,6-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate methyl (1R,4aS,6S,7R,7aS)-1,6-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate http://purl.obolibrary.org/obo/CHEBI_195298 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195327 biolink:ChemicalEntity HYDROXYPROPYL BETADEX cas:94035-02-6 Graph 2-Hydroxypropyl-beta-cyclodextrin|HPBCD|Hydroxypropyl BCD 2-Hydroxypropyl-beta-cyclodextrin|HPBCD|Hydroxypropyl BCD http://purl.obolibrary.org/obo/CHEBI_195327 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195348 biolink:ChemicalEntity protectin D1(1-) A dihydroxydocosahexaenoate that is the conjugate base of protectin D1, obtained by deprotonation of the carboxy group; major species at pH 7.3. pubmed:26580578 Graph (10R,17S)-dihydroxy-(4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoate|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate|neuroprotectin D1 anion|neuroprotectin D1(1-)|protectin D1 anion (4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate (10R,17S)-dihydroxy-(4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoate|(4Z,7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoate|neuroprotectin D1 anion|neuroprotectin D1(1-)|protectin D1 anion http://purl.obolibrary.org/obo/CHEBI_195348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195358 biolink:ChemicalEntity 11-cis-retinyl ester Graph 11-cis-retinyl ester 11-cis-retinyl ester http://purl.obolibrary.org/obo/CHEBI_195358 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195362 biolink:ChemicalEntity N-(omega-hydroxyacyl)-sphingosine Graph N-(omega-hydroxyacyl)-sphing-4-enine|omega-hydroxy-ceramide(d18:1(4E)) N-(omega-hydroxyacyl)-sphing-4-enine|omega-hydroxy-ceramide(d18:1(4E)) http://purl.obolibrary.org/obo/CHEBI_195362 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195364 biolink:ChemicalEntity (6R)-10-formyltetrahydrofolic acid A 10-formyltetrahydrofolic acid that has R-configuration at position 6. patent:EP0535710|pubmed:2185839 Graph (2S,6R)-10-formyltetrahydrofolic acid|(6R)-N(10)-formyl-5,6,7,8-tetrahydrofolic acid|(6R)-N(10)-formyltetrahydrofolic acid|N-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzoyl}-L-glutamic acid N-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzoyl}-L-glutamic acid (2S,6R)-10-formyltetrahydrofolic acid|(6R)-N(10)-formyl-5,6,7,8-tetrahydrofolic acid|(6R)-N(10)-formyltetrahydrofolic acid|N-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzoyl}-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_195364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195366 biolink:ChemicalEntity (6R)-10-formyltetrahydrofolate(2-) Graph (2S)-2-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzamido}pentanedioate|(2S,6R)-10-formyltetrahydrofolate|(6R)-10-formyltetrahydrofolate|(6R)-N(10)-formyl-5,6,7,8-tetrahydrofolate|(6R)-N(10)-formyltetrahydrofolate (2S)-2-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzamido}pentanedioate (2S)-2-{4-[{[(6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}(formyl)amino]benzamido}pentanedioate|(2S,6R)-10-formyltetrahydrofolate|(6R)-10-formyltetrahydrofolate|(6R)-N(10)-formyl-5,6,7,8-tetrahydrofolate|(6R)-N(10)-formyltetrahydrofolate http://purl.obolibrary.org/obo/CHEBI_195366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195398 biolink:ChemicalEntity batimastat A secondary carboxamide resulting from the formal condensation of the carboxy group of (2S,3R)-5-methyl-3-{[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl}-2-[(thiophen-2-ylsulfanyl)methyl]hexanoic acid with the amino group of hydroxylamine. It a broad-spectrum matrix metalloprotease inhibitor. cas:130370-60-4|chemspider:4515033|drugbank:DB03880|kegg.drug:D03061|lincs.smallmolecule:LSM-6276|metacyc.compound:CPD-21519|pdb-ccd:BAT|pubmed:10100701|pubmed:10416010|pubmed:10566008|pubmed:10628317|pubmed:11129784|pubmed:11435723|pubmed:11575928|pubmed:11718018|pubmed:12172929|pubmed:14741217|pubmed:15206921|pubmed:22684055|pubmed:24819550|pubmed:26443597|pubmed:26546696|pubmed:26559179|pubmed:28417261|pubmed:32048249|pubmed:32397419|pubmed:32411205|pubmed:33330030|pubmed:34055088|pubmed:34060428|pubmed:36001659|pubmed:36482856|pubmed:36825288|pubmed:37302822|pubmed:7577999|pubmed:7627972|pubmed:8062271|pubmed:8347186|pubmed:8610113|pubmed:8665519|pubmed:8913271|pubmed:8913840|pubmed:9816289|pubmed:9882797|pubmed:9932102|wikipedia.en:Batimastat Graph (2R,3S)-N(4)-hydroxy-N(1)-[(1S)-2-(methylamino)-2-oxo-1-(phenylmethyl)ethyl]-2-(2-methylpropyl)-3-[(2-thienylthio)methyl]butanediamide|(2R,3S)-N(4)-hydroxy-N(1)-[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-(2-methylpropyl)-3-[(thiophen-2-ylsulfanyl)methyl]butanediamide|4-(N-hydroxyamino)-2R-isobutyl-3S-(thiopen-2-ylthiomethyl)-succinyl-L-phenylalanine-N-methylamide|BB 94|BB-94|BB94|batimastat|batimastatum (2R,3S)-N(4)-hydroxy-N(1)-[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-(2-methylpropyl)-3-[(thiophen-2-ylsulfanyl)methyl]butanediamide (2R,3S)-N(4)-hydroxy-N(1)-[(1S)-2-(methylamino)-2-oxo-1-(phenylmethyl)ethyl]-2-(2-methylpropyl)-3-[(2-thienylthio)methyl]butanediamide|(2R,3S)-N(4)-hydroxy-N(1)-[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-(2-methylpropyl)-3-[(thiophen-2-ylsulfanyl)methyl]butanediamide|4-(N-hydroxyamino)-2R-isobutyl-3S-(thiopen-2-ylthiomethyl)-succinyl-L-phenylalanine-N-methylamide|BB 94|BB-94|BB94|batimastat|batimastatum http://purl.obolibrary.org/obo/CHEBI_195398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195403 biolink:ChemicalEntity (17S)-HDHA(1-) A hydroxydocosahexaenoate that is the conjugate base of (17S)-HDHA, arising from deprotonation of the carboxylic acid function; major species at pH 7.3. pubmed:36608588 Graph (17S)-hydroxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate (17S)-hydroxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate http://purl.obolibrary.org/obo/CHEBI_195403 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195408 biolink:ChemicalEntity PE(16:1(9Z)/14:0) zwitterion Graph http://purl.obolibrary.org/obo/CHEBI_195408 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195410 biolink:ChemicalEntity PE(16:1(9Z)/16:0) zwitterion Graph http://purl.obolibrary.org/obo/CHEBI_195410 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195411 biolink:ChemicalEntity PE(18:0/16:1(9Z)) zwitterion Graph http://purl.obolibrary.org/obo/CHEBI_195411 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195476 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine Graph ganglioside GA2 ganglioside GA2 http://purl.obolibrary.org/obo/CHEBI_195476 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195517 biolink:ChemicalEntity 5-S-cysteinyldopa zwitterion metacyc.compound:CPD-15154|pubmed:10952395 Graph 5-S-cysteinyldopa 5-S-cysteinyldopa http://purl.obolibrary.org/obo/CHEBI_195517 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195533 biolink:ChemicalEntity PABA/NO A C-nitro compound that is benzene substituted by [4-(methylamino)benzoyl]oxy, nitro, nitro, and (3,3-dimethyl-2-oxido-2λ5-triaz-1-en-1-yl)oxy groups at positions 1, 2, 4, and 5, respectively. It is an anti-cancer compound that is designed to release NO upon activation by glutathione. cas:875769-11-2|pubmed:15102935|pubmed:16288082|pubmed:16399394|pubmed:16451080|pubmed:18060792|pubmed:19053760|pubmed:19662104|pubmed:19773442|pubmed:20000791|pubmed:20232108|pubmed:21455987|pubmed:21949595|pubmed:22654912|pubmed:23617697|pubmed:26043946 Graph 5-[(3,3-dimethyl-2-oxido-1-triazen-1-yl)oxy]-2,4-dinitrophenyl 4-(methylamino)benzoate|5-[(3,3-dimethyl-2-oxido-2lambda(5)-triaz-1-en-1-yl)oxy]-2,4-dinitrophenyl 4-(methylamino)benzoate|O(2)-(2,4-dinitro-5-(4-(N-methylamino)benzoyloxy)phenyl) 1-(N,N-dimethylamino)diazen-1-ium-1,2-diolate|PABA/NO 5-[(3,3-dimethyl-2-oxido-2lambda(5)-triaz-1-en-1-yl)oxy]-2,4-dinitrophenyl 4-(methylamino)benzoate 5-[(3,3-dimethyl-2-oxido-1-triazen-1-yl)oxy]-2,4-dinitrophenyl 4-(methylamino)benzoate|5-[(3,3-dimethyl-2-oxido-2lambda(5)-triaz-1-en-1-yl)oxy]-2,4-dinitrophenyl 4-(methylamino)benzoate|O(2)-(2,4-dinitro-5-(4-(N-methylamino)benzoyloxy)phenyl) 1-(N,N-dimethylamino)diazen-1-ium-1,2-diolate|PABA/NO http://purl.obolibrary.org/obo/CHEBI_195533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195541 biolink:ChemicalEntity JTE-013 A semicarbazide derivative that is semicarbazide in which the amino group at position 2 is replaced by a [1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]amino group and the amino group adjacent to the carbonyl is replaced by a (2,6-dichloropyridin-4-yl)amino group. It is a potent S1P2 antagonist (IC50 = 17.6 nM). cas:383150-41-2|lincs.smallmolecule:LSM-2961|pubmed:12557151|pubmed:22673325|pubmed:27295443|pubmed:27829417|pubmed:31610097|pubmed:32088343|pubmed:32487782|pubmed:32798381|pubmed:33643037|pubmed:33971464|pubmed:34413778|pubmed:34769490|pubmed:35013382|pubmed:36339341|pubmed:36527992|pubmed:36690339|pubmed:36800698|pubmed:36834810 Graph 1-(2,6-dichloro-4-pyridinyl)-3-[(1,3-dimethyl-4-propan-2-yl-6-pyrazolo[3,4-b]pyridinyl)amino]urea|1-[1,3-dimethyl-4-(2-methylethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]-4-(2,6-dichloro-4-pyridinyl)-semicarbazide|JTE 013|JTE013|N-(2,6-dichloropyridin-4-yl)-2-[1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]hydrazine-1-carboxamide|N-(2,6-dichloropyridin-4-yl)-2-[1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]hydrazinecarboxamide N-(2,6-dichloropyridin-4-yl)-2-[1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]hydrazinecarboxamide 1-(2,6-dichloro-4-pyridinyl)-3-[(1,3-dimethyl-4-propan-2-yl-6-pyrazolo[3,4-b]pyridinyl)amino]urea|1-[1,3-dimethyl-4-(2-methylethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]-4-(2,6-dichloro-4-pyridinyl)-semicarbazide|JTE 013|JTE013|N-(2,6-dichloropyridin-4-yl)-2-[1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]hydrazine-1-carboxamide|N-(2,6-dichloropyridin-4-yl)-2-[1,3-dimethyl-4-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-6-yl]hydrazinecarboxamide http://purl.obolibrary.org/obo/CHEBI_195541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195542 biolink:ChemicalEntity sphingosine-1-phosphate receptor 2 antagonist Any sphingosine-1-phosphate receptor (S1PR) antagonist that acts as an antagonist for the subtype 2 receptors (S1PR2). pubmed:25746814|pubmed:26384288|pubmed:26794040|pubmed:28676392|pubmed:34411894|pubmed:36527992|wikipedia.en:S1PR2 Graph EDG-5 antagonist|EDG-5 antagonists|EDG5 antagonist|EDG5 antagonists|S1P2 antagonist|S1P2 antagonists|S1PR2 antagonist|S1PR2 antagonists|sphingosine-1-phosphate receptor 2 antagonists EDG-5 antagonist|EDG-5 antagonists|EDG5 antagonist|EDG5 antagonists|S1P2 antagonist|S1P2 antagonists|S1PR2 antagonist|S1PR2 antagonists|sphingosine-1-phosphate receptor 2 antagonists http://purl.obolibrary.org/obo/CHEBI_195542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195544 biolink:ChemicalEntity aspartame zwitterion A dipeptide zwitterion resulting from transfer of a proton from the carboxy to the amino group of aspartame; major species at pH 7.3. metacyc.compound:CPD-5583 Graph (3S)-3-azaniumyl-4-{[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino}-4-oxobutanoate|aspartame (3S)-3-azaniumyl-4-{[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino}-4-oxobutanoate (3S)-3-azaniumyl-4-{[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino}-4-oxobutanoate|aspartame http://purl.obolibrary.org/obo/CHEBI_195544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195545 biolink:ChemicalEntity biocytin zwitterion An L-α-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of biocytin; major species at pH 7.3. metacyc.compound:CPD-17700 Graph (2S)-2-azaniumyl-6-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)hexanoate|biocytin (2S)-2-azaniumyl-6-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)hexanoate (2S)-2-azaniumyl-6-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)hexanoate|biocytin http://purl.obolibrary.org/obo/CHEBI_195545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195546 biolink:ChemicalEntity beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-N-acylsphingoid Graph http://purl.obolibrary.org/obo/CHEBI_195546 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19555 biolink:ChemicalEntity 2-deoxy-D-glucoside A D-glucoside compound with the 2-hydroxy substituent either absent or replaced by a different functional group. Graph 2-deoxy-D-glucosides 2-deoxy-D-glucosides http://purl.obolibrary.org/obo/CHEBI_19555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195574 biolink:ChemicalEntity 4'-Azidocytidine chemspider:402579 Graph 4-amino-1-[(2R,3R,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one 4-amino-1-[(2R,3R,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one 4-amino-1-[(2R,3R,4S,5R)-5-azido-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one http://purl.obolibrary.org/obo/CHEBI_195574 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195578 biolink:ChemicalEntity 2',5'-Dideoxyadenosine chemspider:58670 Graph (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol http://purl.obolibrary.org/obo/CHEBI_195578 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:195634 biolink:ChemicalEntity (4E)-unsatiated ceramide Graph http://purl.obolibrary.org/obo/CHEBI_195634 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19564 biolink:ChemicalEntity 2-deoxyribose 1-phosphate Graph 2-deoxy-ribose 1-phosphates 2-deoxy-ribose 1-phosphates http://purl.obolibrary.org/obo/CHEBI_19564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19565 biolink:ChemicalEntity 2-deoxyribose 5-phosphate Graph 2-deoxy-ribose 5-phosphates 2-deoxy-ribose 5-phosphates http://purl.obolibrary.org/obo/CHEBI_19565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19569 biolink:ChemicalEntity 2-deoxyribose phosphate A deoxyaldopentose phosphate in which the deoxyaldopentose is 2-deoxyribose. Graph 2-deoxyribose phosphates|deoxyribose phosphate 2-deoxyribose phosphates|deoxyribose phosphate http://purl.obolibrary.org/obo/CHEBI_19569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19573 biolink:ChemicalEntity 2-enoyl-CoA An unsaturated fatty acyl-CoA in which the S-acyl group contains a double bond between positions 2 and 3. kegg.compound:C00605|metacyc.compound:D2-ENOYL-COA Graph 2,3-dehydroacyl-CoA|2,3-dehydroacyl-CoAs|2-enoyl-CoAs 2,3-dehydroacyl-CoA|2,3-dehydroacyl-CoAs|2-enoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_19573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19591 biolink:ChemicalEntity 2-hexenal A hexenal having the double bond at the 2-position. cas:505-57-7|lipidmaps:LMFA06000002|pubmed:20736172|pubmed:20936263|pubmed:26475511|reaxys:1740988 Graph 2-hexenal|2-hexenaldehyde|3-propyl-acrolein|alpha,beta-hexylenaldehyde|alpha.beta-Hexylenaldehyd|beta-propylacrolein|hex-2-enal|hexen-2-al|hexen-2-en-1-al|hexylenic aldehyde|leaf aldehyde hex-2-enal 2-hexenal|2-hexenaldehyde|3-propyl-acrolein|alpha,beta-hexylenaldehyde|alpha.beta-Hexylenaldehyd|beta-propylacrolein|hex-2-enal|hexen-2-al|hexen-2-en-1-al|hexylenic aldehyde|leaf aldehyde http://purl.obolibrary.org/obo/CHEBI_19591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:195927 biolink:ChemicalEntity 4-Amino-2-methyl-1-naphthol chemspider:6497|hmdb:HMDB0032887 Graph 4-amino-2-methylnaphthalen-1-ol 4-amino-2-methylnaphthalen-1-ol 4-amino-2-methylnaphthalen-1-ol http://purl.obolibrary.org/obo/CHEBI_195927 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19615 biolink:ChemicalEntity 2-hydroxy-6-oxonona-2,4-dienedioate umbbd.compound:c0425 Graph 2-hydroxy-6-keto-nona-2,4-dienedioate|2-hydroxy-6-oxonona-2,4-dienedioate 2-hydroxy-6-oxonona-2,4-dienedioate 2-hydroxy-6-keto-nona-2,4-dienedioate|2-hydroxy-6-oxonona-2,4-dienedioate http://purl.obolibrary.org/obo/CHEBI_19615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19641 biolink:ChemicalEntity 2-hydroxyisobutyrate A hydroxy fatty acid anion that is the conjugate base of 2-hydroxyisobutyric acid, arising from deprotonation of the carboxy group; major species at pH 7.3. reaxys:3903948 Graph 2-hydroxy-2-methylpropanoate|alpha-hydroxy-alpha-methylpropanoate|alpha-hydroxy-alpha-methylpropionate|alpha-hydroxyisobutanoate|alpha-hydroxyisobutyrate 2-hydroxy-2-methylpropanoate 2-hydroxy-2-methylpropanoate|alpha-hydroxy-alpha-methylpropanoate|alpha-hydroxy-alpha-methylpropionate|alpha-hydroxyisobutanoate|alpha-hydroxyisobutyrate http://purl.obolibrary.org/obo/CHEBI_19641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19660 biolink:ChemicalEntity 2-hydroxyoctadecanoic acid A long-chain fatty acid that is stearic (octadecanoic) acid substituted at position 2 by a hydroxy group. cas:629-22-1|lipidmaps:LMFA02000120|pubmed:13661981|pubmed:21417341|pubmed:22339649|pubmed:4385515|reaxys:1791479 Graph 2-hydroxyoctadecanoic acid|2-hydroxystearic acid|alpha-hydroxyoctadecanoic acid|alpha-hydroxystearic acid 2-hydroxyoctadecanoic acid 2-hydroxyoctadecanoic acid|2-hydroxystearic acid|alpha-hydroxyoctadecanoic acid|alpha-hydroxystearic acid http://purl.obolibrary.org/obo/CHEBI_19660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19672 biolink:ChemicalEntity 4-oxohex-2-enedioic acid beilstein:8404489|wikipedia.en:Maleylacetic_acid Graph 4-oxohex-2-enedioic acid 4-oxohex-2-enedioic acid 4-oxohex-2-enedioic acid http://purl.obolibrary.org/obo/CHEBI_19672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19680 biolink:ChemicalEntity 2-methylacetoacetate beilstein:5246120 Graph 2-methyl-3-oxobutanoate|2-methyl-3-oxobutyrate 2-methyl-3-oxobutanoate 2-methyl-3-oxobutanoate|2-methyl-3-oxobutyrate http://purl.obolibrary.org/obo/CHEBI_19680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:196991 biolink:ChemicalEntity 4-hydroperoxycyclophosphamide A phosphorodiamide that is the active metabolite of the nitrogen mustard cyclophosphamide. It has potent antineoplastic and immunosuppressive properties. cas:39800-16-3|patent:NL7208895|patent:US3808297|pubmed:8024619|reaxys:531579 Graph 2-(Bis(2-chloroethyl)amino)-4-hydroperoxytetrahydro-2H-1,3,2-oxazaphosphorine|2-(bis(2-chloroethyl)amino)tetrahydro-2-oxideo-2H-1,3,2-oxazaphosphorin-4-yl hydroperoxide|2-[bis(2-chloroethyl)amino]-2-oxido-1,3,2-oxazaphosphinan-4-yl hydroperoxide|4-Hydroperoxycyclofosfamide|4-OOH Cyclophosphamide|Perfosfamide (unspecified) 2-[bis(2-chloroethyl)amino]-2-oxido-1,3,2-oxazaphosphinan-4-yl hydroperoxide 2-(Bis(2-chloroethyl)amino)-4-hydroperoxytetrahydro-2H-1,3,2-oxazaphosphorine|2-(bis(2-chloroethyl)amino)tetrahydro-2-oxideo-2H-1,3,2-oxazaphosphorin-4-yl hydroperoxide|2-[bis(2-chloroethyl)amino]-2-oxido-1,3,2-oxazaphosphinan-4-yl hydroperoxide|4-Hydroperoxycyclofosfamide|4-OOH Cyclophosphamide|Perfosfamide (unspecified) http://purl.obolibrary.org/obo/CHEBI_196991 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19702 biolink:ChemicalEntity N(2)-methylguanosine Guanosine with the hydrogen on the amine at position N-2 substituted with a methyl group. cas:2140-77-4|hmdb:HMDB0005862|pubmed:21735129|pubmed:22337946|pubmed:22770225|reaxys:1031383|reaxys:46491 Graph 2-(methylamino)-9-(beta-D-ribofuranosyl)-1,9-dihydro-6H-purin-6-one|2-Methylguanosine|7-Methylguanosine|9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(methylamino)-1,9-dihydro-6H-purin-6-one|N(2)-Methylguanosine|N-methylguanosine|m2g 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(methylamino)-1,9-dihydro-6H-purin-6-one|N-methylguanosine 2-(methylamino)-9-(beta-D-ribofuranosyl)-1,9-dihydro-6H-purin-6-one|2-Methylguanosine|7-Methylguanosine|9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(methylamino)-1,9-dihydro-6H-purin-6-one|N(2)-Methylguanosine|N-methylguanosine|m2g http://purl.obolibrary.org/obo/CHEBI_19702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197221 biolink:ChemicalEntity NORCANTHARIDIN chemspider:8053159|chemspider:83957|hmdb:HMDB0245751|kegg.drug:D97665 Graph (1R,2S,6R,7S)-4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione|4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione (1R,2S,6R,7S)-4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione|4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione (1R,2S,6R,7S)-4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione|4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione http://purl.obolibrary.org/obo/CHEBI_197221 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:197237 biolink:ChemicalEntity CEDRELONE chemspider:10222113 Graph (1R,2R,4R,6S,7S,10R,11R)-6-(uran-3-yl)-17-hydroxy-1,7,11,15,15-pentamethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadeca-12,16-diene-14,18-dione (1R,2R,4R,6S,7S,10R,11R)-6-(uran-3-yl)-17-hydroxy-1,7,11,15,15-pentamethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadeca-12,16-diene-14,18-dione (1R,2R,4R,6S,7S,10R,11R)-6-(uran-3-yl)-17-hydroxy-1,7,11,15,15-pentamethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadeca-12,16-diene-14,18-dione http://purl.obolibrary.org/obo/CHEBI_197237 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:197289 biolink:ChemicalEntity 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid A 6-oxo monocarboxylic acid that is 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid in with one of the ortho positions of the phenyl ring is substituted by an amino group. Graph 2-hydroxy-6-oxo-(2'-aminophenyl)-hexa-2,4-dienoic acid|6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid 2-hydroxy-6-oxo-(2'-aminophenyl)-hexa-2,4-dienoic acid|6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid http://purl.obolibrary.org/obo/CHEBI_197289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19733 biolink:ChemicalEntity (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate A 4-oxo monocarboxylic acid anion resulting from the removal of a proton from the carboxylic acid group of (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid. metacyc.compound:CPD-866|umbbd.compound:c0410 Graph (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate|2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetate (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate|2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetate http://purl.obolibrary.org/obo/CHEBI_19733 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197331 biolink:ChemicalEntity UDP-D-glucuronic acid A UDP-sugar having D-glucopyranuronic acid as the sugar component. pubmed:27834878|pubmed:35043627|pubmed:4333589|pubmed:4373069|pubmed:4393018|pubmed:5737946 Graph UDP-GlcA|UDP-glucuronic acid|UDPGA|uridine diphosphate glucuronic acid|uridine-5'-diphosphoglucuronic acid UDP-GlcA|UDP-glucuronic acid|UDPGA|uridine diphosphate glucuronic acid|uridine-5'-diphosphoglucuronic acid http://purl.obolibrary.org/obo/CHEBI_197331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197387 biolink:ChemicalEntity hexadecanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of sixteen carbon atoms. cas:29354-98-1 Graph hexadecanols|hydroxyhexadecane|hydroxyhexadecanes hexadecanols|hydroxyhexadecane|hydroxyhexadecanes http://purl.obolibrary.org/obo/CHEBI_197387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197424 biolink:ChemicalEntity SB 290157 Antagonist of C3aR cas:1140525-25-2|pubmed:11342658|pubmed:15944244|pubmed:16154494|pubmed:20051658|pubmed:33073351|pubmed:33551801 Graph N(2)-[(2,2-diphenylethoxy)acetyl]-L-arginine trifluoroacetate|N(2)-[2-(2,2-Diphenylethoxy)acetyl]-L-arginine trifluoroacetate salt|N2-[2-(2,2-diphenylethoxy)acetyl]-L-arginine, 2,2,2-trifluoroacetate|SB 290157 trifluoroacetate salt|SB-290157|SB290157|SB290157 trifluoroacetate N(2)-[(2,2-diphenylethoxy)acetyl]-L-arginine trifluoroacetate N(2)-[(2,2-diphenylethoxy)acetyl]-L-arginine trifluoroacetate|N(2)-[2-(2,2-Diphenylethoxy)acetyl]-L-arginine trifluoroacetate salt|N2-[2-(2,2-diphenylethoxy)acetyl]-L-arginine, 2,2,2-trifluoroacetate|SB 290157 trifluoroacetate salt|SB-290157|SB290157|SB290157 trifluoroacetate http://purl.obolibrary.org/obo/CHEBI_197424 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:197438 biolink:ChemicalEntity SR11302 A retinoid that is all-trans-retinoic acid in which the methyl group at position 9 is replaced by a 4-methylphenyl group. It is an inhibitor of activator protein-1 which exhibits antitumour effects in vivo. cas:160162-42-5|pubmed:21515313|pubmed:23760290|pubmed:24587316|pubmed:24831826|pubmed:25001622|pubmed:26908177|pubmed:27490694|pubmed:29177791|pubmed:31392841|pubmed:33119185|pubmed:33794365|pubmed:35559742|pubmed:35966011|pubmed:36035373|pubmed:36670963|pubmed:36898276|pubmed:37707834|pubmed:9159159 Graph (2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(2E,4E,6Z,8E)-3-methyl-7-(p-tolyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(E,E,Z,E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid|SR 11302|SR-11303 (2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid (2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(2E,4E,6Z,8E)-3-methyl-7-(p-tolyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid|(E,E,Z,E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid|SR 11302|SR-11303 http://purl.obolibrary.org/obo/CHEBI_197438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197449 biolink:ChemicalEntity NMR solvent A solvent used in nuclear magnetic resonance (NMR) spectroscopy. Graph NMR solvents|NMR-Loesemittel|NMR-Loesungsmittel NMR solvents|NMR-Loesemittel|NMR-Loesungsmittel http://purl.obolibrary.org/obo/CHEBI_197449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197457 biolink:ChemicalEntity octadecanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of eighteen carbon atoms. Graph hydroxyoctadecane|hydroxyoctadecanes|octadecanols hydroxyoctadecane|hydroxyoctadecanes|octadecanols http://purl.obolibrary.org/obo/CHEBI_197457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197480 biolink:ChemicalEntity icosanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of twenty carbon atoms. Graph eicosanol|eicosanols|icosanols eicosanol|eicosanols|icosanols http://purl.obolibrary.org/obo/CHEBI_197480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197504 biolink:ChemicalEntity very long-chain fatty alcohol A fatty alcohol which has a chain length between C23 and C27. Graph a very long-chain fatty alcohol|very long chain fatty alcohol|very long chain fatty alcohols|very long-chain fatty alcohols a very long-chain fatty alcohol|very long chain fatty alcohol|very long chain fatty alcohols|very long-chain fatty alcohols http://purl.obolibrary.org/obo/CHEBI_197504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197506 biolink:ChemicalEntity medium-chain fatty alcohol Any fatty alcohol with a chain length between C6 and C12. Graph medium-chain fatty alcohols medium-chain fatty alcohols http://purl.obolibrary.org/obo/CHEBI_197506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197507 biolink:ChemicalEntity short-chain fatty alcohol A fatty alcohol with a chain length of less than C6. Graph short-chain fatty alcohols short-chain fatty alcohols http://purl.obolibrary.org/obo/CHEBI_197507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19763 biolink:ChemicalEntity 2-phosphoglycolate Graph 2-phosphoglycolate 2-phosphoglycolate http://purl.obolibrary.org/obo/CHEBI_19763 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:19775 biolink:ChemicalEntity quinaldate A quinolinemonocarboxylate that is the conjugate base of quinaldic acid; major species at pH 7.3. beilstein:329846|reaxys:3905706 Graph quinaldate|quinaldate anion|quinaldate(1-)|quinoline-2-carboxylate quinaldate|quinaldate anion|quinaldate(1-)|quinoline-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_19775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:197994 biolink:ChemicalEntity Demethylasterriquinone B1 chemspider:2281897|hmdb:HMDB0250991 Graph 2,5-dihydroxy-3-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]-6-[7-(3-methylbut-2-enyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione 2,5-dihydroxy-3-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]-6-[7-(3-methylbut-2-enyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione 2,5-dihydroxy-3-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]-6-[7-(3-methylbut-2-enyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione http://purl.obolibrary.org/obo/CHEBI_197994 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19813 biolink:ChemicalEntity 24-methylenecycloartenol Graph http://purl.obolibrary.org/obo/CHEBI_19813 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:198192 biolink:ChemicalEntity Ruthmycin chemspider:30830036 Graph 2-[(1R,9R,12R,14R)-4,9-dihydroxy-2,16-dioxo-14-propyl-13-oxatetracyclo[7.5.3.01,10.03,8]heptadeca-3(8),4,6,10-tetraen-12-yl]acetic acid 2-[(1R,9R,12R,14R)-4,9-dihydroxy-2,16-dioxo-14-propyl-13-oxatetracyclo[7.5.3.01,10.03,8]heptadeca-3(8),4,6,10-tetraen-12-yl]acetic acid 2-[(1R,9R,12R,14R)-4,9-dihydroxy-2,16-dioxo-14-propyl-13-oxatetracyclo[7.5.3.01,10.03,8]heptadeca-3(8),4,6,10-tetraen-12-yl]acetic acid http://purl.obolibrary.org/obo/CHEBI_198192 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19834 biolink:ChemicalEntity 3',5'-cyclic purine nucleotide Graph 3',5'-cyclic purine nucleotides 3',5'-cyclic purine nucleotides http://purl.obolibrary.org/obo/CHEBI_19834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19835 biolink:ChemicalEntity 3',5'-cyclic pyrimidine nucleotide Graph 3',5'-cyclic pyrimidine nucleotides 3',5'-cyclic pyrimidine nucleotides http://purl.obolibrary.org/obo/CHEBI_19835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:198427 biolink:ChemicalEntity Vicanicin chemspider:287195 Graph 2,8-dichloro-9-hydroxy-3-methoxy-1,4,7,10-tetramethylbenzo[b][1,4]benzodioxepin-6-one 2,8-dichloro-9-hydroxy-3-methoxy-1,4,7,10-tetramethylbenzo[b][1,4]benzodioxepin-6-one 2,8-dichloro-9-hydroxy-3-methoxy-1,4,7,10-tetramethylbenzo[b][1,4]benzodioxepin-6-one http://purl.obolibrary.org/obo/CHEBI_198427 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:1989 biolink:ChemicalEntity (6R)-5,10-methylenetetrahydrofolic acid The (6R)-stereoisomer of 5,10-methylenetetrahydrofolic acid. cas:3432-99-3|kegg.compound:C00143|knapsack:C00007250|reaxys:5467239 Graph (6R)-5,10-Methylenetetrahydrofolate|5,10-Methylene-THF|5,10-Methylenetetrahydrofolate|5,10-methylenetetrahydrofolic acid|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid (6R)-5,10-Methylenetetrahydrofolate|5,10-Methylene-THF|5,10-Methylenetetrahydrofolate|5,10-methylenetetrahydrofolic acid|N-{4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_1989 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19891 biolink:ChemicalEntity 3,4-dihydroxyphenylpyruvic acid A 2-oxo monocarboxylic acid that is pyruvic acid in which one of the methyl hydrogens is substituted by a 3,4-dihydroxyphenyl group. cas:4228-66-4|kegg.compound:C04045|pubmed:7164823|pubmed:8773780|reaxys:2695044 Graph 3,4-Dihydroxyphenylpyruvate|3,4-dihydroxy-alpha-oxobenzenepropanoic acid|3-(3,4-dihydroxyphenyl)-2-oxopropanoic acid|DHPPA 3-(3,4-dihydroxyphenyl)-2-oxopropanoic acid 3,4-Dihydroxyphenylpyruvate|3,4-dihydroxy-alpha-oxobenzenepropanoic acid|3-(3,4-dihydroxyphenyl)-2-oxopropanoic acid|DHPPA http://purl.obolibrary.org/obo/CHEBI_19891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19929 biolink:ChemicalEntity 3-hydroxy-3-phenylpropionic acid A 3-hydroxy carboxylic acid that is 3-phenylpropionic acid in which one of the hydrogens β to the carboxy group is replaced by a hydroxy group. metacyc.compound:CPD-12218|pubmed:11219576|reaxys:3197774 Graph 3-hydroxy-3-phenylpropanoic acid 3-hydroxy-3-phenylpropanoic acid 3-hydroxy-3-phenylpropanoic acid http://purl.obolibrary.org/obo/CHEBI_19929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:199329 biolink:ChemicalEntity Inotodiol chemspider:23282401 Graph (3S,5R,10S,13R,14R,17R)-17-[(2S,3R)-3-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5R,10S,13R,14R,17R)-17-[(2S,3R)-3-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5R,10S,13R,14R,17R)-17-[(2S,3R)-3-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol http://purl.obolibrary.org/obo/CHEBI_199329 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:19946 biolink:ChemicalEntity xylosylglycoside Graph xylosylglycoside|xylosylglycosides xylosylglycoside|xylosylglycosides http://purl.obolibrary.org/obo/CHEBI_19946 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19950 biolink:ChemicalEntity 3-O-methylgallate A member of the class of benzoates that results from the removal of a proton from the carboxylic acid group of 3-O-methylgallic acid. Graph 3,4-dihydroxy-5-methoxybenzoate|3-O-methylgallate|4,5-Dihydroxy-m-anisate 3,4-dihydroxy-5-methoxybenzoate 3,4-dihydroxy-5-methoxybenzoate|3-O-methylgallate|4,5-Dihydroxy-m-anisate http://purl.obolibrary.org/obo/CHEBI_19950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19960 biolink:ChemicalEntity 3-amino-3-(4-hydroxyphenyl)propanoate A β-amino-acid anion that is the conjugate base of 3-amino-3-(4-hydroxyphenyl)propanoic acid, arising from deprotonation of the carboxy group. metacyc.compound:CPD-232 Graph 3-amino-3-(4-hydroxyphenyl)propanoate|3-amino-3-(4-hydroxyphenyl)propanoate anion|3-amino-3-(4-hydroxyphenyl)propanoate(1-)|3-amino-3-(4-hydroxyphenyl)propionate|3-amino-3-(4-hydroxyphenyl)propionate anion|3-amino-3-(4-hydroxyphenyl)propionate(1-) 3-amino-3-(4-hydroxyphenyl)propanoate 3-amino-3-(4-hydroxyphenyl)propanoate|3-amino-3-(4-hydroxyphenyl)propanoate anion|3-amino-3-(4-hydroxyphenyl)propanoate(1-)|3-amino-3-(4-hydroxyphenyl)propionate|3-amino-3-(4-hydroxyphenyl)propionate anion|3-amino-3-(4-hydroxyphenyl)propionate(1-) http://purl.obolibrary.org/obo/CHEBI_19960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:19982 biolink:ChemicalEntity 3-chloroacrylic acid A chlorocarboxylic acid that is acrylic acid in which one of the hydrogens at position 3 is substituted by chlorine. cas:2345-61-1|kegg.compound:C06614|reaxys:14713319 Graph 3-chloro-2-propenoic acids|3-chloroacrylic acids|3-chloroprop-2-enoic acid 3-chloroprop-2-enoic acid 3-chloro-2-propenoic acids|3-chloroacrylic acids|3-chloroprop-2-enoic acid http://purl.obolibrary.org/obo/CHEBI_19982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20 biolink:ChemicalEntity (+)-camphene A camphene (2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane) that has R configuration at position 1 and S configuration at position 4. beilstein:2323386|cas:5794-03-6|kegg.compound:C06304|knapsack:C00000818|lipidmaps:LMPR0102120011|reaxys:5240568 Graph (+)-Camphene|(+)-Comphene|(1R)-2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane|(1R,4S)-(+)-camphene|(1R,4S)-2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane|(1R,4S)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane|(1R,4S)-camphene|d-camphene (1R,4S)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane (+)-Camphene|(+)-Comphene|(1R)-2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane|(1R,4S)-(+)-camphene|(1R,4S)-2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane|(1R,4S)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane|(1R,4S)-camphene|d-camphene http://purl.obolibrary.org/obo/CHEBI_20 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20012 biolink:ChemicalEntity 3-enoyl-CoA Generic name for any derivative of coenzyme A in which the thiol group is in thioester linkage with an acyl group containing a C=C double bond β to the thioester linkage. Graph 3-enoyl-CoAs 3-enoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_20012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20016 biolink:ChemicalEntity 3-ethylcatechols Any member of the class of catechols that is catechol substituted by an ethyl group at position 3. Graph 3-ethylcatechols 3-ethylcatechols http://purl.obolibrary.org/obo/CHEBI_20016 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2003 biolink:ChemicalEntity 5,6-dihydroxyindole-2-carboxylic acid A dihydroxyindole that is indole-2-carboxylic acid substituted by hydroxy groups at positions 5 and 6. cas:4790-08-3|kegg.compound:C04185|pubmed:25450182|reaxys:168167 Graph 5,6-DHICA|5,6-Dihydroxyindole-2-carboxylate|5,6-dihydroxy-1H-indole-2-carboxylic acid|5,6-dihydroxy-2-indolecarboxylic acid|5,6-dihydroxy-2-indolylcarboxylic acid|DHI2C|DHICA 5,6-dihydroxy-1H-indole-2-carboxylic acid 5,6-DHICA|5,6-Dihydroxyindole-2-carboxylate|5,6-dihydroxy-1H-indole-2-carboxylic acid|5,6-dihydroxy-2-indolecarboxylic acid|5,6-dihydroxy-2-indolylcarboxylic acid|DHI2C|DHICA http://purl.obolibrary.org/obo/CHEBI_2003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20056 biolink:ChemicalEntity 3-hydroxy-L-proline The L-stereoisomer of 3-hydroxyproline. cas:567-36-2 Graph 3-Hydroxyproline|3-hydroxy-L-proline 3-hydroxy-L-proline 3-Hydroxyproline|3-hydroxy-L-proline http://purl.obolibrary.org/obo/CHEBI_20056 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20060 biolink:ChemicalEntity 3-hydroxy fatty acyl-CoA A hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any 3-hydroxy fatty acid. pubmed:12106015|pubmed:1778900|pubmed:20583174|pubmed:20670938|pubmed:20923481|pubmed:21502722|pubmed:7552767 Graph 3-hydroxy fatty acyl CoA|3-hydroxy fatty acyl CoAs|3-hydroxy fatty acyl coenzyme A|3-hydroxy fatty acyl coenzyme As|3-hydroxyacyl-CoAs|beta-hydroxy fatty acyl-CoA|beta-hydroxy fatty acyl-CoAs|beta-hydroxy fatty acyl-coenzyme A|beta-hydroxy fatty acyl-coenzyme As|beta-hydroxyacyl-CoA|beta-hydroxyacyl-CoAs|beta-hydroxyacyl-coenzyme A|beta-hydroxyacyl-coenzyme As 3-hydroxy fatty acyl CoA|3-hydroxy fatty acyl CoAs|3-hydroxy fatty acyl coenzyme A|3-hydroxy fatty acyl coenzyme As|3-hydroxyacyl-CoAs|beta-hydroxy fatty acyl-CoA|beta-hydroxy fatty acyl-CoAs|beta-hydroxy fatty acyl-coenzyme A|beta-hydroxy fatty acyl-coenzyme As|beta-hydroxyacyl-CoA|beta-hydroxyacyl-CoAs|beta-hydroxyacyl-coenzyme A|beta-hydroxyacyl-coenzyme As http://purl.obolibrary.org/obo/CHEBI_20060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20067 biolink:ChemicalEntity 3-hydroxybutyric acid A straight-chain 3-hydroxy monocarboxylic acid comprising a butyric acid core with a single hydroxy substituent in the 3- position; a ketone body whose levels are raised during ketosis, used as an energy source by the brain during fasting in humans. Also used to synthesise biodegradable plastics. cas:300-85-6|hmdb:HMDB0000357|lipidmaps:LMFA01050005|pubmed:10855969|pubmed:17190852|pubmed:17579249|pubmed:6061736|reaxys:773861|wikipedia.en:3-hydroxybutyrate Graph (1)-3-Hydroxybutyric acid|3 HBA|3-Hydroxybuttersaeure|3-OH-butyric acid|3-hydroxybutanoic acid|BHBA|DL-beta-Hydroxybutyric acid|beta-Hydroxy-n-butyric acid|beta-Hydroxybuttersaeure|beta-hydroxy-n-butyric acid|beta-hydroxybutanoic acid|beta-hydroxybutyric acid 3-hydroxybutanoic acid (1)-3-Hydroxybutyric acid|3 HBA|3-Hydroxybuttersaeure|3-OH-butyric acid|3-hydroxybutanoic acid|BHBA|DL-beta-Hydroxybutyric acid|beta-Hydroxy-n-butyric acid|beta-Hydroxybuttersaeure|beta-hydroxy-n-butyric acid|beta-hydroxybutanoic acid|beta-hydroxybutyric acid http://purl.obolibrary.org/obo/CHEBI_20067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20070 biolink:ChemicalEntity 3-hydroxyhexanoate Graph http://purl.obolibrary.org/obo/CHEBI_20070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20106 biolink:ChemicalEntity vanillylmandelic acid An aromatic ether that is the 3-O-methyl ether of 3,4-dihydroxymandelic acid. cas:55-10-7|hmdb:HMDB0000291|kegg.compound:C05584|metacyc.compound:VANILLYL_MANDELATE|pubmed:13756637|pubmed:23112240|pubmed:23399766|pubmed:23830883|pubmed:24327171|reaxys:2213227|wikipedia.en:Vanillylmandelic_acid Graph 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid|3-methoxy-4-hydroxymandelic acid|Vanillylmandelic acid|Vanilmandelic acid|hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid|3-methoxy-4-hydroxymandelic acid|Vanillylmandelic acid|Vanilmandelic acid|hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid http://purl.obolibrary.org/obo/CHEBI_20106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:201376 biolink:ChemicalEntity Desethyl KBT-3022 chemspider:113311|hmdb:HMDB0251035 Graph 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetic acid 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetic acid 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetic acid http://purl.obolibrary.org/obo/CHEBI_201376 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:201396 biolink:ChemicalEntity Milbemycin oxime Graph 6'-ethyl-24-hydroxy-21-hydroxyimino-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one;24-hydroxy-21-hydroxyimino-5',6',11,13,22-pentamethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one 6'-ethyl-24-hydroxy-21-hydroxyimino-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one;24-hydroxy-21-hydroxyimino-5',6',11,13,22-pentamethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one 6'-ethyl-24-hydroxy-21-hydroxyimino-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one;24-hydroxy-21-hydroxyimino-5',6',11,13,22-pentamethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_201396 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:201428 biolink:ChemicalEntity Cecropin A chemspider:17289004 Graph (4S)-5-[[(2S)-6-amino-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-4-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S,3S)-1-[[(2S,3S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[2-[(2S)-2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-5-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoic acid (4S)-5-[[(2S)-6-amino-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-4-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S,3S)-1-[[(2S,3S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[2-[(2S)-2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-5-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoic acid (4S)-5-[[(2S)-6-amino-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-4-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S,3S)-1-[[(2S,3S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[2-[(2S)-2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-5-amino-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoic acid http://purl.obolibrary.org/obo/CHEBI_201428 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:20156 biolink:ChemicalEntity 3-oxo-Delta(1) steroid Any 3-oxo steroid that contains a double bond between positions 1 and 2. kegg.compound:C02941|metacyc.compound:3-Oxo-Delta-1-Steroids Graph 3-keto-Delta(1) steroid|3-keto-Delta(1) steroids|3-oxo Delta(1)-steroid|3-oxo Delta(1)-steroids|3-oxo-Delta(1) steroid|3-oxo-Delta(1) steroids|3-oxo-Delta(1)-steroids|3-oxo-Delta1-steroid|3-oxo-Delta1-steroids|a 3-oxo-Delta(1)-steroid 3-keto-Delta(1) steroid|3-keto-Delta(1) steroids|3-oxo Delta(1)-steroid|3-oxo Delta(1)-steroids|3-oxo-Delta(1) steroid|3-oxo-Delta(1) steroids|3-oxo-Delta(1)-steroids|3-oxo-Delta1-steroid|3-oxo-Delta1-steroids|a 3-oxo-Delta(1)-steroid http://purl.obolibrary.org/obo/CHEBI_20156 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:201674 biolink:ChemicalEntity Icaritin chemspider:4477409|drugbank:DB12672 Graph 3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one 3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one 3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one http://purl.obolibrary.org/obo/CHEBI_201674 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:201779 biolink:ChemicalEntity Nemadectin Graph (6R,24S)-4',21,24-trihydroxy-5',11,13,22-tetramethyl-6'-(4-methylpent-2-en-2-yl)spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (6R,24S)-4',21,24-trihydroxy-5',11,13,22-tetramethyl-6'-(4-methylpent-2-en-2-yl)spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (6R,24S)-4',21,24-trihydroxy-5',11,13,22-tetramethyl-6'-(4-methylpent-2-en-2-yl)spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_201779 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:20265 biolink:ChemicalEntity lanostane beilstein:3137145|cas:474-20-4 Graph (5alpha)-4,4,14-trimethylcholestane|4,4,14-trimethylcholestane|[5S-[5alpha,8beta,9alpha,10beta,13beta,14alpha,17beta(S*)]]-17-(1,5-dimethylhexyl)hexadecahydro-4,4,10,13,14-pentamethyl-1H-cyclopenta[a]phenanthrene|lanostane lanostane (5alpha)-4,4,14-trimethylcholestane|4,4,14-trimethylcholestane|[5S-[5alpha,8beta,9alpha,10beta,13beta,14alpha,17beta(S*)]]-17-(1,5-dimethylhexyl)hexadecahydro-4,4,10,13,14-pentamethyl-1H-cyclopenta[a]phenanthrene|lanostane http://purl.obolibrary.org/obo/CHEBI_20265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:202791 biolink:ChemicalEntity Ankaflavin chemspider:78444976 Graph 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]-3,3a,4,8-tetrahydrouro[3,2-g]isochromene-2,9-dione 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]-3,3a,4,8-tetrahydrouro[3,2-g]isochromene-2,9-dione 9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]-3,3a,4,8-tetrahydrouro[3,2-g]isochromene-2,9-dione http://purl.obolibrary.org/obo/CHEBI_202791 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:202940 biolink:ChemicalEntity carbovir Cyclopent-2-en-1-ylmethanol in which the 4-position is substituted by a 2-amino-6-hydroxy-9H-purin-9-yl group such that the two substitutents on the cyclopentene ring are in a cis relationship. The (−)-enantiomer, also known as carbovir, is a potent inhibitor of HIV replication replication in cell cultures. cas:118353-05-2|pubmed:15916425|pubmed:18549801|pubmed:2296018 Graph (+-)-carbovir|2-amino-9-[rel-(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-1,9-dihydro-6H-purin-6-one|2-amino-9-[rel-(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-9H-purin-6-ol|carbovir|cis-(+-)-2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-6H-purin-6-one|cis-2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-6H-purin-6-one|cis-2-amino-9-(4-hydroxymethylcyclopent-2-enyl)-9H-purin-6-ol 2-amino-9-[rel-(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-1,9-dihydro-6H-purin-6-one (+-)-carbovir|2-amino-9-[rel-(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-1,9-dihydro-6H-purin-6-one|2-amino-9-[rel-(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-9H-purin-6-ol|carbovir|cis-(+-)-2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-6H-purin-6-one|cis-2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-6H-purin-6-one|cis-2-amino-9-(4-hydroxymethylcyclopent-2-enyl)-9H-purin-6-ol http://purl.obolibrary.org/obo/CHEBI_202940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20346 biolink:ChemicalEntity cinnamyl alcohol beta-D-glucoside Graph cinnamyl alcohol beta-D-glucoside|cinnamyl alcohol beta-D-glucosides cinnamyl alcohol beta-D-glucoside|cinnamyl alcohol beta-D-glucosides http://purl.obolibrary.org/obo/CHEBI_20346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:203600 biolink:ChemicalEntity 1D-myo-inositol 1,4,5-trisphosphate(6-) Hexaanion of 1D-myo-inositol 1,4,5-trisphosphate arising from glabal deprotonation of the phosphate OH groups; major species at pH 7.3. beilstein:4303027 Graph 1D-myo-inositol 1,4,5-triphosphate hexaanion|1D-myo-inositol 1,4,5-triphosphate(6-)|1D-myo-inositol 1,4,5-tris(phosphate)|1D-myo-inositol 1,4,5-trisphosphate|1D-myo-inositol 1,4,5-trisphosphate hexaanion 1D-myo-inositol 1,4,5-tris(phosphate) 1D-myo-inositol 1,4,5-triphosphate hexaanion|1D-myo-inositol 1,4,5-triphosphate(6-)|1D-myo-inositol 1,4,5-tris(phosphate)|1D-myo-inositol 1,4,5-trisphosphate|1D-myo-inositol 1,4,5-trisphosphate hexaanion http://purl.obolibrary.org/obo/CHEBI_203600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20361 biolink:ChemicalEntity (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfate Graph (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfates|4-deoxygluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine sulfates (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfates|4-deoxygluc-4-enuronosyl-(1,3)-N-acetyl-D-galactosamine sulfates http://purl.obolibrary.org/obo/CHEBI_20361 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2038 biolink:ChemicalEntity 5-azacytidine An N-glycosyl-1,3,5-triazine that is 4-amino-1,3,5-triazin-2(1H)-one substituted by a β-D-ribofuranosyl residue via an N-glycosidic linkage. An antineoplastic agent, it is used in the treatment of myeloid leukaemia. cas:320-67-2|drugbank:DB00928|drugcentral:25|hmdb:HMDB0015063|kegg.compound:C11262|kegg.drug:D03021|lincs.smallmolecule:LSM-5218|patent:KR20140069225|patent:US2015038444|pubmed:11841042|pubmed:15962522|pubmed:17611569|pubmed:28131982|pubmed:28415666|pubmed:28486212|pubmed:29438107|reaxys:620461|wikipedia.en:Azacitidine Graph 4-Amino-1-beta-D-ribofuranosyl-s-triazin-2(1H)-one|4-amino-1-beta-D-ribofuranosyl-1,3,5-triazin-2(1H)-one|5-Azacytidine|5-azacytidine|Azacitidine|azacitidina|azacitidinum 4-amino-1-beta-D-ribofuranosyl-1,3,5-triazin-2(1H)-one|5-azacytidine 4-Amino-1-beta-D-ribofuranosyl-s-triazin-2(1H)-one|4-amino-1-beta-D-ribofuranosyl-1,3,5-triazin-2(1H)-one|5-Azacytidine|5-azacytidine|Azacitidine|azacitidina|azacitidinum http://purl.obolibrary.org/obo/CHEBI_2038 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20391 biolink:ChemicalEntity 4-hydroxy-L-lysine A hydroxy-L-lysine that is L-lysine carrying a hydroxy substituent at position 4. Graph http://purl.obolibrary.org/obo/CHEBI_20391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20392 biolink:ChemicalEntity 4-hydroxyproline A monohydroxyproline where the hydroxy group is located at the 4-position. It is found in fibrillar collagen. pubmed:21988268|pubmed:24563386|pubmed:24695516|pubmed:436278|wikipedia.en:Hydroxyproline Graph 4-hydroxyproline|4Hyp 4-hydroxyproline 4-hydroxyproline|4Hyp http://purl.obolibrary.org/obo/CHEBI_20392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20432 biolink:ChemicalEntity imidazolone Graph imidazolones imidazolones http://purl.obolibrary.org/obo/CHEBI_20432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20441 biolink:ChemicalEntity 4-(methylamino)butyrate An aza fatty acid anion and the conjugate base of 4-(methylamino)butyric acid. cas:1119-48-8|umbbd.compound:c0474 Graph 4-(N-methylamino)butyric acid|4-(methylamino)butanoate|4-methylaminobutyrate|gamma-methylaminobutyrate 4-(methylamino)butanoate 4-(N-methylamino)butyric acid|4-(methylamino)butanoate|4-methylaminobutyrate|gamma-methylaminobutyrate http://purl.obolibrary.org/obo/CHEBI_20441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:204734 biolink:ChemicalEntity desonide Triamcinolone acetonide with hydrogen instead of the fluorine substituent at position 9. A corticosteroid anti-inflammatory, it is used topically as a cream, ointment or lotion for the treatment of various skin disorders. beilstein:56987|cas:638-94-8|drugbank:DB01260|drugcentral:3135|kegg.drug:D03696|patent:US2990401|patent:US3536586|patent:US3549498|pubmed:3783574|pubmed:6827553|wikipedia.en:Desonide Graph (4aR,4bS,5S,6aS,6bS,9aR,10aS,10bS)-5-hydroxy-6b-(hydroxyacetyl)-4a,6a,8,8-tetramethyl-4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-dodecahydro-2H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-2-one|11beta,21-dihydroxy-16alpha,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione|11beta,21-dihydroxy-16alpha,17-isopropylidenedioxypregna-1,4-diene-3,20-dione|11beta,21-dihydroxy-16alpha,17alpha-isopropylidenedioxypregna-1,4-diene-3,20-dione|16alpha,17alpha-isopropylidenedioxyprednisolone|16alpha-hydroxyprednisole-16,17-acetonide|16alpha-hydroxyprednisolone-16alpha,17-acetonide|desfluorotriamcinolone acetonide|desonida|desonide|desonidum (4aR,4bS,5S,6aS,6bS,9aR,10aS,10bS)-5-hydroxy-6b-(hydroxyacetyl)-4a,6a,8,8-tetramethyl-4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-dodecahydro-2H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-2-one (4aR,4bS,5S,6aS,6bS,9aR,10aS,10bS)-5-hydroxy-6b-(hydroxyacetyl)-4a,6a,8,8-tetramethyl-4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-dodecahydro-2H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-2-one|11beta,21-dihydroxy-16alpha,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione|11beta,21-dihydroxy-16alpha,17-isopropylidenedioxypregna-1,4-diene-3,20-dione|11beta,21-dihydroxy-16alpha,17alpha-isopropylidenedioxypregna-1,4-diene-3,20-dione|16alpha,17alpha-isopropylidenedioxyprednisolone|16alpha-hydroxyprednisole-16,17-acetonide|16alpha-hydroxyprednisolone-16alpha,17-acetonide|desfluorotriamcinolone acetonide|desonida|desonide|desonidum http://purl.obolibrary.org/obo/CHEBI_204734 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:204745 biolink:ChemicalEntity Versicolin chemspider:170651 Graph 3-methylbenzene-1,2,4-triol 3-methylbenzene-1,2,4-triol 3-methylbenzene-1,2,4-triol http://purl.obolibrary.org/obo/CHEBI_204745 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:20476 biolink:ChemicalEntity 4-sulfonatobenzoate(2-) A doubly-charged sulfonatobenzoate consisting of benzoate having a sufonato group at the 4-position. kegg.compound:C02236|umbbd.compound:c0304 Graph (-)O3S-C6H4-COO(-)|4-sulfobenzoate|4-sulfonatobenzoate|4-sulphonatobenzoate 4-sulfonatobenzoate (-)O3S-C6H4-COO(-)|4-sulfobenzoate|4-sulfonatobenzoate|4-sulphonatobenzoate http://purl.obolibrary.org/obo/CHEBI_20476 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20479 biolink:ChemicalEntity (5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate umbbd.compound:c0553 Graph (5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate|4-carboxymethyl-4-sulfobut-2-en-4-olide|4-sulfolactone|4-sulfomuconolactone (5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate (5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate|4-carboxymethyl-4-sulfobut-2-en-4-olide|4-sulfolactone|4-sulfomuconolactone http://purl.obolibrary.org/obo/CHEBI_20479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:204847 biolink:ChemicalEntity Eurystatin A chemspider:8131043 Graph (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]hept-2-enamide (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]hept-2-enamide (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]hept-2-enamide http://purl.obolibrary.org/obo/CHEBI_204847 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:20485 biolink:ChemicalEntity 4-pyridones Any pyridone that is pyridin-4-one or its derivatives by substitution of one of more of the hydrogens. Graph 4H-pyrid-4-ones|pyridin-4-ones 4H-pyrid-4-ones|pyridin-4-ones http://purl.obolibrary.org/obo/CHEBI_20485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:204928 biolink:ChemicalEntity cefotaxime A cephalosporin compound having acetoxymethyl and [2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino side groups. beilstein:1096643|cas:63527-52-6|drugbank:DB00493|drugcentral:546|kegg.compound:C06885|kegg.drug:D07647|patent:DE2556736|patent:DE2702501|patent:US4098888|patent:US4152432|pdb-ccd:CE3|pubmed:10866367|pubmed:11034276|pubmed:11061623|pubmed:11677129|pubmed:12833570|pubmed:1384868|pubmed:14512220|pubmed:1502708|pubmed:15164972|pubmed:15361989|pubmed:15969234|pubmed:1635063|pubmed:17006042|pubmed:17386217|pubmed:18611527|pubmed:19741292|pubmed:21425867|pubmed:24038683|pubmed:24211456|pubmed:29017833|pubmed:9131470|reaxys:1096643|wikipedia.en:Cefotaxime Graph (6R,7R)-3-(acetoxymethyl)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7R)-3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(Z)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7R,Z)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-(acetoxymethyl)-7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3,4-didehydrocepham-4-carboxylic acid|Cephotaxime|cefotaxima|cefotaxime|cefotaximum 3-(acetoxymethyl)-7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3,4-didehydrocepham-4-carboxylic acid (6R,7R)-3-(acetoxymethyl)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7R)-3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(Z)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7R,Z)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-(acetoxymethyl)-7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3,4-didehydrocepham-4-carboxylic acid|Cephotaxime|cefotaxima|cefotaxime|cefotaximum http://purl.obolibrary.org/obo/CHEBI_204928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20502 biolink:ChemicalEntity 5,10-methylenetetrahydrofolic acid beilstein:72305 Graph N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid N-{4-[3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]benzoyl}-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_20502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20506 biolink:ChemicalEntity 5,6,7,8-tetrahydrofolic acid beilstein:101189|cas:135-16-0|drugbank:DB00116|kegg.compound:C00101|knapsack:C00007249 Graph (6S)-THFA|(6S)-Tetrahydrofolate|(6S)-Tetrahydrofolic acid|5,6,7,8-Tetrahydrofolate|5,6,7,8-tetrahydrofolic acid|N-[4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl]-L-glutamic acid|THF|Tetrahydrofolic acid|tetrahydrofolate|tetrahydrofolic acid N-[4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl]-L-glutamic acid (6S)-THFA|(6S)-Tetrahydrofolate|(6S)-Tetrahydrofolic acid|5,6,7,8-Tetrahydrofolate|5,6,7,8-tetrahydrofolic acid|N-[4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}benzoyl]-L-glutamic acid|THF|Tetrahydrofolic acid|tetrahydrofolate|tetrahydrofolic acid http://purl.obolibrary.org/obo/CHEBI_20506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20515 biolink:ChemicalEntity 5,6-dioxidoindole-2-carboxylate gmelin:2470948 Graph 5,6-dioxido-1H-indole-2-carboxylate 5,6-dioxido-1H-indole-2-carboxylate 5,6-dioxido-1H-indole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_20515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20551 biolink:ChemicalEntity mesalaminate(1-) A hydroxybenzoate that is the conjugate base of mesalamine, arising from deprotonation of the carboxy group. reaxys:8144503|umbbd.compound:c0732 Graph 5-amino-2-hydroxybenzoate|5-aminosalicylate|5-aminosalicylate anion|5-aminosalicylate(1-)|mesalaminate|mesalaminate anion 5-amino-2-hydroxybenzoate 5-amino-2-hydroxybenzoate|5-aminosalicylate|5-aminosalicylate anion|5-aminosalicylate(1-)|mesalaminate|mesalaminate anion http://purl.obolibrary.org/obo/CHEBI_20551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:205528 biolink:ChemicalEntity isosilybin A chemspider:9235077|knapsack:C00039453|lipidmaps:LMPK12140713|pubmed:16631762|pubmed:17389612|pubmed:17764149|pubmed:20721970|pubmed:23116206|pubmed:23461697|pubmed:24456525|pubmed:24597776|pubmed:34318464 Graph (+)-isosilybin A|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-1-benzopyran-4-one|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one (+)-isosilybin A|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-1-benzopyran-4-one|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one|(2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one http://purl.obolibrary.org/obo/CHEBI_205528 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:20569 biolink:ChemicalEntity EC 2.5.1.19 (3-phosphoshikimate 1-carboxyvinyltransferase) inhibitor An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of 3-phosphoshikimate 1-carboxyvinyltransferase (EC 2.5.1.19). Graph 3-enol-pyruvoylshikimate-5-phosphate synthase inhibitor|3-enol-pyruvoylshikimate-5-phosphate synthase inhibitors|3-phosphoshikimate 1-carboxyvinyltransferase (EC 2.5.1.19) inhibitor|3-phosphoshikimate 1-carboxyvinyltransferase (EC 2.5.1.19) inhibitors|3-phosphoshikimate 1-carboxyvinyltransferase inhibitor|3-phosphoshikimate 1-carboxyvinyltransferase inhibitors|5-enolpyruvylshikimate-3-phosphate synthase inhibitor|5-enolpyruvylshikimate-3-phosphate synthase inhibitors|EC 2.5.1.19 (3-phosphoshikimate 1-carboxyvinyltransferase) inhibitors|EC 2.5.1.19 inhibitor|EC 2.5.1.19 inhibitors|EPSP synthase inhibitor|EPSP synthase inhibitors|phosphoenolpyruvate:3-phosphoshikimate 5-O-(1-carboxyvinyl)-transferase inhibitor|phosphoenolpyruvate:3-phosphoshikimate 5-O-(1-carboxyvinyl)-transferase inhibitors 3-enol-pyruvoylshikimate-5-phosphate synthase inhibitor|3-enol-pyruvoylshikimate-5-phosphate synthase inhibitors|3-phosphoshikimate 1-carboxyvinyltransferase (EC 2.5.1.19) inhibitor|3-phosphoshikimate 1-carboxyvinyltransferase (EC 2.5.1.19) inhibitors|3-phosphoshikimate 1-carboxyvinyltransferase inhibitor|3-phosphoshikimate 1-carboxyvinyltransferase inhibitors|5-enolpyruvylshikimate-3-phosphate synthase inhibitor|5-enolpyruvylshikimate-3-phosphate synthase inhibitors|EC 2.5.1.19 (3-phosphoshikimate 1-carboxyvinyltransferase) inhibitors|EC 2.5.1.19 inhibitor|EC 2.5.1.19 inhibitors|EPSP synthase inhibitor|EPSP synthase inhibitors|phosphoenolpyruvate:3-phosphoshikimate 5-O-(1-carboxyvinyl)-transferase inhibitor|phosphoenolpyruvate:3-phosphoshikimate 5-O-(1-carboxyvinyl)-transferase inhibitors http://purl.obolibrary.org/obo/CHEBI_20569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20570 biolink:ChemicalEntity 5-hydroxycamphor A cyclic monoterpene ketone that is camphor bearing a hydroxy substituent at position 5. kegg.compound:C03448|reaxys:3197243 Graph 5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|5-hydroxybornan-2-one 5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|5-hydroxybornan-2-one 5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one|5-hydroxybornan-2-one http://purl.obolibrary.org/obo/CHEBI_20570 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:205919 biolink:ChemicalEntity clobetasol A 3-oxo-Δ1,Δ4-steroid that is 16β-methylpregna-1,4-diene-3,20-dione bearing hydroxy groups at the 11β and 17α positions, fluorine at position 9, and a chlorine substituent at position 21. It is used as its 17α-propionate ester to treat various skin disorders, including exzema and psoriasis. beilstein:6748271|cas:25122-41-2|drugbank:DB01013|kegg.drug:D07715|patent:DE1902340|patent:US3721687|pubmed:26658258|pubmed:27012570 Graph (11beta,16beta)-21-chloro-9-fluoro-11,17-dihydroxy-16-methylpregna-1,4-diene-3,20-dione|21-chloro-9-fluoro-11beta,17-dihydroxy-16beta-methylpregna-1,4-diene-3,20-dione|clobetasol|clobetasolum 21-chloro-9-fluoro-11beta,17-dihydroxy-16beta-methylpregna-1,4-diene-3,20-dione (11beta,16beta)-21-chloro-9-fluoro-11,17-dihydroxy-16-methylpregna-1,4-diene-3,20-dione|21-chloro-9-fluoro-11beta,17-dihydroxy-16beta-methylpregna-1,4-diene-3,20-dione|clobetasol|clobetasolum http://purl.obolibrary.org/obo/CHEBI_205919 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20607 biolink:ChemicalEntity 5-methylcytidine beilstein:89657|cas:2140-61-6 Graph http://purl.obolibrary.org/obo/CHEBI_20607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20612 biolink:ChemicalEntity 5-methyltetrahydrofolate A group of heterocyclic compounds based on the 5-methyl-5,6,7,8-tetrahydropteroic acid skeleton conjugated with one or more L-glutamic acid or L-glutamate units. Graph 5-methyltetrahydrofolates 5-methyltetrahydrofolates http://purl.obolibrary.org/obo/CHEBI_20612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20629 biolink:ChemicalEntity 5-phosphoribosyl-ATP Graph (5-phosphoribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate)|5-phosphoribosyl-ATPs (5-phosphoribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate) (5-phosphoribofuranosyl)adenosine 5'-(tetrahydrogen triphosphate)|5-phosphoribosyl-ATPs http://purl.obolibrary.org/obo/CHEBI_20629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20642 biolink:ChemicalEntity 5alpha-cholane beilstein:2048471 Graph 5alpha-cholane 5alpha-cholane 5alpha-cholane http://purl.obolibrary.org/obo/CHEBI_20642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20652 biolink:ChemicalEntity 5alpha-ergostane beilstein:3203417|cas:511-20-6 Graph 5alpha-ergostane|ergostane 5alpha-ergostane 5alpha-ergostane|ergostane http://purl.obolibrary.org/obo/CHEBI_20652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20656 biolink:ChemicalEntity 5alpha-pregnane beilstein:2502007|cas:641-85-0 Graph 5alpha-pregnane|allopregnane 5alpha-pregnane 5alpha-pregnane|allopregnane http://purl.obolibrary.org/obo/CHEBI_20656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20659 biolink:ChemicalEntity 5beta-androstane The 5β-stereoisomer of androstane. reaxys:2500892 Graph 5beta-androstane 5beta-androstane 5beta-androstane http://purl.obolibrary.org/obo/CHEBI_20659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20664 biolink:ChemicalEntity 5beta-cholane beilstein:2048472 Graph 5beta-cholane 5beta-cholane 5beta-cholane http://purl.obolibrary.org/obo/CHEBI_20664 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20674 biolink:ChemicalEntity 5beta-pregnane beilstein:2502008|cas:481-26-5|kegg.compound:C01523 Graph 5beta-pregnane 5beta-pregnane 5beta-pregnane http://purl.obolibrary.org/obo/CHEBI_20674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20680 biolink:ChemicalEntity 6,7-dihydrobiopterin Graph 2-amino-6-(1,2-dihydroxypropyl)-7,8-dihydropteridin-4(6H)-one|6,7-Dihydrobiopterin|6,7-dihydrobiopterin|Dihydrobiopterin|Quinoid-dihydrobiopterin|q-dihydrobiopterin|quinoid-dihydrobiopterin 2-amino-6-(1,2-dihydroxypropyl)-7,8-dihydropteridin-4(6H)-one 2-amino-6-(1,2-dihydroxypropyl)-7,8-dihydropteridin-4(6H)-one|6,7-Dihydrobiopterin|6,7-dihydrobiopterin|Dihydrobiopterin|Quinoid-dihydrobiopterin|q-dihydrobiopterin|quinoid-dihydrobiopterin http://purl.obolibrary.org/obo/CHEBI_20680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20702 biolink:ChemicalEntity 2-aminopurines Any aminopurine having the amino substituent at the 2-position. Graph 2-aminopurines 2-aminopurines http://purl.obolibrary.org/obo/CHEBI_20702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20706 biolink:ChemicalEntity 6-aminopurines Any compound having 6-aminopurine (adenine) as part of its structure. pubmed:1646334|pubmed:18524423|pubmed:7342604 Graph 6-aminopurines 6-aminopurines http://purl.obolibrary.org/obo/CHEBI_20706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:207229 biolink:ChemicalEntity dihydroartemisinin A sesquiterpenoid compound which is used as a drug for treatment of malaria. beilstein:4185848|pubmed:10893313|pubmed:3669021 Graph (3R,5aS,6R,8aS,9R,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10-ol|1,5,9-trimethyl-(1R,4S,5R,8S,9R,10S,12R,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-ol(Dihydroartemisinin) (3R,5aS,6R,8aS,9R,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10-ol (3R,5aS,6R,8aS,9R,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10-ol|1,5,9-trimethyl-(1R,4S,5R,8S,9R,10S,12R,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-ol(Dihydroartemisinin) http://purl.obolibrary.org/obo/CHEBI_207229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20725 biolink:ChemicalEntity 6-hydroxydopa cas:21373-30-8 Graph 2,4,5-trihydroxyphenylalanine|2,5-dihydroxytyrosine|2-amino-3-(2,4,5-trihydroxyphenyl)propanoic acid|3,4,6-topa|3,4,6-trihydroxyphenylalanine|6-OHdopa 2-amino-3-(2,4,5-trihydroxyphenyl)propanoic acid 2,4,5-trihydroxyphenylalanine|2,5-dihydroxytyrosine|2-amino-3-(2,4,5-trihydroxyphenyl)propanoic acid|3,4,6-topa|3,4,6-trihydroxyphenylalanine|6-OHdopa http://purl.obolibrary.org/obo/CHEBI_20725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20750 biolink:ChemicalEntity 6-phospho-2-dehydro-D-gluconate(3-) beilstein:6609981 Graph 6-O-phosphonato-D-arabino-hex-2-ulosonate|6-O-phosphonato-D-fructosonate|6-phospho-2-dehydro-D-gluconate 6-O-phosphonato-D-arabino-hex-2-ulosonate 6-O-phosphonato-D-arabino-hex-2-ulosonate|6-O-phosphonato-D-fructosonate|6-phospho-2-dehydro-D-gluconate http://purl.obolibrary.org/obo/CHEBI_20750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20794 biolink:ChemicalEntity 7-methylguanosine A positively charged methylguanosine in which a single methyl substituent is located at position 7. cas:20244-86-4|drugbank:DB03493|hmdb:HMDB0001107|metacyc.compound:CPD0-1041|pdb-ccd:MG7|pubmed:22770225|reaxys:3631436|wikipedia.en:7-Methylguanosine Graph 2-amino-9-(beta-D-ribofuranosyl)-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|7-methylguanosine|G|N(7)-methylguanosine|m7g 2-amino-9-(beta-D-ribofuranosyl)-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|7-methylguanosine 2-amino-9-(beta-D-ribofuranosyl)-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-6-oxo-6,9-dihydro-1H-purin-7-ium|7-methylguanosine|G|N(7)-methylguanosine|m7g http://purl.obolibrary.org/obo/CHEBI_20794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20805 biolink:ChemicalEntity (+)-8'-hydroxyabscisic acid The 8'-hydroxylated derivative of (+)-abscisic acid. kegg.compound:C15514 Graph (2Z,4E)-5-[(1R,6R)-1-hydroxy-6-(hydroxymethyl)-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid (2Z,4E)-5-[(1R,6R)-1-hydroxy-6-(hydroxymethyl)-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid (2Z,4E)-5-[(1R,6R)-1-hydroxy-6-(hydroxymethyl)-2,6-dimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid http://purl.obolibrary.org/obo/CHEBI_20805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20814 biolink:ChemicalEntity phenanthrene-9,10-diol beilstein:2370333|cas:604-84-2|umbbd.compound:c0541 Graph 9,10-dihydroxyphenanthrene|9,10-phenanthrenediol|phenanthrene-9,10-diol phenanthrene-9,10-diol 9,10-dihydroxyphenanthrene|9,10-phenanthrenediol|phenanthrene-9,10-diol http://purl.obolibrary.org/obo/CHEBI_20814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20847 biolink:ChemicalEntity ADP-glycero-D-manno-heptose Graph adenine 5'-[3-(glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] adenine 5'-[3-(glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] adenine 5'-[3-(glycero-D-manno-heptopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_20847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20853 biolink:ChemicalEntity AMP-sugar Graph AMP-sugar|AMP-sugars AMP-sugar|AMP-sugars http://purl.obolibrary.org/obo/CHEBI_20853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20854 biolink:ChemicalEntity ATP synthase inhibitor A mitochondrial respiratory-chain inhibitor that interferes with the action of ATP synthase. Graph http://purl.obolibrary.org/obo/CHEBI_20854 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20855 biolink:ChemicalEntity ATP-sugar Graph ATP-sugar|ATP-sugars ATP-sugar|ATP-sugars http://purl.obolibrary.org/obo/CHEBI_20855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20857 biolink:ChemicalEntity C-glycosyl compound A glycosyl compound arising formally from the elimination of water from a glycosidic hydroxy group and an H atom bound to a carbon atom, thus creating a C-C bond. Graph C-glycoside|C-glycosides|C-glycosyl compounds C-glycoside|C-glycosides|C-glycosyl compounds http://purl.obolibrary.org/obo/CHEBI_20857 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20858 biolink:ChemicalEntity C19-gibberellin Graph C19-gibberellins C19-gibberellins http://purl.obolibrary.org/obo/CHEBI_20858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20859 biolink:ChemicalEntity C20-gibberellin Graph C20-gibberellins C20-gibberellins http://purl.obolibrary.org/obo/CHEBI_20859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20873 biolink:ChemicalEntity CDP-sugar A pyrimidine nucleotide-sugar having CDP as the nucleotide component attached to an unspecified sugar via an anomeric diphosphate linkage. Graph CDP-sugar|CDP-sugars CDP-sugar|CDP-sugars http://purl.obolibrary.org/obo/CHEBI_20873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20878 biolink:ChemicalEntity CMP-sugar A pyrimidine nucleotide-sugar having CMP as the nucleotide component attached to an unspecified sugar via an anomeric diphosphate linkage. Graph CMP-sugar|CMP-sugars CMP-sugar|CMP-sugars http://purl.obolibrary.org/obo/CHEBI_20878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20891 biolink:ChemicalEntity (R)-4'-phosphopantothenate(2-) beilstein:9284851 Graph 3-[(2R)-2-hydroxy-4-[(hydroxyphosphinato)oxy]-3,3-dimethylbutanamido]propanoate 3-[(2R)-2-hydroxy-4-[(hydroxyphosphinato)oxy]-3,3-dimethylbutanamido]propanoate 3-[(2R)-2-hydroxy-4-[(hydroxyphosphinato)oxy]-3,3-dimethylbutanamido]propanoate http://purl.obolibrary.org/obo/CHEBI_20891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20899 biolink:ChemicalEntity D-alloisoleucine beilstein:1721794|cas:1509-35-9|gmelin:1317451 Graph (2R,3S)-2-amino-3-methylpentanoic acid|D-alloisoleucine|allo-D-isoleucine D-alloisoleucine (2R,3S)-2-amino-3-methylpentanoic acid|D-alloisoleucine|allo-D-isoleucine http://purl.obolibrary.org/obo/CHEBI_20899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20902 biolink:ChemicalEntity allose phosphate Graph allose phosphate|allose phosphates allose phosphate|allose phosphates http://purl.obolibrary.org/obo/CHEBI_20902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20912 biolink:ChemicalEntity D-arabinonic acid beilstein:1724262|cas:488-30-2 Graph D-Arabonic acid D-Arabonic acid http://purl.obolibrary.org/obo/CHEBI_20912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20937 biolink:ChemicalEntity D-fructuronic acid Graph D-fructuronic acid|D-lyxo-hex-5-ulosonic acid D-fructuronic acid|D-lyxo-hex-5-ulosonic acid D-fructuronic acid|D-lyxo-hex-5-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_20937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20954 biolink:ChemicalEntity D-galactosaminide Graph D-galactosaminide|D-galactosaminides D-galactosaminide|D-galactosaminides http://purl.obolibrary.org/obo/CHEBI_20954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20960 biolink:ChemicalEntity galactose phosphate Graph galactose phosphate|galactose phosphates galactose phosphate|galactose phosphates http://purl.obolibrary.org/obo/CHEBI_20960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20961 biolink:ChemicalEntity D-galactoside Graph D-galactoside|D-galactosides D-galactoside|D-galactosides http://purl.obolibrary.org/obo/CHEBI_20961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:209807 biolink:ChemicalEntity cefoxitin A semisynthetic cephamycin antibiotic which, in addition to the methoxy group at the 7α position, has 2-thienylacetamido and carbamoyloxymethyl side-groups. It is resistant to β-lactamase. beilstein:4216947|cas:35607-66-0|drugbank:DB01331|drugcentral:550|hmdb:HMDB0015426|kegg.compound:C06887|kegg.drug:D02345|lincs.smallmolecule:LSM-5786|patent:DE2129675|patent:DE2203653|patent:US4297488|pdb-ccd:CFX|pubmed:12569987|pubmed:17043131|pubmed:17178800|pubmed:17220412|pubmed:17353248|pubmed:17387156|pubmed:17923492|pubmed:18056283|pubmed:18070972|pubmed:2083978|pubmed:29017833|pubmed:8360877|reaxys:4216947|wikipedia.en:Cefoxitin Graph (6R,7S)-3-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7S)-4-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[(thiophen-2-enyl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-[(carbamoyloxy)methyl]-7alpha-methoxy-7beta-[(thiophen-2-yl)acetamido]-3,4-didehydrocepham-4-carboxylic acid|CFX|Cefoxitin|Cephoxitin|Rephoxitin|cefoxitin|cefoxitina|cefoxitine|cefoxitinum|ceftoxitin (6R,7S)-4-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[(thiophen-2-enyl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-[(carbamoyloxy)methyl]-7alpha-methoxy-7beta-[(thiophen-2-yl)acetamido]-3,4-didehydrocepham-4-carboxylic acid (6R,7S)-3-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R,7S)-4-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[(thiophen-2-enyl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-[(carbamoyloxy)methyl]-7alpha-methoxy-7beta-[(thiophen-2-yl)acetamido]-3,4-didehydrocepham-4-carboxylic acid|CFX|Cefoxitin|Cephoxitin|Rephoxitin|cefoxitin|cefoxitina|cefoxitine|cefoxitinum|ceftoxitin http://purl.obolibrary.org/obo/CHEBI_209807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:20984 biolink:ChemicalEntity D-gluconate adduct Graph D-gluconate adduct|D-gluconate adducts D-gluconate adduct|D-gluconate adducts http://purl.obolibrary.org/obo/CHEBI_20984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21005 biolink:ChemicalEntity D-glucose bisphosphate Graph D-glucose bisphosphate|D-glucose bisphosphates D-glucose bisphosphate|D-glucose bisphosphates http://purl.obolibrary.org/obo/CHEBI_21005 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21006 biolink:ChemicalEntity D-glucose monophosphate Graph D-glucose monophosphate|D-glucose monophosphates D-glucose monophosphate|D-glucose monophosphates http://purl.obolibrary.org/obo/CHEBI_21006 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21008 biolink:ChemicalEntity glucose phosphate Graph glucose phosphates glucose phosphates http://purl.obolibrary.org/obo/CHEBI_21008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21010 biolink:ChemicalEntity D-glucosyl-D-mannose A glycosylmannose with both components having D-configuration. Graph http://purl.obolibrary.org/obo/CHEBI_21010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21037 biolink:ChemicalEntity aldohexose phosphate Graph aldohexose phosphate|aldohexose phosphates aldohexose phosphate|aldohexose phosphates http://purl.obolibrary.org/obo/CHEBI_21037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21054 biolink:ChemicalEntity mannonic acid A hexonic acid involved in the glucuronate metabolism. pubmed:15358357|pubmed:23314367|pubmed:863980 Graph http://purl.obolibrary.org/obo/CHEBI_21054 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21060 biolink:ChemicalEntity mannose phosphate Graph mannose phosphates mannose phosphates http://purl.obolibrary.org/obo/CHEBI_21060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21077 biolink:ChemicalEntity D-ribonic acid The D-enantiomer ribonic acid. hmdb:HMDB0000867|kegg.compound:C01685|pubmed:22770225|reaxys:1724264 Graph (2R,3R,4R)-2,3,4,5-tetrahydroxypentanoic acid|D-Ribonic acid|D-ribonic acid (2R,3R,4R)-2,3,4,5-tetrahydroxypentanoic acid|D-ribonic acid (2R,3R,4R)-2,3,4,5-tetrahydroxypentanoic acid|D-Ribonic acid|D-ribonic acid http://purl.obolibrary.org/obo/CHEBI_21077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21080 biolink:ChemicalEntity ribose diphosphate Graph ribose diphosphate|ribose diphosphates ribose diphosphate|ribose diphosphates http://purl.obolibrary.org/obo/CHEBI_21080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:210866 biolink:ChemicalEntity Antrocin chemspider:78444664 Graph 7,7-dimethyl-4-methylidene-3,3a,5,6,6a,8,9,10-octahydrobenzo[h][2]benzouran-1-one 7,7-dimethyl-4-methylidene-3,3a,5,6,6a,8,9,10-octahydrobenzo[h][2]benzouran-1-one 7,7-dimethyl-4-methylidene-3,3a,5,6,6a,8,9,10-octahydrobenzo[h][2]benzouran-1-one http://purl.obolibrary.org/obo/CHEBI_210866 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21099 biolink:ChemicalEntity D-tagaturonic acid Graph D-arabino-hex-5-ulosonic acid D-arabino-hex-5-ulosonic acid D-arabino-hex-5-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_21099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21100 biolink:ChemicalEntity D-altrarate(1-) An altrarate(1−) that is the conjugate base of D-altraric acid. Graph D-talarate|hydrogen D-altrarate hydrogen D-altrarate D-talarate|hydrogen D-altrarate http://purl.obolibrary.org/obo/CHEBI_21100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21101 biolink:ChemicalEntity D-altraric acid The D-enantiomer of altraric acid. reaxys:1728115 Graph (2S,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid|D-altraric acid|D-talaric acid D-altraric acid (2S,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid|D-altraric acid|D-talaric acid http://purl.obolibrary.org/obo/CHEBI_21101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21137 biolink:ChemicalEntity tri-mu-sulfido-mu3-sulfido-triiron pdb-ccd:F3S Graph FE3-S4 CLUSTER|[3Fe-4S] cluster|[Fe3S4]|[Fe3S4] cluster|tri-mu-sulfido-mu3-sulfido-triiron tri-mu-sulfido-mu3-sulfido-triiron FE3-S4 CLUSTER|[3Fe-4S] cluster|[Fe3S4]|[Fe3S4] cluster|tri-mu-sulfido-mu3-sulfido-triiron http://purl.obolibrary.org/obo/CHEBI_21137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21161 biolink:ChemicalEntity GDP-D-mannuronic acid A GDP-sugar having D-mannuronic acid as the sugar component. metacyc.compound:CPD-1828 Graph guanosine 5'-[3-(D-mannopyranosyluronic acid) dihydrogen diphosphate] guanosine 5'-[3-(D-mannopyranosyluronic acid) dihydrogen diphosphate] guanosine 5'-[3-(D-mannopyranosyluronic acid) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_21161 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21165 biolink:ChemicalEntity GDP-alpha-D-mannosylchitobiosyldiphosphodolichol Graph GDP-alpha-D-mannosylchitobiosyldiphosphodolichol|GDP-alpha-D-mannosylchitobiosyldiphosphodolichols GDP-alpha-D-mannosylchitobiosyldiphosphodolichol|GDP-alpha-D-mannosylchitobiosyldiphosphodolichols http://purl.obolibrary.org/obo/CHEBI_21165 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:21167 biolink:ChemicalEntity GDP-hexose A GDP-sugar in which the sugar component is a hexosyl residue. Graph GDP-hexose|GDP-hexoses GDP-hexose|GDP-hexoses http://purl.obolibrary.org/obo/CHEBI_21167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21168 biolink:ChemicalEntity GDP-mannose Graph GDP-mannoses GDP-mannoses http://purl.obolibrary.org/obo/CHEBI_21168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21169 biolink:ChemicalEntity GDP-sugar Graph GDP-sugar|GDP-sugars GDP-sugar|GDP-sugars http://purl.obolibrary.org/obo/CHEBI_21169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:211870 biolink:ChemicalEntity Inostamycin Graph (2R)-2-[(2R,3S,4R,5S,6R)-5-ethyl-6-[(2R,3R,4R,6S)-6-[(2S,3S,5S)-5-[(2R,3R,5R)-5-ethyl-2-hydroxy-5-[(1S)-1-hydroxybutyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3,6-dimethyloxan-2-yl]butanoic acid (2R)-2-[(2R,3S,4R,5S,6R)-5-ethyl-6-[(2R,3R,4R,6S)-6-[(2S,3S,5S)-5-[(2R,3R,5R)-5-ethyl-2-hydroxy-5-[(1S)-1-hydroxybutyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3,6-dimethyloxan-2-yl]butanoic acid (2R)-2-[(2R,3S,4R,5S,6R)-5-ethyl-6-[(2R,3R,4R,6S)-6-[(2S,3S,5S)-5-[(2R,3R,5R)-5-ethyl-2-hydroxy-5-[(1S)-1-hydroxybutyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2,4-dihydroxy-3,6-dimethyloxan-2-yl]butanoic acid http://purl.obolibrary.org/obo/CHEBI_211870 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21203 biolink:ChemicalEntity L-2-aminohexanoate An L-α-amino acid anion that is the conjugate base of L-norleucine. gmelin:2380914|kegg.compound:C01933|metacyc.compound:L-2-AMINOHEXANOATE|reaxys:4964325 Graph (2S)-2-aminohexanoate|(S)-2-aminohexanoate|L-2-Aminohexanoate|L-Aminohexanoate|L-norleucinate (2S)-2-aminohexanoate (2S)-2-aminohexanoate|(S)-2-aminohexanoate|L-2-Aminohexanoate|L-Aminohexanoate|L-norleucinate http://purl.obolibrary.org/obo/CHEBI_21203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:212106 biolink:ChemicalEntity Secomilbemycin D chemspider:78438539 Graph (4E)-6-hydroxy-4-[(2E,4R,6E)-8-[(2R,4S,6R,8R,9S)-4-hydroxy-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]-4,6-dimethylocta-2,6-dienylidene]-7-methylisochromen-1-one (4E)-6-hydroxy-4-[(2E,4R,6E)-8-[(2R,4S,6R,8R,9S)-4-hydroxy-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]-4,6-dimethylocta-2,6-dienylidene]-7-methylisochromen-1-one (4E)-6-hydroxy-4-[(2E,4R,6E)-8-[(2R,4S,6R,8R,9S)-4-hydroxy-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]-4,6-dimethylocta-2,6-dienylidene]-7-methylisochromen-1-one http://purl.obolibrary.org/obo/CHEBI_212106 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21239 biolink:ChemicalEntity arogenic acid cas:53078-86-7 Graph 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid|alpha-amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid|arogenic acid|pretyrosine 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid|alpha-amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid|arogenic acid|pretyrosine http://purl.obolibrary.org/obo/CHEBI_21239 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21260 biolink:ChemicalEntity cysteic acid An amino sulfonic acid that is the sulfonic acid analogue of cysteine. cas:13100-82-8|ecmdb:ECMDB02757|hmdb:HMDB0002757|pubmed:21876281|pubmed:25156684|pubmed:8283286|reaxys:1725494|wikipedia.en:Cysteic_acid Graph 2-amino-3-sulfopropanoic acid|3-Sulfoalanine|beta-Sulfoalanine|cysteine sulfonic acid 2-amino-3-sulfopropanoic acid 2-amino-3-sulfopropanoic acid|3-Sulfoalanine|beta-Sulfoalanine|cysteine sulfonic acid http://purl.obolibrary.org/obo/CHEBI_21260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:212795 biolink:ChemicalEntity Hispolon chemspider:8257726 Graph (3Z,5E)-6-(3,4-dihydroxyphenyl)-4-hydroxyhexa-3,5-dien-2-one (3Z,5E)-6-(3,4-dihydroxyphenyl)-4-hydroxyhexa-3,5-dien-2-one (3Z,5E)-6-(3,4-dihydroxyphenyl)-4-hydroxyhexa-3,5-dien-2-one http://purl.obolibrary.org/obo/CHEBI_212795 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21282 biolink:ChemicalEntity (3S,5S)-3,5-diaminohexanoate A diamino acid anion that is the conjugate base of (3S,5S)-3,5-diaminohexanoic acid, obtained by deprotonation of the carboxy group. Graph (3S,5S)-3,5-diaminocaproate|(3S,5S)-3,5-diaminohexanoate|L-erythro-3,5-diaminocaproate|L-erythro-3,5-diaminohexanoate (3S,5S)-3,5-diaminohexanoate (3S,5S)-3,5-diaminocaproate|(3S,5S)-3,5-diaminohexanoate|L-erythro-3,5-diaminocaproate|L-erythro-3,5-diaminohexanoate http://purl.obolibrary.org/obo/CHEBI_21282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21288 biolink:ChemicalEntity L-erythrose The L-enantiomer of erythrose. Graph L-(+)-Erythrose|L-erythro-tetrose|L-erythrose L-erythro-tetrose|L-erythrose L-(+)-Erythrose|L-erythro-tetrose|L-erythrose http://purl.obolibrary.org/obo/CHEBI_21288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21291 biolink:ChemicalEntity L-fuconate kegg.compound:C01720 Graph 6-deoxy-L-galactonate|L-Fuconate|L-fuconate 6-deoxy-L-galactonate 6-deoxy-L-galactonate|L-Fuconate|L-fuconate http://purl.obolibrary.org/obo/CHEBI_21291 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21313 biolink:ChemicalEntity L-glutamyl ester Any α-amino acid ester that is the ester of L-glutamic acid. Graph L-glutamyl esters L-glutamyl esters http://purl.obolibrary.org/obo/CHEBI_21313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21314 biolink:ChemicalEntity glutamyl phosphate Graph glutamyl phosphates glutamyl phosphates http://purl.obolibrary.org/obo/CHEBI_21314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21336 biolink:ChemicalEntity L-idonic acid The L-enantiomer of idonic acid. cas:1114-17-6|ecmdb:ECMDB21376|kegg.compound:C00770|pubmed:1182275|pubmed:14973046|reaxys:1726056 Graph L-idonic acid L-idonic acid L-idonic acid http://purl.obolibrary.org/obo/CHEBI_21336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21337 biolink:ChemicalEntity idonic acid Graph L-idonic acids L-idonic acids http://purl.obolibrary.org/obo/CHEBI_21337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21338 biolink:ChemicalEntity aldehydo-L-iduronate An iduronate that is the conjugate base of aldehydo-L-iduronic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. Graph L-iduronate L-iduronate L-iduronate http://purl.obolibrary.org/obo/CHEBI_21338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21347 biolink:ChemicalEntity L-lanthionine The L-enantiomer of lanthionine. agr:IND606859743|cas:922-55-4|chemspider:88959|hmdb:HMDB0240656|metacyc.compound:CPD-3736|pdb-ccd:85F|pubmed:31398016|pubmed:33112129|pubmed:5543047|pubmed:5948138|pubmed:6007887|pubmed:7185053|wikipedia.en:Lanthionine Graph (2R,2'R)-3,3'-sulfanediylbis(2-aminopropanoic acid)|(R)-S-(2-amino-2-carboxyethyl)-L-cysteine|(R,R)-2,6-diamino-4-thiaheptanedioic acid|(R,R)-3,3'-thiobis-(2-aminopropanoic acid)|(R,R)-bis(2-amino-2-carboxyethyl)sulfide|3,3'-thiobis-L-alanine|3,3'-thiodi-L-alanine|L-lanthionine|beta,beta'-thiodi-L-alanine (2R,2'R)-3,3'-sulfanediylbis(2-aminopropanoic acid)|L-lanthionine (2R,2'R)-3,3'-sulfanediylbis(2-aminopropanoic acid)|(R)-S-(2-amino-2-carboxyethyl)-L-cysteine|(R,R)-2,6-diamino-4-thiaheptanedioic acid|(R,R)-3,3'-thiobis-(2-aminopropanoic acid)|(R,R)-bis(2-amino-2-carboxyethyl)sulfide|3,3'-thiobis-L-alanine|3,3'-thiodi-L-alanine|L-lanthionine|beta,beta'-thiodi-L-alanine http://purl.obolibrary.org/obo/CHEBI_21347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21363 biolink:ChemicalEntity L-methionine sulfone An L-methionine derivative in which the sulfur has been oxidised to the corresponding sulfone. cas:7314-32-1|metacyc.compound:CPD-3739|pdb-ccd:OMT|pubmed:18071251|pubmed:20944408|pubmed:939991|reaxys:1725510 Graph (2S)-2-amino-4-(methylsulfonyl)butanoic acid|(S)-Amino-4-(methylsulphonyl)butyric acid|L-2-amino-4-(methylsulfonyl)butanoic acid|L-methionine sulfone|S-DIOXYMETHIONINE|methionine sulfone (2S)-2-amino-4-(methylsulfonyl)butanoic acid (2S)-2-amino-4-(methylsulfonyl)butanoic acid|(S)-Amino-4-(methylsulphonyl)butyric acid|L-2-amino-4-(methylsulfonyl)butanoic acid|L-methionine sulfone|S-DIOXYMETHIONINE|methionine sulfone http://purl.obolibrary.org/obo/CHEBI_21363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21368 biolink:ChemicalEntity L-ornithine derivative An ornithine derivative resulting from reaction of L-ornithine at the amino group, the carboxy group or the side-chain amino group, or from the replacement of any hydrogen of L-ornithine by a heteroatom. Graph L-ornithine derivatives L-ornithine derivatives http://purl.obolibrary.org/obo/CHEBI_21368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21376 biolink:ChemicalEntity rhamnonic acid cas:6422-34-0|kegg.compound:C01934 Graph 6-deoxymannonic acid 6-deoxymannonic acid 6-deoxymannonic acid http://purl.obolibrary.org/obo/CHEBI_21376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:213772 biolink:ChemicalEntity Azinomycin A chemspider:9932912 Graph [2-[[(1E)-1-[(3R,4R,5S)-3-acetyloxy-4-hydroxy-1-azabicyclo[3.1.0]hexan-2-ylidene]-2-oxo-2-(2-oxopropylamino)ethyl]amino]-1-(2-methyloxiran-2-yl)-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate [2-[[(1E)-1-[(3R,4R,5S)-3-acetyloxy-4-hydroxy-1-azabicyclo[3.1.0]hexan-2-ylidene]-2-oxo-2-(2-oxopropylamino)ethyl]amino]-1-(2-methyloxiran-2-yl)-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate [2-[[(1E)-1-[(3R,4R,5S)-3-acetyloxy-4-hydroxy-1-azabicyclo[3.1.0]hexan-2-ylidene]-2-oxo-2-(2-oxopropylamino)ethyl]amino]-1-(2-methyloxiran-2-yl)-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate http://purl.obolibrary.org/obo/CHEBI_213772 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21397 biolink:ChemicalEntity L-altrarate(1-) pubmed:17649980 Graph L-talarate|hydrogen L-altrarate hydrogen L-altrarate L-talarate|hydrogen L-altrarate http://purl.obolibrary.org/obo/CHEBI_21397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21398 biolink:ChemicalEntity L-altraric acid Altraric acid of L-configuration. reaxys:1728118 Graph (2R,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid|L-altraric acid|L-talaric acid L-altraric acid (2R,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid|L-altraric acid|L-talaric acid http://purl.obolibrary.org/obo/CHEBI_21398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21415 biolink:ChemicalEntity L-tyrosyl ester An α-amino acid ester resulting from esterification of the carboxy group of L-tyrosine. pubmed:24667307 Graph L-tyrosine ester|L-tyrosine esters|L-tyrosyl esters L-tyrosine ester|L-tyrosine esters|L-tyrosyl esters http://purl.obolibrary.org/obo/CHEBI_21415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21437 biolink:ChemicalEntity Mo-molybdopterin cofactor A molybdopterin cofactor in which the coordinated metal is a mononuclear molybdenum or molybdate species. cas:73508-07-3|drugbank:DB02137|kegg.compound:C18237 Graph Mo-molybdopterin cofactors|Moco|Molybdenum cofactor|molybdenum cofactor molybdenum cofactor Mo-molybdopterin cofactors|Moco|Molybdenum cofactor|molybdenum cofactor http://purl.obolibrary.org/obo/CHEBI_21437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21494 biolink:ChemicalEntity N-acetoxyarylamine Any arylamine having an acetytoxy group attached to the nitrogen. cas:71825-04-2|kegg.compound:C16684 Graph an N-acetoxyarylamine an N-acetoxyarylamine http://purl.obolibrary.org/obo/CHEBI_21494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21500 biolink:ChemicalEntity N-acetyl-9-O-acetylneuraminic acid cas:55717-54-9|kegg.compound:C04017|pubmed:1321878|pubmed:1413991|pubmed:1571107|pubmed:16311885|pubmed:2385959|pubmed:2611785|pubmed:30612272|pubmed:34393634|pubmed:34874597|pubmed:3497642|pubmed:590943|pubmed:7391062|pubmed:7396920|pubmed:8209746|pubmed:8872119|pubmed:8922951 Graph 5-acetamido-9-O-acetyl-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|9-Anana|9-O-Acetyl-N-acetylneuraminic acid|9-O-Acetylsialic acid 5-acetamido-9-O-acetyl-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid 5-acetamido-9-O-acetyl-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid|9-Anana|9-O-Acetyl-N-acetylneuraminic acid|9-O-Acetylsialic acid http://purl.obolibrary.org/obo/CHEBI_21500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21501 biolink:ChemicalEntity N-acetyl-D-amino acid An N-acetyl-amino acid having D-configuration. kegg.compound:C03135 Graph N-Acetyl-D-amino-acid|N-acetyl-D-amino acids N-Acetyl-D-amino-acid|N-acetyl-D-amino acids http://purl.obolibrary.org/obo/CHEBI_21501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21507 biolink:ChemicalEntity N-acetyl-D-galactosaminyl group A galactosaminyl group (D-configuration) in which the amino group at C-2 is acetylated. The group may be substituted with further mono- or oligo-saccharide groups. Graph http://purl.obolibrary.org/obo/CHEBI_21507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21509 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine Graph N-acetyl-D-galactosaminyl-N-acetylneuraminyl-D-galactosyl-D-glucosyl-N-acylsphingosine N-acetyl-D-galactosaminyl-N-acetylneuraminyl-D-galactosyl-D-glucosyl-N-acylsphingosine http://purl.obolibrary.org/obo/CHEBI_21509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21519 biolink:ChemicalEntity N-acetyl-D-glucosamine 1-phosphate A N-acyl-D-glucosamine 1-phosphate in which the acyl group specified is acetyl. Graph http://purl.obolibrary.org/obo/CHEBI_21519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21524 biolink:ChemicalEntity N-acetyl-D-glucosaminyl groups A glucosaminyl group having D-configuration and an N-acetyl substituent (and derivatives thereof). Graph N-acetyl-D-glucosaminyl derivative group|N-acetyl-D-glucosaminyl derivative groups|N-acetyl-D-glucosaminyl groups N-acetyl-D-glucosaminyl derivative group|N-acetyl-D-glucosaminyl derivative groups|N-acetyl-D-glucosaminyl groups http://purl.obolibrary.org/obo/CHEBI_21524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21545 biolink:ChemicalEntity N-acetyl-L-amino acid An L-amino acid having an N-acetyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_21545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21547 biolink:ChemicalEntity N-acetyl-L-aspartic acid An N-acyl-L-aspartic acid in which the acyl group is specified as acetyl. cas:997-55-7|hmdb:HMDB0000812|kegg.compound:C01042|metacyc.compound:CPD-420|pubmed:1400776|pubmed:1583881|pubmed:17190852|pubmed:17703473|pubmed:19445994|pubmed:19816853|pubmed:20362635|pubmed:20946933|pubmed:21547934|pubmed:21608034|pubmed:21920405|pubmed:22284151|pubmed:2272391|pubmed:22770225|pubmed:2324740|pubmed:6131106|reaxys:1726198|wikipedia.en:N-acetylaspartic_acid Graph (2S)-2-acetamidobutanedioic acid|(S)-2-(acetylamino)butanedioic acid|(S)-2-(acetylamino)succinic acid|L-N-acetylaspartic acid|N-acetylaspartic acid|NAA|acetyl-L-aspartic acid|acetylaspartic acid (2S)-2-acetamidobutanedioic acid (2S)-2-acetamidobutanedioic acid|(S)-2-(acetylamino)butanedioic acid|(S)-2-(acetylamino)succinic acid|L-N-acetylaspartic acid|N-acetylaspartic acid|NAA|acetyl-L-aspartic acid|acetylaspartic acid http://purl.obolibrary.org/obo/CHEBI_21547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21549 biolink:ChemicalEntity N-acetyl-L-glutamate(1-) An N-acyl-L-α-amino acid anion resulting from deprotonation of both carboxy groups and protonation of the amide nitrogen of N-acetyl-L-glutamic acid. Graph (2S)-2-(acetylammonio)pentanedioate (2S)-2-(acetylammonio)pentanedioate (2S)-2-(acetylammonio)pentanedioate http://purl.obolibrary.org/obo/CHEBI_21549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21557 biolink:ChemicalEntity N-acetyl-L-methionine An L-methionine derivative that is L-methionine in which one of the amine hydrogens is substituted by an acetyl group. cas:65-82-7|drugbank:DB01646|hmdb:HMDB0011745|kegg.compound:C02712|metacyc.compound:CPD0-2015|pdb-ccd:AME|pubmed:16091934|pubmed:16129491|pubmed:21246718|pubmed:21796695|pubmed:24769178|pubmed:448454|pubmed:7069504|pubmed:7354384|pubmed:845673|pubmed:986424|reaxys:1725552|reaxys:4744969 Graph (2S)-2-acetamido-4-(methylsulfanyl)butanoic acid|AcMet|Acetyl-L-methionine|Acetylmethionine|L-(N-Acetyl)methionine|Methionamine|N-Ac-Met|N-Acetylmethionine|N-acetyl-L-methionine|Nalpha-acetyl-L-methionine N-acetyl-L-methionine (2S)-2-acetamido-4-(methylsulfanyl)butanoic acid|AcMet|Acetyl-L-methionine|Acetylmethionine|L-(N-Acetyl)methionine|Methionamine|N-Ac-Met|N-Acetylmethionine|N-acetyl-L-methionine|Nalpha-acetyl-L-methionine http://purl.obolibrary.org/obo/CHEBI_21557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21569 biolink:ChemicalEntity N-acetyl-O-acetylneuraminic acid Graph N-acetyl-O-acetylneuraminic acids N-acetyl-O-acetylneuraminic acids http://purl.obolibrary.org/obo/CHEBI_21569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:215747 biolink:ChemicalEntity Benvitimod chemspider:4943924|drugbank:DB06083|kegg.drug:D11365 Graph 5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol 5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol 5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol http://purl.obolibrary.org/obo/CHEBI_215747 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21575 biolink:ChemicalEntity N-acetyl-amino acid An N-acyl-amino acid that has acetyl as the acyl group. kegg.compound:C02847 Graph N-Acetyl amino acid|N-acetyl-amino acids N-Acetyl amino acid|N-acetyl-amino acids http://purl.obolibrary.org/obo/CHEBI_21575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21601 biolink:ChemicalEntity N-acetyl-D-hexosamine Any N-acetylhexosamine in which the hexosamine has D-configuration. The structure provided is an illustrative example of the pyranose form of an N-acetyl-D-hexosamine. Graph N-acetyl-D-hexosamine|N-acetyl-D-hexosamines|N-acetylhexosamine|N-acetylhexosamines N-acetyl-D-hexosamine|N-acetyl-D-hexosamines|N-acetylhexosamine|N-acetylhexosamines http://purl.obolibrary.org/obo/CHEBI_21601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21615 biolink:ChemicalEntity N-acetyl-D-muramic acid The pyranose form of N-acetylmuramic acid. cas:61633-75-8|ecmdb:ECMDB20176|hmdb:HMDB0060493|kegg.compound:C02713|pubmed:12369847|pubmed:24819062|reaxys:3085879|wikipedia.en:N-Acetylmuramic_acid Graph 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucopyranose|N-Acetyl-D-muramoate|N-Acetylmuramic acid 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucopyranose 2-acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucopyranose|N-Acetyl-D-muramoate|N-Acetylmuramic acid http://purl.obolibrary.org/obo/CHEBI_21615 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21619 biolink:ChemicalEntity N-acetylneuraminates Graph N-acetylneuraminate N-acetylneuraminate http://purl.obolibrary.org/obo/CHEBI_21619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21622 biolink:ChemicalEntity N-acetylneuraminic acids Graph http://purl.obolibrary.org/obo/CHEBI_21622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21626 biolink:ChemicalEntity N-acetylphenylalanine The N-acetyl derivative of phenylalanine. cas:2901-75-9|reaxys:2213851 Graph 2-(acetylamino)-3-phenylpropanoic acid|N-Acetyl-3-phenyl-DL-alanine|N-acetylphenylalanine|afalanina|afalanine|afalaninum 2-(acetylamino)-3-phenylpropanoic acid|N-acetylphenylalanine 2-(acetylamino)-3-phenylpropanoic acid|N-Acetyl-3-phenyl-DL-alanine|N-acetylphenylalanine|afalanina|afalanine|afalaninum http://purl.obolibrary.org/obo/CHEBI_21626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21635 biolink:ChemicalEntity N-acyl-D-glucosamine 1-phosphate Graph N-acyl-D-glucosamine 1-phosphate|N-acyl-D-glucosamine 1-phosphates N-acyl-D-glucosamine 1-phosphate|N-acyl-D-glucosamine 1-phosphates http://purl.obolibrary.org/obo/CHEBI_21635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21637 biolink:ChemicalEntity N-acyl-D-glucosamine phosphate Graph N-acyl-D-glucosamine phosphates N-acyl-D-glucosamine phosphates http://purl.obolibrary.org/obo/CHEBI_21637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21638 biolink:ChemicalEntity N-acylglucosamine Graph N-acylglucosamine|N-acylglucosamines N-acylglucosamine|N-acylglucosamines http://purl.obolibrary.org/obo/CHEBI_21638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2164 biolink:ChemicalEntity 6-acetamido-3-aminohexanoic acid A member of the class of β-amino acids that is the N6-acetyl derivative of 3,6-diaminohexanoic acid. kegg.compound:C03846|metacyc.compound:3-AMINO-6-ACETAMIDOHEXANOATE Graph 6-Acetamido-3-aminohexanoate|6-acetamido-3-aminohexanoic acid|N(6)-acetyl-beta-lysine 6-acetamido-3-aminohexanoic acid 6-Acetamido-3-aminohexanoate|6-acetamido-3-aminohexanoic acid|N(6)-acetyl-beta-lysine http://purl.obolibrary.org/obo/CHEBI_2164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21644 biolink:ChemicalEntity N-acyl-L-amino acid Any N-acylamino acid having L-configuration. Graph http://purl.obolibrary.org/obo/CHEBI_21644 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21645 biolink:ChemicalEntity N-acyl-L-arginine An N-acyl-L-amino acid that is L-arginine in which one of the hydrogens attached to the nitrogen is replaced by any acyl group. kegg.compound:C02562 Graph N-acyl-L-arginines N-acyl-L-arginines http://purl.obolibrary.org/obo/CHEBI_21645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21647 biolink:ChemicalEntity N-acyl-L-aspartic acid L-Aspartic acid substituted at nitrogen by an acyl group. kegg.compound:C02715 Graph N-acyl-L-aspartic acids N-acyl-L-aspartic acids http://purl.obolibrary.org/obo/CHEBI_21647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2165 biolink:ChemicalEntity 6-acetamido-3-oxohexanoic acid A 3-oxo monocarboxylic acid that is 3-oxohexanoic acid substituted at position 6 by an acetamido group. cas:59403-50-8|kegg.compound:C03682|metacyc.compound:3-OXO-6-ACETAMIDOHEXANOATE|reaxys:20934815 Graph 3-keto-6-acetamidohexanoate|3-oxo-6-acetamidohexanoic acid|6-Acetamido-3-oxohexanoate|6-acetamido-3-ketohexanoic acid|6-acetamido-3-oxohexanoic acid 6-acetamido-3-oxohexanoic acid 3-keto-6-acetamidohexanoate|3-oxo-6-acetamidohexanoic acid|6-Acetamido-3-oxohexanoate|6-acetamido-3-ketohexanoic acid|6-acetamido-3-oxohexanoic acid http://purl.obolibrary.org/obo/CHEBI_2165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21650 biolink:ChemicalEntity N-acyl-L-glutamic acid Any optically active N-acylglutamic acid having L-configuration. Graph N-acyl-L-glutamic acid N-acyl-L-glutamic acid http://purl.obolibrary.org/obo/CHEBI_21650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21652 biolink:ChemicalEntity N-acyl-O-acetylneuraminic acid Graph N-acyl-O-acetylneuraminic acid|N-acyl-O-acetylneuraminic acids N-acyl-O-acetylneuraminic acid|N-acyl-O-acetylneuraminic acids http://purl.obolibrary.org/obo/CHEBI_21652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21654 biolink:ChemicalEntity N-acyl-aspartic acid An aspartic acid derivative that is aspartic acid in which one of the hydrogens attached to the amino group is replaced by an acyl group. Graph http://purl.obolibrary.org/obo/CHEBI_21654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21655 biolink:ChemicalEntity N-acylgalactosamine Graph N-acylgalactosamine|N-acylgalactosamines N-acylgalactosamine|N-acylgalactosamines http://purl.obolibrary.org/obo/CHEBI_21655 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21656 biolink:ChemicalEntity N-acyl-hexosamine Graph N-acyl-hexosamine|N-acyl-hexosamines N-acyl-hexosamine|N-acyl-hexosamines http://purl.obolibrary.org/obo/CHEBI_21656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21658 biolink:ChemicalEntity N-acylglutamic acid A glutamic acid derivative that is glutamic acid in which a hydrogen attached to the nitrogen has been replaced by an acyl group. Graph http://purl.obolibrary.org/obo/CHEBI_21658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21662 biolink:ChemicalEntity N-acylneuraminic acid phosphate Graph N-acylneuraminate phosphate|N-acylneuraminic acid phosphates N-acylneuraminate phosphate|N-acylneuraminic acid phosphates http://purl.obolibrary.org/obo/CHEBI_21662 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21663 biolink:ChemicalEntity N-acylneuraminates Graph N-acylneuraminate N-acylneuraminate http://purl.obolibrary.org/obo/CHEBI_21663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21672 biolink:ChemicalEntity N-amidino-amino acid Graph N-amidino-amino acids N-amidino-amino acids http://purl.obolibrary.org/obo/CHEBI_21672 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:21681 biolink:ChemicalEntity N-benzoyl-D-arginines Any D-arginine derivative in which at least one of the nitrogens has been benzoylated. Graph http://purl.obolibrary.org/obo/CHEBI_21681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21686 biolink:ChemicalEntity N-carbamoyl-L-amino acid A N-carbamoyl-amino acid in which the amino acid has a L-configuration. Graph N-carbamoyl-L-amino acids N-carbamoyl-L-amino acids http://purl.obolibrary.org/obo/CHEBI_21686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21689 biolink:ChemicalEntity N-carbamoyl-amino acid Graph N-carbamoyl-amino acids N-carbamoyl-amino acids http://purl.obolibrary.org/obo/CHEBI_21689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21725 biolink:ChemicalEntity N-glycoloylglucosamine Graph http://purl.obolibrary.org/obo/CHEBI_21725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21726 biolink:ChemicalEntity N-glycoloyl-hexosamine A N-acyl-hexosamine in which the acyl group specified is glycoloyl. Graph N-glycoloyl-hexosamines N-glycoloyl-hexosamines http://purl.obolibrary.org/obo/CHEBI_21726 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21727 biolink:ChemicalEntity N-glycoloylmannosamine Graph http://purl.obolibrary.org/obo/CHEBI_21727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21731 biolink:ChemicalEntity N-glycosyl compound A glycosyl compound arising formally from the elimination of water from a glycosidic hydroxy group and an H atom bound to a nitrogen atom, thus creating a C-N bond. Graph N-glycoside|N-glycosides|N-glycosyl compounds|glycosylamine|glycosylamines glycosylamine N-glycoside|N-glycosides|N-glycosyl compounds|glycosylamine|glycosylamines http://purl.obolibrary.org/obo/CHEBI_21731 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21745 biolink:ChemicalEntity N-(long-chain-fatty-acyl)-L-glutamic acid An N-acyl-L-glutamic acid in which the acyl group has a chain length of C12 or greater. kegg.compound:C04305 Graph N-(long-chain-fatty-acyl)-L-glutamic acids N-(long-chain-fatty-acyl)-L-glutamic acids http://purl.obolibrary.org/obo/CHEBI_21745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21752 biolink:ChemicalEntity N-methyl-L-alpha-amino acid An non-proteinogenic L-α-amino acid in which the amino group bears one or more methyl groups. Graph N-methyl-L-alpha-amino acids|N-methyl-L-amino acid N-methyl-L-alpha-amino acids|N-methyl-L-amino acid http://purl.obolibrary.org/obo/CHEBI_21752 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21759 biolink:ChemicalEntity N-methyl-N'-nitro-N-nitrosoguanidine An N-nitroguanidine compound having nitroso and methyl substituents at the N'-position beilstein:1779490|cas:70-25-7|kegg.compound:C14592 Graph 1-Methyl-1-nitroso-3-nitroguanidine|1-Methyl-3-nitro-1-nitrosoguanidine|1-Nitroso-3-nitro-1-methylguanidine|1-methyl-3-nitro-1-nitrosoguanidine|MNG|MNNG|Methylnitronitrosoguanidine|N'-Nitro-N-nitroso-N-methylguanidine|N-Methyl-N',2-dioxohydrazinecarboximidohydrazide 2-oxide|N-Methyl-N'-nitro-N-nitrosoguanidine|N-Methyl-N-nitroso-N'-nitroguanidine|N-Methyl-N-nitrosonitroguanidin|N-Nitroso-N-methyl-N'-nitroguanidine 1-methyl-3-nitro-1-nitrosoguanidine 1-Methyl-1-nitroso-3-nitroguanidine|1-Methyl-3-nitro-1-nitrosoguanidine|1-Nitroso-3-nitro-1-methylguanidine|1-methyl-3-nitro-1-nitrosoguanidine|MNG|MNNG|Methylnitronitrosoguanidine|N'-Nitro-N-nitroso-N-methylguanidine|N-Methyl-N',2-dioxohydrazinecarboximidohydrazide 2-oxide|N-Methyl-N'-nitro-N-nitrosoguanidine|N-Methyl-N-nitroso-N'-nitroguanidine|N-Methyl-N-nitrosonitroguanidin|N-Nitroso-N-methyl-N'-nitroguanidine http://purl.obolibrary.org/obo/CHEBI_21759 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21760 biolink:ChemicalEntity N-methyl-amino acid An amino acid derivative in which at least one of the hydrogens of the amino group has been replaced by a methyl group. Graph N-methyl-amino acids N-methyl-amino acids http://purl.obolibrary.org/obo/CHEBI_21760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21763 biolink:ChemicalEntity N-methylethanolamine An ethanolamine compound having an N-methyl substituent. cas:109-83-1|patent:CN101415672|patent:CN101870710|patent:WO2010125179|pubmed:10930630|pubmed:22112405|pubmed:5677135|pubmed:6049253|reaxys:1071196|wikipedia.en:N-Methylethanolamine Graph (2-Hydroxyethyl)methylamine|2-(N-Methylamino)ethanol|2-(methylamino)ethanol|2-Hydroxy-N-methylethylamine|2-Methylaminoethanol|2-N-Monomethylaminoethanol|Methyl(2-hydroxyethyl)amine|Methyl(beta-hydroxyethyl)amine|Methylethanolamine|Methylethylolamine|Monomethyl-aminoaethanol|Monomethylaminoethanol|Monomethylethanolamine|Monomethylmonoethanolamine|N-(2-Hydroxyethyl)-N-methylamine|N-(2-Hydroxyethyl)methylamine|N-Methyl-2-aminoethanol|N-Methyl-2-ethanolamine|N-Methyl-2-hydroxyethylamine|N-Methyl-N-(2-hydroxyethyl)amine|N-Methyl-N-(beta-hydroxyethyl)amine|N-Methylaminoethanol|N-Methylethanolamine|N-Methylmonoethanolamine|N-Monomethylaminoethanol|N-Monomethylethanolamine|beta-(Methylamino)ethanol 2-(methylamino)ethanol (2-Hydroxyethyl)methylamine|2-(N-Methylamino)ethanol|2-(methylamino)ethanol|2-Hydroxy-N-methylethylamine|2-Methylaminoethanol|2-N-Monomethylaminoethanol|Methyl(2-hydroxyethyl)amine|Methyl(beta-hydroxyethyl)amine|Methylethanolamine|Methylethylolamine|Monomethyl-aminoaethanol|Monomethylaminoethanol|Monomethylethanolamine|Monomethylmonoethanolamine|N-(2-Hydroxyethyl)-N-methylamine|N-(2-Hydroxyethyl)methylamine|N-Methyl-2-aminoethanol|N-Methyl-2-ethanolamine|N-Methyl-2-hydroxyethylamine|N-Methyl-N-(2-hydroxyethyl)amine|N-Methyl-N-(beta-hydroxyethyl)amine|N-Methylaminoethanol|N-Methylethanolamine|N-Methylmonoethanolamine|N-Monomethylaminoethanol|N-Monomethylethanolamine|beta-(Methylamino)ethanol http://purl.obolibrary.org/obo/CHEBI_21763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21766 biolink:ChemicalEntity N-methylglycines An N-alkylglycine that is sarcosine and derivatives of sarcosine arising by replacement of the hydrogen attached to the nitrogen by a hydrocarbyl group. Graph http://purl.obolibrary.org/obo/CHEBI_21766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21776 biolink:ChemicalEntity N-myristoyl amino acid Graph N-myristoyl amino acids N-myristoyl amino acids http://purl.obolibrary.org/obo/CHEBI_21776 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2179 biolink:ChemicalEntity D-fucopyranose The six-membered ring form of D-fucose. cas:3615-37-0|gmelin:1972483|hmdb:HMDB0029196|kegg.compound:C01018|knapsack:C00001118|metacyc.compound:D-FUCOSE|pubmed:19913595|pubmed:22159189|pubmed:23552326|pubmed:23942008|pubmed:9367758|reaxys:1905881 Graph 6-Deoxy-D-galactose|6-deoxy-D-galactopyranose|D-Fucose|D-fucopyranose|D-fucose 6-deoxy-D-galactopyranose|D-fucopyranose 6-Deoxy-D-galactose|6-deoxy-D-galactopyranose|D-Fucose|D-fucopyranose|D-fucose http://purl.obolibrary.org/obo/CHEBI_2179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21794 biolink:ChemicalEntity N-sulfoglucosamine Graph N-sulfo-glucosamines|N-sulfoglucosamine|N-sulfoglucosamines N-sulfo-glucosamines|N-sulfoglucosamine|N-sulfoglucosamines http://purl.obolibrary.org/obo/CHEBI_21794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21805 biolink:ChemicalEntity N(2')-acetylgentamycin Graph N(2')-acetylgentamycins N(2')-acetylgentamycins http://purl.obolibrary.org/obo/CHEBI_21805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21806 biolink:ChemicalEntity N(2),N(5)-diacyl-L-ornithine A L-ornithine derivative in which L-ornithine is acylated on both nitrogens. Graph N(2),N(5)-diacyl-L-ornithines N(2),N(5)-diacyl-L-ornithines http://purl.obolibrary.org/obo/CHEBI_21806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2181 biolink:ChemicalEntity L-fucopyranose The pyranose form of L-fucose. cas:2438-80-4|glygen:G82576YO|glytoucan:G82576YO|gmelin:863814|hmdb:HMDB0000174|kegg.compound:C01019|knapsack:C00035100|metacyc.compound:L-FUCOSE|pubmed:19913595|pubmed:25728407|pubmed:27145048|pubmed:27782805|pubmed:7688662|reaxys:1905878|wikipedia.en:L-Fucose Graph (-)-L-Fucose|(3S,4R,5R,6S)-6-methyloxane-2,3,4,5-tetrol|(3S,4R,5R,6S)-6-methyltetrahydropyran-2,3,4,5-tetrol|(3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol|6-Deoxy-L-galactose|6-deoxy-L-galactopyranose|L-Fucose|L-fucopyranose|L-fucose 6-deoxy-L-galactopyranose|L-fucopyranose (-)-L-Fucose|(3S,4R,5R,6S)-6-methyloxane-2,3,4,5-tetrol|(3S,4R,5R,6S)-6-methyltetrahydropyran-2,3,4,5-tetrol|(3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol|6-Deoxy-L-galactose|6-deoxy-L-galactopyranose|L-Fucose|L-fucopyranose|L-fucose http://purl.obolibrary.org/obo/CHEBI_2181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21815 biolink:ChemicalEntity N2-acyl-L-ornithine Graph http://purl.obolibrary.org/obo/CHEBI_21815 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21816 biolink:ChemicalEntity N(2)-glutamino group Graph (4-amino-1-carboxy-4-oxobutyl)amino|N(2)-glutamino|N(alpha)-glutamino (4-amino-1-carboxy-4-oxobutyl)amino (4-amino-1-carboxy-4-oxobutyl)amino|N(2)-glutamino|N(alpha)-glutamino http://purl.obolibrary.org/obo/CHEBI_21816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:218307 biolink:ChemicalEntity Tenvermectin C chemspider:78441806 Graph (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-22-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,13-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-22-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,13-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-22-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,13-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_218307 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:218313 biolink:ChemicalEntity Tenvermectin D chemspider:78441807 Graph (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-13-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-13-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one (1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21S,24S)-13-ethyl-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',6',11,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one http://purl.obolibrary.org/obo/CHEBI_218313 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:21836 biolink:ChemicalEntity N(4)-glycosyl-L-asparagine Graph N(4)-glycosyl-L-asparagines N(4)-glycosyl-L-asparagines http://purl.obolibrary.org/obo/CHEBI_21836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21844 biolink:ChemicalEntity N(5)-alkyl-L-glutamine An L-glutamine derivative having an alkyl group attached to the amide nitrogen. Graph N(5)-alkyl-L-glutamines N(5)-alkyl-L-glutamines http://purl.obolibrary.org/obo/CHEBI_21844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21858 biolink:ChemicalEntity hypusine An L-lysine derivative that is L-lysine bearing a (2R)-4-amino-2-hydroxybutyl substituent at position N6. cas:34994-11-1|pdb-ccd:5CT|pubmed:17476569|pubmed:19379712|pubmed:21360085|pubmed:3114263|pubmed:6434336|pubmed:8347280|pubmed:8820901|pubmed:9748364 Graph (+)-hypusine|N(6)-[(2R)-4-amino-2-hydroxybutyl]-L-lysine N(6)-[(2R)-4-amino-2-hydroxybutyl]-L-lysine (+)-hypusine|N(6)-[(2R)-4-amino-2-hydroxybutyl]-L-lysine http://purl.obolibrary.org/obo/CHEBI_21858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21860 biolink:ChemicalEntity L-pyrrolysine A N6-acyl-L-lysine having (2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-ylcarbonyl as the N6-acyl group. cas:448235-52-7|kegg.compound:C16138|metacyc.compound:CPD-3321|pdb-ccd:PYL|pubmed:15329732|pubmed:16256420|pubmed:17360621|pubmed:17626042|pubmed:19063902|pubmed:19796638|wikipedia.en:Pyrrolysine Graph (2S)-2-amino-6-[(2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-ylcarbonyl]aminohexanoic acid|N(6)-{[(2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine|N6-((2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-ylcarbonyl)-L-lysine|N6-(4-methyl-1,2-didehydropyrrolidine-5-carboxyl)-L-lysine|N6-(4-methyl-delta-1-pyrroline-5-carboxyl)-L-lysine|Pyrrolysine|monomethylamine methyltransferase cofactor lysine adduct|pyrrolysine N(6)-{[(2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine (2S)-2-amino-6-[(2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-ylcarbonyl]aminohexanoic acid|N(6)-{[(2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine|N6-((2R,3R)-3-methyl-3,4-dihydro-2H-pyrrol-2-ylcarbonyl)-L-lysine|N6-(4-methyl-1,2-didehydropyrrolidine-5-carboxyl)-L-lysine|N6-(4-methyl-delta-1-pyrroline-5-carboxyl)-L-lysine|Pyrrolysine|monomethylamine methyltransferase cofactor lysine adduct|pyrrolysine http://purl.obolibrary.org/obo/CHEBI_21860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21865 biolink:ChemicalEntity N(6)-dimethylallyladenosine 5'-monophosphate Graph N(6)-dimethylallyladenosine 5'-monophosphates N(6)-dimethylallyladenosine 5'-monophosphates http://purl.obolibrary.org/obo/CHEBI_21865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21891 biolink:ChemicalEntity N(6)-methyladenosine A methyladenosine compound with one methyl group attached to N6 of the adenine nucleobase. cas:1867-73-8|lincs.smallmolecule:LSM-3835|pubmed:26046440|pubmed:26323656|pubmed:26748145|pubmed:26958595|pubmed:27396363|pubmed:27467725|pubmed:28349455|pubmed:323854|reaxys:42872 Graph (2R,3S,4R,5R)-2-Hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetrahydro-furan-3,4-diol|6-Methyladenosine|6-Methylaminopurine D-riboside|6-Methylaminopurine ribonucleoside|6-Methylaminopurine riboside|6-Methylaminopurinosine|N(6)-Methyladenosine|N(6)-methyladenosine|N(6)-monomethyladenosine|N-methyladenosine|m6a N-methyladenosine (2R,3S,4R,5R)-2-Hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetrahydro-furan-3,4-diol|6-Methyladenosine|6-Methylaminopurine D-riboside|6-Methylaminopurine ribonucleoside|6-Methylaminopurine riboside|6-Methylaminopurinosine|N(6)-Methyladenosine|N(6)-methyladenosine|N(6)-monomethyladenosine|N-methyladenosine|m6a http://purl.obolibrary.org/obo/CHEBI_21891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21894 biolink:ChemicalEntity N6-myristoyl-L-lysine Graph (S)-2-amino-6-(tetradecanoylamino)hexanoic acid|N(zeta)-myristoyllysine|N6-(1-oxotetradecyl)-L-lysine|N6-myristoyl-L-lysine|epsilon-myristoyllysine (S)-2-amino-6-(tetradecanoylamino)hexanoic acid|N(zeta)-myristoyllysine|N6-(1-oxotetradecyl)-L-lysine|N6-myristoyl-L-lysine|epsilon-myristoyllysine http://purl.obolibrary.org/obo/CHEBI_21894 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:21911 biolink:ChemicalEntity N(alpha)-methyl-L-histidines A N-methyl-L-α-amino acid that is L-histidine in which at least one of the amino hydrogens has been replaced by a methyl group. Graph http://purl.obolibrary.org/obo/CHEBI_21911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21968 biolink:ChemicalEntity O-phosphoamino acid Graph O-phosphoamino acids O-phosphoamino acids http://purl.obolibrary.org/obo/CHEBI_21968 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21969 biolink:ChemicalEntity O-phosphorylhomoserine An O-phosphoamino acid in which the amino acid specified is homoserine. kegg.compound:C05702 Graph O-Phosphorylhomoserine|O-phosphorylhomoserines O-Phosphorylhomoserine|O-phosphorylhomoserines http://purl.obolibrary.org/obo/CHEBI_21969 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:21976 biolink:ChemicalEntity o-succinylhomoserine kegg.compound:C05701 Graph O-Succinylhomoserine|O-succinylhomoserines O-Succinylhomoserine|O-succinylhomoserines http://purl.obolibrary.org/obo/CHEBI_21976 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2198 biolink:ChemicalEntity 6-hydroxymelatonin A member of the class of tryptamines that is melatonin with a hydroxy group substituent at position 6. cas:2208-41-5|hmdb:HMDB0004081|kegg.compound:C05643|pubmed:15356035|pubmed:16300638|pubmed:22430231|pubmed:2646423|pubmed:3964785|pubmed:7263843|reaxys:483231 Graph Lopac-H-0627|N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide Lopac-H-0627|N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide http://purl.obolibrary.org/obo/CHEBI_2198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22020 biolink:ChemicalEntity S-(ADP-ribosyl)-L-cysteine Graph S-(ADP-ribosyl)-L-cysteine S-(ADP-ribosyl)-L-cysteine http://purl.obolibrary.org/obo/CHEBI_22020 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22043 biolink:ChemicalEntity S-farnesyl-L-cysteine An S-polyprenyl-L-cysteine where the polyprenyl moiety is specified as farnesyl. Graph S-farnesyl-L-cysteines S-farnesyl-L-cysteines http://purl.obolibrary.org/obo/CHEBI_22043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22046 biolink:ChemicalEntity S-geranylgeranyl-L-cysteine An S-polyprenyl-L-cysteine where the polyprenyl moiety is specified as geranylgeranyl. cas:131404-69-8|metacyc.compound:CPD-12591|reaxys:9958844 Graph Geranylgeranylcysteine|S-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]-L-cysteine|S-geranylgeranylcysteine S-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]-L-cysteine Geranylgeranylcysteine|S-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]-L-cysteine|S-geranylgeranylcysteine http://purl.obolibrary.org/obo/CHEBI_22046 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22063 biolink:ChemicalEntity sulfoxide An organosulfur compound having the structure R2S=O or R2C=S=O (R ≠ H). Graph S-oxides|sulfoxide|sulfoxides S-oxides|sulfoxide|sulfoxides http://purl.obolibrary.org/obo/CHEBI_22063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22064 biolink:ChemicalEntity S-palmitoyl amino acid Graph S-palmitoyl amino acids S-palmitoyl amino acids http://purl.obolibrary.org/obo/CHEBI_22064 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22065 biolink:ChemicalEntity S-palmitoyl-L-cysteine A palmitoyl-L-cysteine in which the palmitoyl group is attached to the sulfur via a thioester linkage. drugbank:DB08342|pdb-ccd:P1L Graph S-hexadecanoyl-L-cysteine S-hexadecanoyl-L-cysteine S-hexadecanoyl-L-cysteine http://purl.obolibrary.org/obo/CHEBI_22065 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2208 biolink:ChemicalEntity purine-6-thiol A thiol that is the tautomer of mercaptopurine. cas:50-44-2|drugbank:DB01033|kegg.compound:C01756|kegg.compound:C02380|pdb-ccd:PM6|pubmed:24211998|pubmed:24651962|pubmed:24670805|pubmed:24774509|reaxys:608595 Graph 1,7-Dihydro-6H-purine-6-thione|3H-Purine-6-thiol|6-MP|6-Thiohypoxanthine|7H-purine-6-thiol 7H-purine-6-thiol 1,7-Dihydro-6H-purine-6-thione|3H-Purine-6-thiol|6-MP|6-Thiohypoxanthine|7H-purine-6-thiol http://purl.obolibrary.org/obo/CHEBI_2208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22080 biolink:ChemicalEntity TDP-sugar A pyrimidine nucleotide-sugar having TDP as the nucleotide component attached to an unspecified sugar via an anomeric diphosphate linkage. Graph TDP-sugars TDP-sugars http://purl.obolibrary.org/obo/CHEBI_22080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22099 biolink:ChemicalEntity UDP-D-galactosamine cas:17479-06-0 Graph Udp galactosamine|Uridine 5'-(trihydrogen diphosphate), P'-(2-amino-2-deoxy-alpha-D-galactopyranosyl) ester|Uridine 5'-diphosphogalactosamine|Uridine diphosphate galactosamine|uridine 5'-[3-(2-amino-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-amino-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] Udp galactosamine|Uridine 5'-(trihydrogen diphosphate), P'-(2-amino-2-deoxy-alpha-D-galactopyranosyl) ester|Uridine 5'-diphosphogalactosamine|Uridine diphosphate galactosamine|uridine 5'-[3-(2-amino-2-deoxy-D-galactopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_22099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22102 biolink:ChemicalEntity UDP-D-glucosamine Graph uridine 5'-[3-(2-amino-2-deoxy-D-glucopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-amino-2-deoxy-D-glucopyranosyl) dihydrogen diphosphate] uridine 5'-[3-(2-amino-2-deoxy-D-glucopyranosyl) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_22102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22119 biolink:ChemicalEntity UDP-N-acetylmannosaminouronic acid Graph UDP-N-acetylmannosaminouronates UDP-N-acetylmannosaminouronates http://purl.obolibrary.org/obo/CHEBI_22119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:221278 biolink:ChemicalEntity (R)-nipecotic acid The (R)-enantiopmer of nipecotic acid. beilstein:81097 Graph (-)-hexahydronicotinic acid|(-)-nipecotic acid|(-)-piperidine-3-carboxylic acid|(3R)-(-)-piperidine-3-carboxylic acid|(3R)-hexahydronicotinic acid|(3R)-nipecotic acid|(3R)-piperidine-3-carboxylic acid|(R)-(-)-3-piperidinecarboxylic acid|(R)-(-)-nipecotic acid|(R)-(-)-piperidine-3-carboxylic acid|(R)-hexahydronicotinic acid|(R)-piperidine-3-carboxylic acid (3R)-piperidine-3-carboxylic acid (-)-hexahydronicotinic acid|(-)-nipecotic acid|(-)-piperidine-3-carboxylic acid|(3R)-(-)-piperidine-3-carboxylic acid|(3R)-hexahydronicotinic acid|(3R)-nipecotic acid|(3R)-piperidine-3-carboxylic acid|(R)-(-)-3-piperidinecarboxylic acid|(R)-(-)-nipecotic acid|(R)-(-)-piperidine-3-carboxylic acid|(R)-hexahydronicotinic acid|(R)-piperidine-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_221278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:221321 biolink:ChemicalEntity Fulvic acid chemspider:4514278|hmdb:HMDB0252514 Graph 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylic acid 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylic acid 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_221321 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22144 biolink:ChemicalEntity abscisic aldehyde beilstein:2053284 Graph (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienal|abscisic aldehyde (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienal (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienal|abscisic aldehyde http://purl.obolibrary.org/obo/CHEBI_22144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22151 biolink:ChemicalEntity (+)-abscisic acid beta-D-glucopyranosyl ester A (+)-abscisic acid D-glucopyranosyl ester that is derived from β-D-glucopyranose. kegg.compound:C15970|pubmed:12114582|reaxys:7394092 Graph (+)-(S)-ABA-beta-GE|(+)-S-ABA-beta-GE|(+)-abscisyl beta-D-glucopyranoside|(+)-beta-D-glucopyranosyl abscisate|1-O-{(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoyl}-beta-D-glucopyranose|ABA-beta-GE|Abscisic acid-beta-D-glucopyranosyl ester|abscisic acid 1'-O-beta-glucoside|beta-D-glucopyranosyl cis-(+)-abscisate 1-O-{(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoyl}-beta-D-glucopyranose (+)-(S)-ABA-beta-GE|(+)-S-ABA-beta-GE|(+)-abscisyl beta-D-glucopyranoside|(+)-beta-D-glucopyranosyl abscisate|1-O-{(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoyl}-beta-D-glucopyranose|ABA-beta-GE|Abscisic acid-beta-D-glucopyranosyl ester|abscisic acid 1'-O-beta-glucoside|beta-D-glucopyranosyl cis-(+)-abscisate http://purl.obolibrary.org/obo/CHEBI_22151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22152 biolink:ChemicalEntity 2-cis-abscisic acid A member of the class of abscisic acids in which the double bond betweeen positions 2 and 3 has cis- (natural) geometry. beilstein:2698956 Graph (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid|Abscisinsaeure|Abszisinsaeure|abscisic acid|acide abscissique|acido abscisico (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid|Abscisinsaeure|Abszisinsaeure|abscisic acid|acide abscissique|acido abscisico http://purl.obolibrary.org/obo/CHEBI_22152 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:221528 biolink:ChemicalEntity Anantin chemspider:78442926 Graph (3R)-3-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-[[[(5S,8R,14R,20R,23S)-5-benzyl-8-[(2S)-butan-2-yl]-3,6,9,12,15,18,21,25-octahydroxy-20-(2-hydroxy-2-iminoethyl)-14-(1H-indol-3-ylmethyl)-1,4,7,10,13,16,19,22-octazacyclopentacosa-3,6,9,12,15,18,21,25-octaen-23-yl]-hydroxymethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-1-hydroxy-3-phenylpropylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-(1H-imidazol-5-yl)propylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-1,3-dihydroxypropylidene]amino]-1-hydroxyethylidene]amino]-4-[(1R)-1-carboxy-2-phenylethyl]imino-4-hydroxybutanoic acid (3R)-3-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-[[[(5S,8R,14R,20R,23S)-5-benzyl-8-[(2S)-butan-2-yl]-3,6,9,12,15,18,21,25-octahydroxy-20-(2-hydroxy-2-iminoethyl)-14-(1H-indol-3-ylmethyl)-1,4,7,10,13,16,19,22-octazacyclopentacosa-3,6,9,12,15,18,21,25-octaen-23-yl]-hydroxymethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-1-hydroxy-3-phenylpropylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-(1H-imidazol-5-yl)propylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-1,3-dihydroxypropylidene]amino]-1-hydroxyethylidene]amino]-4-[(1R)-1-carboxy-2-phenylethyl]imino-4-hydroxybutanoic acid (3R)-3-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-[[[(5S,8R,14R,20R,23S)-5-benzyl-8-[(2S)-butan-2-yl]-3,6,9,12,15,18,21,25-octahydroxy-20-(2-hydroxy-2-iminoethyl)-14-(1H-indol-3-ylmethyl)-1,4,7,10,13,16,19,22-octazacyclopentacosa-3,6,9,12,15,18,21,25-octaen-23-yl]-hydroxymethylidene]amino]-1-hydroxy-3-methylpentylidene]amino]-1-hydroxy-3-phenylpropylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-(1H-imidazol-5-yl)propylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-1,3-dihydroxypropylidene]amino]-1-hydroxyethylidene]amino]-4-[(1R)-1-carboxy-2-phenylethyl]imino-4-hydroxybutanoic acid http://purl.obolibrary.org/obo/CHEBI_221528 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22153 biolink:ChemicalEntity acaricide A substance used to destroy pests of the subclass Acari (mites and ticks). wikipedia.en:Acaricide Graph Akarizid|Akarizide|acaricides|miticide Akarizid|Akarizide|acaricides|miticide http://purl.obolibrary.org/obo/CHEBI_22153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22154 biolink:ChemicalEntity acenaphthene A polycyclic aromatic hydrocarbon derived from naphthalene by the addition of an ethylene bridge connecting C-1 and C-8. cas:83-32-9|gmelin:261742|kegg.compound:C19312|patent:CN102898269|patent:CN103304357|pubmed:24239307|pubmed:24420562|pubmed:24746347|reaxys:386081|wikipedia.en:Acenaphthene Graph 1,2-dihydroacenaphthylene|acenaphthene|peri-ethylenenaphthalene 1,2-dihydroacenaphthylene 1,2-dihydroacenaphthylene|acenaphthene|peri-ethylenenaphthalene http://purl.obolibrary.org/obo/CHEBI_22154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22156 biolink:ChemicalEntity acenaphthenes Any member of the class of acenaphthylenes based on a acenaphthene skeleton and its derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22156 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22160 biolink:ChemicalEntity acetamides Compounds with the general formula RNHC(=O)CH3. Graph http://purl.obolibrary.org/obo/CHEBI_22160 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22177 biolink:ChemicalEntity acetohydroxamic acids Any hydroxamic acid in which the N-acyl group is specified as acetyl. Graph http://purl.obolibrary.org/obo/CHEBI_22177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22179 biolink:ChemicalEntity acetohydroximates Graph acetohydroximates acetohydroximates http://purl.obolibrary.org/obo/CHEBI_22179 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22180 biolink:ChemicalEntity EC 2.2.1.6 (acetolactate synthase) inhibitor An EC 2.2.1.* (transketolase/transaldolase) inhibitor that interferes with the action of acetolactate synthase (EC 2.2.1.6). wikipedia.en:Acetolactate_synthase Graph EC 2.2.1.6 (acetolactate synthase) inhibitors|EC 2.2.1.6 inhibitor|EC 2.2.1.6 inhibitors|acetohydroxy acid synthetase inhibitor|acetohydroxy acid synthetase inhibitors|acetohydroxyacid synthase inhibitor|acetohydroxyacid synthase inhibitors|acetolactate pyruvate-lyase (carboxylating) inhibitor|acetolactate pyruvate-lyase (carboxylating) inhibitors|acetolactate synthase (EC 2.2.1.6) inhibitor|acetolactate synthase (EC 2.2.1.6) inhibitors|acetolactate synthase inhibitor|acetolactate synthase inhibitors|acetolactic synthetase inhibitor|acetolactic synthetase inhibitors|alpha-acetohydroxy acid synthetase inhibitor|alpha-acetohydroxy acid synthetase inhibitors|alpha-acetohydroxyacid synthase inhibitor|alpha-acetohydroxyacid synthase inhibitors|alpha-acetolactate synthase inhibitor|alpha-acetolactate synthase inhibitors|alpha-acetolactate synthetase inhibitor|alpha-acetolactate synthetase inhibitors|pyruvate:pyruvate acetaldehydetransferase (decarboxylating) inhibitor|pyruvate:pyruvate acetaldehydetransferase (decarboxylating) inhibitors EC 2.2.1.6 (acetolactate synthase) inhibitors|EC 2.2.1.6 inhibitor|EC 2.2.1.6 inhibitors|acetohydroxy acid synthetase inhibitor|acetohydroxy acid synthetase inhibitors|acetohydroxyacid synthase inhibitor|acetohydroxyacid synthase inhibitors|acetolactate pyruvate-lyase (carboxylating) inhibitor|acetolactate pyruvate-lyase (carboxylating) inhibitors|acetolactate synthase (EC 2.2.1.6) inhibitor|acetolactate synthase (EC 2.2.1.6) inhibitors|acetolactate synthase inhibitor|acetolactate synthase inhibitors|acetolactic synthetase inhibitor|acetolactic synthetase inhibitors|alpha-acetohydroxy acid synthetase inhibitor|alpha-acetohydroxy acid synthetase inhibitors|alpha-acetohydroxyacid synthase inhibitor|alpha-acetohydroxyacid synthase inhibitors|alpha-acetolactate synthase inhibitor|alpha-acetolactate synthase inhibitors|alpha-acetolactate synthetase inhibitor|alpha-acetolactate synthetase inhibitors|pyruvate:pyruvate acetaldehydetransferase (decarboxylating) inhibitor|pyruvate:pyruvate acetaldehydetransferase (decarboxylating) inhibitors http://purl.obolibrary.org/obo/CHEBI_22180 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22187 biolink:ChemicalEntity acetophenones A class or aromatic ketone consisting of acetophenone, PhC(=O)CH3, and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22191 biolink:ChemicalEntity acetyl phosphate(2-) beilstein:3589395|cas:19926-71-7|gmelin:325632|pubmed:23870140|pubmed:24756028|umbbd.compound:c0049 Graph acetyl phosphate acetyl phosphate acetyl phosphate http://purl.obolibrary.org/obo/CHEBI_22191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22193 biolink:ChemicalEntity acetyl-L-lysine An N-acetyl-L-amino acid that is the N-acetyl derivative of L-lysine. Graph http://purl.obolibrary.org/obo/CHEBI_22193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22194 biolink:ChemicalEntity acetyl-L-serine An acetyl-amino acid in which the amino acid specified is L-serine. Graph acetyl-L-serines acetyl-L-serines http://purl.obolibrary.org/obo/CHEBI_22194 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22195 biolink:ChemicalEntity acetyl-amino acid Any amino acid derivative that is the N-acetyl or O-acetyl derivative of an amino acid. Graph acetyl-amino acids acetyl-amino acids http://purl.obolibrary.org/obo/CHEBI_22195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22198 biolink:ChemicalEntity acetylcysteine Graph http://purl.obolibrary.org/obo/CHEBI_22198 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2220 biolink:ChemicalEntity 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside A disaccharide derivative consisting of any β-D-glucopyranoside that has an β-D-xylopyranosyl residue attached at position 6. metacyc.compound:ALPHA-6-O-BETA-D-XYLOPYRANOSYL-BETA-D- Graph 6-O-(beta-D-xylosyl)-beta-D-glucoside|a 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside 6-O-(beta-D-xylosyl)-beta-D-glucoside|a 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_2220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22200 biolink:ChemicalEntity acetylgentamycin Graph acetylgentamicin|acetylgentamycins acetylgentamicin|acetylgentamycins http://purl.obolibrary.org/obo/CHEBI_22200 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22201 biolink:ChemicalEntity acetylkanamycin Graph acetylkanamycin|acetylkanamycins acetylkanamycin|acetylkanamycins http://purl.obolibrary.org/obo/CHEBI_22201 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22204 biolink:ChemicalEntity acetylspermidine Graph http://purl.obolibrary.org/obo/CHEBI_22204 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22205 biolink:ChemicalEntity acetylspermine Graph acetylspermine|acetylspermines acetylspermine|acetylspermines http://purl.obolibrary.org/obo/CHEBI_22205 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22210 biolink:ChemicalEntity aconitate(3-) A tricarboxylic acid trianion that is the conjugate base of aconitic acid. gmelin:364851 Graph prop-1-ene-1,2,3-tricarboxylate prop-1-ene-1,2,3-tricarboxylate prop-1-ene-1,2,3-tricarboxylate http://purl.obolibrary.org/obo/CHEBI_22210 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22211 biolink:ChemicalEntity aconitic acid A tricarboxylic acid that is prop-1-ene substituted by carboxy groups at positions 1, 2 and 3. cas:499-12-7|gmelin:185280|pubmed:24702026|pubmed:24710945|pubmed:25011271|reaxys:1725828|wikipedia.en:Aconitic_acid Graph 1-propene-1,2,3-tricarboxylic acid|3-carboxy-2-pentenedioic acid|achilleic acid|citridic acid|equisetic acid|prop-1-ene-1,2,3-tricarboxylic acid prop-1-ene-1,2,3-tricarboxylic acid 1-propene-1,2,3-tricarboxylic acid|3-carboxy-2-pentenedioic acid|achilleic acid|citridic acid|equisetic acid|prop-1-ene-1,2,3-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_22211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22213 biolink:ChemicalEntity acridines Graph http://purl.obolibrary.org/obo/CHEBI_22213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22216 biolink:ChemicalEntity acrylamides An enamide which is acrylamide or a derivative of acrylamide obtained by replacement of one or more of its hydrogens. pubmed:20111795|pubmed:22214428 Graph http://purl.obolibrary.org/obo/CHEBI_22216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:222169 biolink:ChemicalEntity (S)-nipecotic acid The (S)-enantiomer of nipecotic acid. beilstein:81098 Graph (+)-hexahydronicotinic acid|(+)-nipecotic acid|(+)-piperidine-3-carboxylic acid|(3S)-(+)-piperidine-3-carboxylic acid|(3S)-hexahydronicotinic acid|(3S)-nipecotic acid|(3S)-piperidine-3-carboxylic acid|(S)-(+)-3-piperidinecarboxylic acid|(S)-(+)-nipecotic acid|(S)-Piperidine-3-carboxylic acid|(S)-hexahydronicotinic acid (3S)-piperidine-3-carboxylic acid (+)-hexahydronicotinic acid|(+)-nipecotic acid|(+)-piperidine-3-carboxylic acid|(3S)-(+)-piperidine-3-carboxylic acid|(3S)-hexahydronicotinic acid|(3S)-nipecotic acid|(3S)-piperidine-3-carboxylic acid|(S)-(+)-3-piperidinecarboxylic acid|(S)-(+)-nipecotic acid|(S)-Piperidine-3-carboxylic acid|(S)-hexahydronicotinic acid http://purl.obolibrary.org/obo/CHEBI_222169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22221 biolink:ChemicalEntity acyl group An organic group formed by removing one or more hydroxy groups from an oxoacid that has the general structure RkE(=O)l(OH)m (l ≠ 0). Although the term is almost always applied to organic compounds, with carboxylic acid as the oxoacid, acyl groups can in principle be derived from other types of acids such as sulfonic acids or phosphonic acids. Graph acyl group|acyl groups|alkanoyl|alkanoyl group|groupe acyle alkanoyl acyl group|acyl groups|alkanoyl|alkanoyl group|groupe acyle http://purl.obolibrary.org/obo/CHEBI_22221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:222239 biolink:ChemicalEntity Valilactone chemspider:169154 Graph [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]heptan-2-yl] (2S)-2-ormamido-3-methylbutanoate [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]heptan-2-yl] (2S)-2-ormamido-3-methylbutanoate [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]heptan-2-yl] (2S)-2-ormamido-3-methylbutanoate http://purl.obolibrary.org/obo/CHEBI_222239 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22229 biolink:ChemicalEntity acylglutathione Graph acylglutathiones acylglutathiones http://purl.obolibrary.org/obo/CHEBI_22229 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22231 biolink:ChemicalEntity acylglycerone phosphate Graph acylglycerone phosphate|acylglycerone phosphates acylglycerone phosphate|acylglycerone phosphates http://purl.obolibrary.org/obo/CHEBI_22231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:222323 biolink:ChemicalEntity Dimerumic acid chemspider:4947731 Graph (E)-N,5-dihydroxy-N-[3-[5-[3-[hydroxy-[(E)-5-hydroxy-3-methylpent-2-enoyl]amino]propyl]-3,6-dioxopiperazin-2-yl]propyl]-3-methylpent-2-enamide (E)-N,5-dihydroxy-N-[3-[5-[3-[hydroxy-[(E)-5-hydroxy-3-methylpent-2-enoyl]amino]propyl]-3,6-dioxopiperazin-2-yl]propyl]-3-methylpent-2-enamide (E)-N,5-dihydroxy-N-[3-[5-[3-[hydroxy-[(E)-5-hydroxy-3-methylpent-2-enoyl]amino]propyl]-3,6-dioxopiperazin-2-yl]propyl]-3-methylpent-2-enamide http://purl.obolibrary.org/obo/CHEBI_222323 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22235 biolink:ChemicalEntity adamantanones A member of the class of adamantanes that is adamantane carrying at least one oxo group at unspecified position. Graph http://purl.obolibrary.org/obo/CHEBI_22235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22251 biolink:ChemicalEntity adenosine bisphosphate Graph adenosine bisphosphates adenosine bisphosphates http://purl.obolibrary.org/obo/CHEBI_22251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22256 biolink:ChemicalEntity adenosine phosphate Graph adenosine phosphates adenosine phosphates http://purl.obolibrary.org/obo/CHEBI_22256 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22260 biolink:ChemicalEntity adenosines Any purine ribonucleoside that is a derivative of adenosine. Graph http://purl.obolibrary.org/obo/CHEBI_22260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22266 biolink:ChemicalEntity adipate semialdehyde Graph adipate semialdehydes adipate semialdehydes http://purl.obolibrary.org/obo/CHEBI_22266 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22271 biolink:ChemicalEntity aflatoxin Any of a group of related and highly toxic secondary metabolites (mycotoxins) whose main structural feature is a fused coumarin-bis(dihydrofuran) ring system and which are produced by strains of the moulds Aspergillus flavus or A. parasiticus, together with further metabolites of these mycotoxins pubmed:11104412|pubmed:18757582|pubmed:20507532|pubmed:25042713|pubmed:25112578|pubmed:25274127|pubmed:25339440|pubmed:25466118|wikipedia.en:Aflatoxin Graph aflatoxins aflatoxins http://purl.obolibrary.org/obo/CHEBI_22271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22278 biolink:ChemicalEntity alanine derivative An amino acid derivative resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of alanine by a heteroatom. The definition normally excludes peptides containing alanine residues. Graph http://purl.obolibrary.org/obo/CHEBI_22278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:222828 biolink:ChemicalEntity monoethylglycinexylidide Amino acid amide formed from 2,6-dimethylaniline and N-ethylglycine components; an active metabolite of lidocaine, formed by oxidative deethylation. Used as an indicator of hepatic function. cas:7728-40-7|hmdb:HMDB0060656|kegg.compound:C16561|pubmed:17296334|pubmed:22212047|pubmed:22452841|pubmed:22468031|pubmed:7071904|pubmed:9989796|reaxys:2417108 Graph 2-Ethylamino-2',6'-acetoxylidide|2-Ethylamino-2,6-acetoxylidine|Ethylglycylxylidide|Lidocaine N-de-ethylated metabolite|N-(2,6-Dimethylphenyl)-2-(ethylamino)acetamide|N-(2,6-dimethylphenyl)-N(2)-ethylglycinamide|N-Ethylglycinexylidide|norlidocaine|omega-(ethylamino)-2',6'-dimethylacetanilide N-(2,6-dimethylphenyl)-N(2)-ethylglycinamide 2-Ethylamino-2',6'-acetoxylidide|2-Ethylamino-2,6-acetoxylidine|Ethylglycylxylidide|Lidocaine N-de-ethylated metabolite|N-(2,6-Dimethylphenyl)-2-(ethylamino)acetamide|N-(2,6-dimethylphenyl)-N(2)-ethylglycinamide|N-Ethylglycinexylidide|norlidocaine|omega-(ethylamino)-2',6'-dimethylacetanilide http://purl.obolibrary.org/obo/CHEBI_222828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:222862 biolink:ChemicalEntity Methanobactin Graph (2S)-2-[[(8S,11R,16R,19S)-23-hydroxy-11-[[(2S)-3-hydroxy-2-[[2-[(5-hydroxy-2-propan-2-yloxycarbonyl-1H-imidazol-4-yl)sulanylcarbonylamino]acetyl]amino]propanoyl]amino]-19-(hydroxymethyl)-8-[(4-hydroxyphenyl)methyl]-7,10,18-trioxo-21-sulanylidene-13,14-dithia-6,9,17,20,24,25-hexazatricyclo[20.2.1.02,6]pentacosa-1(24),22-diene-16-carbonyl]amino]-4-methylsulanylbutanoic acid (2S)-2-[[(8S,11R,16R,19S)-23-hydroxy-11-[[(2S)-3-hydroxy-2-[[2-[(5-hydroxy-2-propan-2-yloxycarbonyl-1H-imidazol-4-yl)sulanylcarbonylamino]acetyl]amino]propanoyl]amino]-19-(hydroxymethyl)-8-[(4-hydroxyphenyl)methyl]-7,10,18-trioxo-21-sulanylidene-13,14-dithia-6,9,17,20,24,25-hexazatricyclo[20.2.1.02,6]pentacosa-1(24),22-diene-16-carbonyl]amino]-4-methylsulanylbutanoic acid (2S)-2-[[(8S,11R,16R,19S)-23-hydroxy-11-[[(2S)-3-hydroxy-2-[[2-[(5-hydroxy-2-propan-2-yloxycarbonyl-1H-imidazol-4-yl)sulanylcarbonylamino]acetyl]amino]propanoyl]amino]-19-(hydroxymethyl)-8-[(4-hydroxyphenyl)methyl]-7,10,18-trioxo-21-sulanylidene-13,14-dithia-6,9,17,20,24,25-hexazatricyclo[20.2.1.02,6]pentacosa-1(24),22-diene-16-carbonyl]amino]-4-methylsulanylbutanoic acid http://purl.obolibrary.org/obo/CHEBI_222862 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22289 biolink:ChemicalEntity aldaric acid anion Graph aldarate|aldarates|aldaric acid anions aldarate|aldarates|aldaric acid anions http://purl.obolibrary.org/obo/CHEBI_22289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2229 biolink:ChemicalEntity 6-phospho-2-dehydro-D-gluconic acid A ketoaldonic acid phosphate that is the 6-phospho derivative of 2-dehydro-D-gluconic acid. kegg.compound:C01218|metacyc.compound:CPD-339|reaxys:26019655 Graph 2-Dehydro-D-gluconate 6-phosphate|6-O-phosphono-D-arabino-hex-2-ulosonic acid|6-O-phosphono-D-fructosonic acid|6-Phospho-2-dehydro-D-gluconate 6-O-phosphono-D-arabino-hex-2-ulosonic acid 2-Dehydro-D-gluconate 6-phosphate|6-O-phosphono-D-arabino-hex-2-ulosonic acid|6-O-phosphono-D-fructosonic acid|6-Phospho-2-dehydro-D-gluconate http://purl.obolibrary.org/obo/CHEBI_2229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22290 biolink:ChemicalEntity aldaric acid Dicarboxylic acids formed from aldoses by replacement of both terminal groups (CHO and CH2OH) by carboxy groups. Graph aldaric acid|aldaric acids aldaric acid|aldaric acids http://purl.obolibrary.org/obo/CHEBI_22290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22292 biolink:ChemicalEntity alditol 1-phosphate Graph alditol 1-phosphate|alditol 1-phosphates alditol 1-phosphate|alditol 1-phosphates http://purl.obolibrary.org/obo/CHEBI_22292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22294 biolink:ChemicalEntity alditol 4-phosphate Graph alditol 4-phosphate|alditol 4-phosphates alditol 4-phosphate|alditol 4-phosphates http://purl.obolibrary.org/obo/CHEBI_22294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22295 biolink:ChemicalEntity alditol 5-phosphate Graph alditol 5-phosphate|alditol 5-phosphates alditol 5-phosphate|alditol 5-phosphates http://purl.obolibrary.org/obo/CHEBI_22295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22297 biolink:ChemicalEntity alditol phosphate Graph alditol phosphate|alditol phosphates alditol phosphate|alditol phosphates http://purl.obolibrary.org/obo/CHEBI_22297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22299 biolink:ChemicalEntity aldonate A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of an aldonic acid. Graph aldonate|aldonates aldonate|aldonates http://purl.obolibrary.org/obo/CHEBI_22299 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22300 biolink:ChemicalEntity aldonic acid phosphate An aldonic acid in which at least one of the hydroxy groups has been phosphorylated. Graph aldonic acid phosphates aldonic acid phosphates http://purl.obolibrary.org/obo/CHEBI_22300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22301 biolink:ChemicalEntity aldonic acid Any carbohydrate acid formed by oxidising the aldehyde functional group of an aldose to a carboxylic acid functional group. Aldonic acids have the general formula HOCH2[CH(OH)]nC(=O)OH. Graph aldonic acid|aldonic acids aldonic acid|aldonic acids http://purl.obolibrary.org/obo/CHEBI_22301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22302 biolink:ChemicalEntity aldonolactone Graph aldonolactones aldonolactones http://purl.obolibrary.org/obo/CHEBI_22302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22307 biolink:ChemicalEntity aldoxime Oximes of aldehydes RCH=NOH. kegg.compound:C02658 Graph aldoxime|aldoximes aldoximes aldoxime|aldoximes http://purl.obolibrary.org/obo/CHEBI_22307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22313 biolink:ChemicalEntity alkaline earth metal atom Graph Erdalkalimetall|Erdalkalimetalle|alkaline earth metal|alkaline earth metals|alkaline-earth metal|alkaline-earth metals|metal alcalino-terreux|metal alcalinoterreo|metales alcalinoterreos|metaux alcalino-terreux alkaline earth metals Erdalkalimetall|Erdalkalimetalle|alkaline earth metal|alkaline earth metals|alkaline-earth metal|alkaline-earth metals|metal alcalino-terreux|metal alcalinoterreo|metales alcalinoterreos|metaux alcalino-terreux http://purl.obolibrary.org/obo/CHEBI_22313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22314 biolink:ChemicalEntity alkali metal atom Graph Alkalimetall|Alkalimetalle|alkali metal|alkali metals|metal alcalin|metal alcalino|metales alcalinos|metaux alcalins alkali metals Alkalimetall|Alkalimetalle|alkali metal|alkali metals|metal alcalin|metal alcalino|metales alcalinos|metaux alcalins http://purl.obolibrary.org/obo/CHEBI_22314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22315 biolink:ChemicalEntity alkaloid Any of the naturally occurring, basic nitrogen compounds (mostly heterocyclic) occurring mostly in the plant kingdom, but also found in bacteria, fungi, and animals. By extension, certain neutral compounds biogenetically related to basic alkaloids are also classed as alkaloids. Amino acids, peptides, proteins, nucleotides, nucleic acids, amino sugars and antibiotics are not normally regarded as alkaloids. Compounds in which the nitrogen is exocyclic (dopamine, mescaline, serotonin, etc.) are usually classed as amines rather than alkaloids. wikipedia.en:Alkaloid Graph Alkaloid|Alkaloide|alcaloide|alcaloides|alkaloids alkaloids Alkaloid|Alkaloide|alcaloide|alcaloides|alkaloids http://purl.obolibrary.org/obo/CHEBI_22315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22319 biolink:ChemicalEntity alkanesulfinate Graph alkanesulfinates|alkanesulfonites alkanesulfinates|alkanesulfonites http://purl.obolibrary.org/obo/CHEBI_22319 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22323 biolink:ChemicalEntity alkyl group A univalent group ‒CnH2n+1 derived from an alkane by removal of a hydrogen atom from any carbon atom. Graph alkyl group|alkyl groups|groupe alkyle|grupo alquilo|grupos alquilo alkyl group|alkyl groups alkyl group|alkyl groups|groupe alkyle|grupo alquilo|grupos alquilo http://purl.obolibrary.org/obo/CHEBI_22323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22324 biolink:ChemicalEntity alkyl phosphate Graph alkyl phosphates alkyl phosphates http://purl.obolibrary.org/obo/CHEBI_22324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22326 biolink:ChemicalEntity S-alkylsulfenic acid Any SO-thioperoxol in which the substituent attached to sulfur is an alkyl group. kegg.compound:C02245|metacyc.compound:Alkyl-Sulfenates Graph Alkyl sulfenate|S-alkyl-SO-thioperoxol|S-alkyl-SO-thioperoxols|S-alkylsulfenic acids|alkyl sulfenates|an S-alkyl sulfenate Alkyl sulfenate|S-alkyl-SO-thioperoxol|S-alkyl-SO-thioperoxols|S-alkylsulfenic acids|alkyl sulfenates|an S-alkyl sulfenate http://purl.obolibrary.org/obo/CHEBI_22326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22327 biolink:ChemicalEntity aliphatic sulfide Graph aliphatic thioether|aliphatic thioethers aliphatic thioether|aliphatic thioethers http://purl.obolibrary.org/obo/CHEBI_22327 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22329 biolink:ChemicalEntity alkyl-sn-glycerol 3-phosphate Graph alkyl-sn-glycerol 3-phosphate|alkyl-sn-glycerol 3-phosphates alkyl-sn-glycerol 3-phosphate|alkyl-sn-glycerol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_22329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22331 biolink:ChemicalEntity alkylamines Any amine formally derived from ammonia by replacing one, two or three hydrogen atoms by alkyl groups. Graph http://purl.obolibrary.org/obo/CHEBI_22331 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:223316 biolink:ChemicalEntity (+)-artemisinin A sesquiterpene lactone obtained from sweet wormwood, Artemisia annua, which is used as an antimalarial for the treatment of multi-drug resistant strains of falciparum malaria. cas:63968-64-9|drugcentral:3871|gmelin:1755493|kegg.compound:C09538|kegg.drug:D02481|knapsack:C00003359|lincs.smallmolecule:LSM-6546|lipidmaps:LMPR0103190003|metacyc.compound:CPD-7561|pubmed:15330155|pubmed:18008167|pubmed:19090980|pubmed:22174561|pubmed:7877142|pubmed:8544181|reaxys:4194670|wikipedia.en:Artemisinin Graph (3R,5aS,6R,8aS,9R,12S,12aR)-3,6,9-trimethyloctahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10(3H)-one|1,5,9-trimethyl-(1R,4S,5R,9R,12S,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one|Octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one|QHS|Qing Hau Sau|Qinghaosu|Quing Hau Sau|arteannuin|artemisinin|artemisinina|artemisinine|artemisininum|huanghuahaosu (3R,5aS,6R,8aS,9R,12S,12aR)-3,6,9-trimethyloctahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10(3H)-one (3R,5aS,6R,8aS,9R,12S,12aR)-3,6,9-trimethyloctahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10(3H)-one|1,5,9-trimethyl-(1R,4S,5R,9R,12S,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one|Octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one|QHS|Qing Hau Sau|Qinghaosu|Quing Hau Sau|arteannuin|artemisinin|artemisinina|artemisinine|artemisininum|huanghuahaosu http://purl.obolibrary.org/obo/CHEBI_223316 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22332 biolink:ChemicalEntity alkylamino group Alkyl substituents attached to the remainder of a molecule via nitrogen. Graph alkylamino groups alkylamino groups http://purl.obolibrary.org/obo/CHEBI_22332 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22333 biolink:ChemicalEntity alkylating agent Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases. Graph http://purl.obolibrary.org/obo/CHEBI_22333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22335 biolink:ChemicalEntity alkylglycerone phosphate Graph alkylglycerone phosphate|alkylglycerone phosphates alkylglycerone phosphate|alkylglycerone phosphates http://purl.obolibrary.org/obo/CHEBI_22335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22339 biolink:ChemicalEntity alkyne Acyclic branched or unbranched hydrocarbons having a carbon-carbon triple bond and the general formula CnH2n−2, RC≡CR. Graph alkyne|alkynes alkyne|alkynes alkyne|alkynes http://purl.obolibrary.org/obo/CHEBI_22339 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22359 biolink:ChemicalEntity alloisoleucine A 2-amino-3-methylpentanoic acid having either (2R,3S)- or (2S,3R)-configuration. drugbank:DB01739 Graph alloisoleucine|rel-(2R,3S)-2-amino-3-methylpentanoic acid alloisoleucine alloisoleucine|rel-(2R,3S)-2-amino-3-methylpentanoic acid http://purl.obolibrary.org/obo/CHEBI_22359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22385 biolink:ChemicalEntity alpha-D-glucan Graph alpha-D-glucans alpha-D-glucans http://purl.obolibrary.org/obo/CHEBI_22385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22390 biolink:ChemicalEntity alpha-D-glucoside Graph alpha-D-glucoside|alpha-D-glucosides|an alpha-D-glucoside alpha-D-glucoside|alpha-D-glucosides|an alpha-D-glucoside http://purl.obolibrary.org/obo/CHEBI_22390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:224037 biolink:ChemicalEntity 3-sulfinato-L-alaninate(2-) Dianion of 3-sulfino-L-alanine arising from deprotonation of carboxy and sulfinate groups. Graph (2R)-2-amino-3-sulfinatopropanoate|3-sulfinato-L-alaninate|3-sulfinato-L-alaninate dianion 3-sulfinato-L-alaninate (2R)-2-amino-3-sulfinatopropanoate|3-sulfinato-L-alaninate|3-sulfinato-L-alaninate dianion http://purl.obolibrary.org/obo/CHEBI_224037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:224292 biolink:ChemicalEntity Eurystatin B chemspider:4943815 Graph (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]oct-2-enamide (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]oct-2-enamide (E)-6-methyl-N-[7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]oct-2-enamide http://purl.obolibrary.org/obo/CHEBI_224292 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22440 biolink:ChemicalEntity alpha-N-substituted L-arginine An L-arginine derivative that is L-arginine in which one of the hydrogens attached to the α-nitrogen has replaced by another atom or group. kegg.compound:C04026 Graph alpha-N-substituted L-arginines alpha-N-substituted L-arginines http://purl.obolibrary.org/obo/CHEBI_22440 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22445 biolink:ChemicalEntity alpha-aspartyl group Graph 2-amino-3-carboxypropanoyl|alpha-aspartyl|aspart-1-yl alpha-aspartyl 2-amino-3-carboxypropanoyl|alpha-aspartyl|aspart-1-yl http://purl.obolibrary.org/obo/CHEBI_22445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22450 biolink:ChemicalEntity (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one beilstein:707309|cas:18172-33-3|kegg.compound:C03032 Graph (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one|alpha-Cyclopiazonic acid|cyclopiazonic acid (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one|alpha-Cyclopiazonic acid|cyclopiazonic acid http://purl.obolibrary.org/obo/CHEBI_22450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22453 biolink:ChemicalEntity alpha-glutamyl group Graph 2-amino-4-carboxybutanoyl|alpha-glutamyl|glutam-1-yl alpha-glutamyl 2-amino-4-carboxybutanoyl|alpha-glutamyl|glutam-1-yl http://purl.obolibrary.org/obo/CHEBI_22453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22455 biolink:ChemicalEntity alpha-hydroxynitrile A hydroxynitrile in which the hydroxy group is located on the carbon α to the carbonitrile group. Graph alpha-hydroxynitriles alpha-hydroxynitriles http://purl.obolibrary.org/obo/CHEBI_22455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2247 biolink:ChemicalEntity 7,8-diaminononanoic acid An amino fatty acid carrying amino substituents at positions 7 and 8. Some of its isomers are naturally occurring intermediates of biotin synthesis, and targets of antimicrobial and herbicide development. beilstein:1767544|cas:21738-21-6|kegg.compound:C01037|knapsack:C00000759|pubmed:15937974|pubmed:19345718 Graph 7,8-DAP|7,8-DAPA|7,8-Diaminononanoate|7,8-diaminononanoic acid|7,8-diaminopelargonic acid|DAP|DAPA 7,8-diaminononanoic acid 7,8-DAP|7,8-DAPA|7,8-Diaminononanoate|7,8-diaminononanoic acid|7,8-diaminopelargonic acid|DAP|DAPA http://purl.obolibrary.org/obo/CHEBI_2247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22470 biolink:ChemicalEntity alpha-tocopherol A tocopherol that is chroman-6-ol substituted by methyl groups at positions 2, 5, 7 and 8 and a 4,8,12-trimethyltridecyl group at position 2. beilstein:8176170|cas:10191-41-0|kegg.drug:D02332|pubmed:23949732|pubmed:24683365|wikipedia.en:Alpha-Tocopherol Graph (+-)-alpha-tocopherol|2,5,7,8-tetramethyl-2-(4',8',12'-trimethyltridecyl)-6-chromanol|E 307|E-307|E307|all-rac-alpha-tocopherol|dl-alpha-tocopherol|rel-(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol rel-(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol (+-)-alpha-tocopherol|2,5,7,8-tetramethyl-2-(4',8',12'-trimethyltridecyl)-6-chromanol|E 307|E-307|E307|all-rac-alpha-tocopherol|dl-alpha-tocopherol|rel-(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol http://purl.obolibrary.org/obo/CHEBI_22470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22475 biolink:ChemicalEntity amino acid amide An amide of an amino acid formed formally by conversion of the carboxy group to a carboxamido group. Graph http://purl.obolibrary.org/obo/CHEBI_22475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22478 biolink:ChemicalEntity amino alcohol An alcohol containing an amino functional group in addition to the alcohol-defining hydroxy group. Graph amino alcohols|aminoalcohol|aminoalcohols amino alcohols|aminoalcohol|aminoalcohols http://purl.obolibrary.org/obo/CHEBI_22478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22479 biolink:ChemicalEntity amino cyclitol glycoside Graph amino cyclitol glycoside|amino cyclitol glycosides amino cyclitol glycoside|amino cyclitol glycosides http://purl.obolibrary.org/obo/CHEBI_22479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22480 biolink:ChemicalEntity amino disaccharide A disaccharide derivative that is a disaccharide having one or more substituted or unsubstituted amino groups in place of hydroxy groups at unspecified positions. Graph amino-disaccharides amino-disaccharides http://purl.obolibrary.org/obo/CHEBI_22480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22483 biolink:ChemicalEntity amino oligosaccharide Graph amino oligosaccharides amino oligosaccharides http://purl.obolibrary.org/obo/CHEBI_22483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22484 biolink:ChemicalEntity galactosamine oligosaccharide Graph galactosamine oligosaccharides galactosamine oligosaccharides http://purl.obolibrary.org/obo/CHEBI_22484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22485 biolink:ChemicalEntity glucosamine oligosaccharide Graph glucosamine oligosaccharides glucosamine oligosaccharides http://purl.obolibrary.org/obo/CHEBI_22485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22487 biolink:ChemicalEntity alpha-aminoacyl group A univalent carboacyl group formed by loss of OH from the carboxy group of an α-amino acid. Graph alpha-aminoacyl groups|aminoacyl group alpha-aminoacyl groups|aminoacyl group http://purl.obolibrary.org/obo/CHEBI_22487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22490 biolink:ChemicalEntity aminoadipate semialdehyde Graph aminoadipate semialdehydes aminoadipate semialdehydes http://purl.obolibrary.org/obo/CHEBI_22490 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22492 biolink:ChemicalEntity amino aldehyde Any aldehyde which contains an amino group. pubmed:17105264 Graph http://purl.obolibrary.org/obo/CHEBI_22492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22493 biolink:ChemicalEntity aminobenzenesulfonate Graph aminobenzenesulfonate|aminobenzenesulfonates aminobenzenesulfonate aminobenzenesulfonate|aminobenzenesulfonates http://purl.obolibrary.org/obo/CHEBI_22493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22494 biolink:ChemicalEntity aminobenzoate Graph aminobenzoates aminobenzoates http://purl.obolibrary.org/obo/CHEBI_22494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22495 biolink:ChemicalEntity aminobenzoic acid Graph Aminobenzoesaeure|aminobenzoic acid aminobenzoic acid Aminobenzoesaeure|aminobenzoic acid http://purl.obolibrary.org/obo/CHEBI_22495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22496 biolink:ChemicalEntity aminobiphenyl Any member of the class of biphenyls in which the biphenyl skeleton is substituted by at least one amino group. Graph http://purl.obolibrary.org/obo/CHEBI_22496 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22497 biolink:ChemicalEntity aminobutanal Any member of the class of butanals carrying by at least one amino group on the butanal skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_22497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22500 biolink:ChemicalEntity aminobutanoyl-CoA Any member of the class of butanoyl-CoAs having an aminobutanoyl group as the acyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_22500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22501 biolink:ChemicalEntity aminodiol An amino alcohol having two hydroxy functional groups. Graph amino diol|amino diols|aminodiols amino diol|amino diols|aminodiols http://purl.obolibrary.org/obo/CHEBI_22501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22506 biolink:ChemicalEntity aminoglycan Graph aminoglycans aminoglycans http://purl.obolibrary.org/obo/CHEBI_22506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22507 biolink:ChemicalEntity aminoglycoside antibiotic Graph aminoglycoside antibiotics aminoglycoside antibiotics http://purl.obolibrary.org/obo/CHEBI_22507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2251 biolink:ChemicalEntity 7,8-dihydromethanopterin A member of the class of methanopterins resulting from the formal hydrogenation at the 7 and 8 positions of methanopterin. kegg.compound:C05927|metacyc.compound:CPD-10789|pubmed:12511515|pubmed:15028691 Graph 1-[4-({(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethyl}amino)phenyl]-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|DHMPT|H2MPT|dihydromethanopterin 1-[4-({(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethyl}amino)phenyl]-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol 1-[4-({(1R)-1-[(6S,7S)-2-amino-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]ethyl}amino)phenyl]-1-deoxy-5-O-(5-O-{[(1S)-1,3-dicarboxypropoxy](hydroxy)phosphoryl}-alpha-D-ribofuranosyl)-D-ribitol|DHMPT|H2MPT|dihydromethanopterin http://purl.obolibrary.org/obo/CHEBI_2251 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22512 biolink:ChemicalEntity aminoimidazole Any member of the class of imidazoles carrying at least one amino substituent. Graph aminoimidazoles aminoimidazoles http://purl.obolibrary.org/obo/CHEBI_22512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:225237 biolink:ChemicalEntity 2-phenylethanaminium The cation obtained by protonation of the amino group of 2-phenylethylamine. beilstein:3539103|pdb-ccd:PEA|pubmed:10476872 Graph 2-phenylethanaminium|2-phenylethylamine|2-phenylethylammonium|Phenethyl-ammonium 2-phenylethanaminium 2-phenylethanaminium|2-phenylethylamine|2-phenylethylammonium|Phenethyl-ammonium http://purl.obolibrary.org/obo/CHEBI_225237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:225238 biolink:ChemicalEntity benzylaminium The conjugate acid of benzylamine; major product at pH 7.3. beilstein:12297043|gmelin:324961|metacyc.compound:BENZYLAMINE Graph benzylamine|benzylaminium cation|benzylaminium(1+)|benzylammmonium|phenylmethanaminium|phenylmethylaminium phenylmethanaminium benzylamine|benzylaminium cation|benzylaminium(1+)|benzylammmonium|phenylmethanaminium|phenylmethylaminium http://purl.obolibrary.org/obo/CHEBI_225238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22527 biolink:ChemicalEntity aminopurine Any purine having at least one amino substituent. Graph aminopurines aminopurines http://purl.obolibrary.org/obo/CHEBI_22527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22529 biolink:ChemicalEntity amino sugar phosphate Graph amino sugar phosphate|amino sugar phosphates amino sugar phosphate|amino sugar phosphates http://purl.obolibrary.org/obo/CHEBI_22529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22531 biolink:ChemicalEntity aminotoluene Any member of the class of toluenes carrying one or more amino groups. Graph http://purl.obolibrary.org/obo/CHEBI_22531 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22532 biolink:ChemicalEntity aminouracil Graph aminouracils aminouracils http://purl.obolibrary.org/obo/CHEBI_22532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22542 biolink:ChemicalEntity androstane-3,17-dione An androstanoid that is androstane substituted by oxo groups at positions 3 and 17. wikipedia.en:Androstanedione Graph androstane-3,17-dione androstane-3,17-dione androstane-3,17-dione http://purl.obolibrary.org/obo/CHEBI_22542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2255 biolink:ChemicalEntity 7beta-aminocephalosporanic acid The α,β-unsaturated monocarboxylic acid that is the active nucleus for the synthesis of cephalosporins and intermediates. beilstein:8919572|cas:957-68-6|kegg.compound:C07756|lincs.smallmolecule:LSM-5737|pdb-ccd:4KR|pubmed:1384868|pubmed:24003232|reaxys:622638 Graph (6R,7R)-3-(acetoxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7R)-7-Aminocephalosporanate|3-acetoxymethyl-7beta-amino-3,4-didehydrocepham-4-carboxylic acid|7-ACA|7-Aminocephalosporanic acid|7-Aminocephalosporinic acid (6R,7R)-3-(acetoxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-acetoxymethyl-7beta-amino-3,4-didehydrocepham-4-carboxylic acid (6R,7R)-3-(acetoxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(7R)-7-Aminocephalosporanate|3-acetoxymethyl-7beta-amino-3,4-didehydrocepham-4-carboxylic acid|7-ACA|7-Aminocephalosporanic acid|7-Aminocephalosporinic acid http://purl.obolibrary.org/obo/CHEBI_2255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22557 biolink:ChemicalEntity anhydrohexose Any anhydro sugar formally arising by elimination of water from two hydroxy groups of a single molecule of a hexose or hexose derivative. pubmed:6453583 Graph anhydro hexose|anhydro hexoses|anhydrohexose|anhydrohexoses anhydro hexose|anhydro hexoses|anhydrohexose|anhydrohexoses http://purl.obolibrary.org/obo/CHEBI_22557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22558 biolink:ChemicalEntity anhydro sugar Intramolecular ethers formally arising by elimination of water from two hydroxy groups of a single molecule of a monosaccharide (aldose or ketose) or monosaccharide derivative. Graph anhydro sugar|anhydro sugars|anhydrosugars|sugar anhydride|sugar anhydrides anhydro sugar|anhydro sugars|anhydrosugars|sugar anhydride|sugar anhydrides http://purl.obolibrary.org/obo/CHEBI_22558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22562 biolink:ChemicalEntity anilines Any aromatic amine that is benzene carrying at least one amino substituent and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22563 biolink:ChemicalEntity anion A monoatomic or polyatomic species having one or more elementary charges of the electron. Graph Anion|Anionen|anion|aniones|anions anion Anion|Anionen|anion|aniones|anions http://purl.obolibrary.org/obo/CHEBI_22563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22565 biolink:ChemicalEntity ansamycin A class of macrocyclic lactams that consist of an aromatic (phenyl or naphthyl) or quinonoid (benzoquinone or naphthoquinone) moiety that is bridged by an aliphatic chain. wikipedia.en:Ansamycin Graph http://purl.obolibrary.org/obo/CHEBI_22565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22569 biolink:ChemicalEntity anthocyanidin glucoside Graph anthocyanidin glucosides anthocyanidin glucosides http://purl.obolibrary.org/obo/CHEBI_22569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22580 biolink:ChemicalEntity anthraquinone Graph anthracenequinones|anthraquinones anthracenequinones|anthraquinones http://purl.obolibrary.org/obo/CHEBI_22580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22583 biolink:ChemicalEntity antifeedant A substance that prevents pests from feeding. Graph antifeedants antifeedants http://purl.obolibrary.org/obo/CHEBI_22583 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22586 biolink:ChemicalEntity antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. Graph antioxidants|antioxydant|antoxidant antioxidants|antioxydant|antoxidant http://purl.obolibrary.org/obo/CHEBI_22586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22587 biolink:ChemicalEntity antiviral agent A substance that destroys or inhibits replication of viruses. Graph anti-viral agent|anti-viral agents|antiviral|antiviral agents|antivirals anti-viral agent|anti-viral agents|antiviral|antiviral agents|antivirals http://purl.obolibrary.org/obo/CHEBI_22587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22590 biolink:ChemicalEntity arabinan A polysaccharide composed of arabinose residues. kegg.compound:C02474|kegg.glycan:G10584 Graph alpha-L-Araban|alpha-L-Arabinan|arabinans alpha-L-Araban|alpha-L-Arabinan|arabinans http://purl.obolibrary.org/obo/CHEBI_22590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22595 biolink:ChemicalEntity arabinonate Graph http://purl.obolibrary.org/obo/CHEBI_22595 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22598 biolink:ChemicalEntity arabinonolactone Graph arabinonolactones arabinonolactones http://purl.obolibrary.org/obo/CHEBI_22598 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22599 biolink:ChemicalEntity arabinose cas:147-81-9|hmdb:HMDB0029942|wikipedia.en:Arabinose Graph Ara|arabino-pentose|arabinose arabino-pentose|arabinose Ara|arabino-pentose|arabinose http://purl.obolibrary.org/obo/CHEBI_22599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2260 biolink:ChemicalEntity 7-deoxyloganic acid A cyclopentapyran that is 1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid substituted at positions 1 and 7 by β-D-glucosyloxy and methyl groups respectively (the 1S,4aS,7S,7aR-diatereomer). kegg.compound:C11636|metacyc.compound:CPD-9981|pubmed:11397448|pubmed:17401822|pubmed:24103035|reaxys:1691468 Graph (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid|bis-desoxydihydromonotropein (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid (1S,4aS,7S,7aR)-1-(beta-D-glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid|bis-desoxydihydromonotropein http://purl.obolibrary.org/obo/CHEBI_2260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22600 biolink:ChemicalEntity arabinose phosphate Graph arabinose phosphate|arabinose phosphates arabinose phosphate|arabinose phosphates http://purl.obolibrary.org/obo/CHEBI_22600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22601 biolink:ChemicalEntity arabinoside Graph arabinoside|arabinosides arabinoside|arabinosides http://purl.obolibrary.org/obo/CHEBI_22601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22603 biolink:ChemicalEntity arabinoxylans Graph http://purl.obolibrary.org/obo/CHEBI_22603 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22605 biolink:ChemicalEntity arabinitol A pentitol that is the sugar alcohol produced by the reduction of arabinose or lyxose. It is found in serum or urine of human infected with Candida albicans. pubmed:13525419|pubmed:16435225|pubmed:8204415|wikipedia.en:Arabitol Graph arabitol arabitol http://purl.obolibrary.org/obo/CHEBI_22605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22617 biolink:ChemicalEntity arginine derivative An amino acid derivative resulting from reaction of arginine at the amino group, the carboxy group, or the guanidyl group, or from the replacement of any hydrogen of arginine by a heteroatom. The definition normally excludes peptides containing arginine residues. Graph http://purl.obolibrary.org/obo/CHEBI_22617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22629 biolink:ChemicalEntity arsenate ion Graph arsenate|arsenate anions|arsenate ions arsenate|arsenate anions|arsenate ions http://purl.obolibrary.org/obo/CHEBI_22629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22632 biolink:ChemicalEntity arsenic molecular entity Graph arsenic compounds|arsenic molecular entities|arsenic molecular entity arsenic compounds|arsenic molecular entities|arsenic molecular entity http://purl.obolibrary.org/obo/CHEBI_22632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22633 biolink:ChemicalEntity arsenite ion An arsenic oxoanion resulting from the removal of one or more protons from arsenous acid. Graph arsenite anions|arsenite ions arsenite anions|arsenite ions http://purl.obolibrary.org/obo/CHEBI_22633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22638 biolink:ChemicalEntity organoarsonic acid Any organoarsenic compound that is the As-organyl derivative of arsonic acid. Graph organoarsonic acids organoarsonic acids http://purl.obolibrary.org/obo/CHEBI_22638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22644 biolink:ChemicalEntity arylalkylamine kegg.compound:C05225 Graph arylalkylamines arylalkylamines http://purl.obolibrary.org/obo/CHEBI_22644 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22645 biolink:ChemicalEntity arenecarboxamide A monocarboxylic acid amide in which the amide linkage is bonded directly to an arene ring system. Graph arenecarboxamides arenecarboxamides http://purl.obolibrary.org/obo/CHEBI_22645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22648 biolink:ChemicalEntity arylmercury compound kegg.compound:C01783 Graph Arylmercury|arylmercury compound|arylmercury compounds Arylmercury|arylmercury compound|arylmercury compounds http://purl.obolibrary.org/obo/CHEBI_22648 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22651 biolink:ChemicalEntity ascorbate A ketoaldonate that is the conjugate base of ascorbic acid. Graph http://purl.obolibrary.org/obo/CHEBI_22651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22652 biolink:ChemicalEntity ascorbic acid Graph http://purl.obolibrary.org/obo/CHEBI_22652 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22653 biolink:ChemicalEntity asparagine An α-amino acid in which one of the hydrogens attached to the α-carbon of glycine is substituted by a 2-amino-2-oxoethyl group. cas:3130-87-8|gmelin:279043|kegg.compound:C16438|pubmed:22264337|pubmed:22770225|reaxys:1723525|wikipedia.en:Asparagine Graph 2,4-diamino-4-oxobutanoic acid|2-amino-3-carbamoylpropanoic acid|ASN|Asn|Asparagin|DL-Asparagine|Hasp|N|asparagina|asparagine asparagine 2,4-diamino-4-oxobutanoic acid|2-amino-3-carbamoylpropanoic acid|ASN|Asn|Asparagin|DL-Asparagine|Hasp|N|asparagina|asparagine http://purl.obolibrary.org/obo/CHEBI_22653 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22654 biolink:ChemicalEntity asparagine derivative An amino acid derivative resulting from reaction of asparagine at the amino group, the carboxy group, or the carboxamide, or from the replacement of any hydrogen of asparagine by a heteroatom. The definition normally excludes peptides containing asparagine residues. Graph http://purl.obolibrary.org/obo/CHEBI_22654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22656 biolink:ChemicalEntity asparaginyl group Graph 2,4-diamino-4-oxobutanoyl|asparaginyl 2,4-diamino-4-oxobutanoyl 2,4-diamino-4-oxobutanoyl|asparaginyl http://purl.obolibrary.org/obo/CHEBI_22656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22658 biolink:ChemicalEntity aspartate family amino acid An L-α-amino acid which is L-aspartic acid or any of the essential amino acids biosynthesised from it (asparagine, lysine, methionine, threonine and isoleucine). A closed class. pubmed:4386082|pubmed:4394351|pubmed:4721772|pubmed:5016260|pubmed:5074276 Graph aspartate family amino acids|aspartic acid family amino acid|aspartic acid family amino acids|oxaloacetate family amino acid|oxaloacetate family amino acids|oxaloacetate/aspartate family amino acid|oxaloacetate/aspartate family amino acids aspartate family amino acids|aspartic acid family amino acid|aspartic acid family amino acids|oxaloacetate family amino acid|oxaloacetate family amino acids|oxaloacetate/aspartate family amino acid|oxaloacetate/aspartate family amino acids http://purl.obolibrary.org/obo/CHEBI_22658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22660 biolink:ChemicalEntity aspartic acid An α-amino acid that consists of succinic acid bearing a single α-amino substituent cas:617-45-8|gmelin:185140|kegg.compound:C16433|pubmed:22264337|reaxys:774618|wikipedia.en:Aspartic_acid Graph (+-)-Aspartic acid|(R,S)-Aspartic acid|2-aminobutanedioic acid|Asp|Aspartic acid|D|DL-Aminosuccinic acid|DL-Asparagic acid|aspartic acid aspartic acid (+-)-Aspartic acid|(R,S)-Aspartic acid|2-aminobutanedioic acid|Asp|Aspartic acid|D|DL-Aminosuccinic acid|DL-Asparagic acid|aspartic acid http://purl.obolibrary.org/obo/CHEBI_22660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22661 biolink:ChemicalEntity aspartic acid derivative An amino acid derivative resulting from reaction of aspartic acid at the amino group or either of the carboxy groups, or from the replacement of any hydrogen of aspartic acid by a heteroatom. The definition normally excludes peptides containing aspartic acid residues. Graph http://purl.obolibrary.org/obo/CHEBI_22661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22669 biolink:ChemicalEntity aspulvinone Graph aspulvinones aspulvinones http://purl.obolibrary.org/obo/CHEBI_22669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22676 biolink:ChemicalEntity auxin "Any of a group of compounds, both naturally occurring and synthetic, that induce cell elongation in plant stems (from Greek αυξανω, ""to grow"")." wikipedia.en:Auxin Graph auxins auxins http://purl.obolibrary.org/obo/CHEBI_22676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22680 biolink:ChemicalEntity azide Any nitrogen molecular entity containing the group ‒N3. Graph azides azides azides http://purl.obolibrary.org/obo/CHEBI_22680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22681 biolink:ChemicalEntity aziridines Graph http://purl.obolibrary.org/obo/CHEBI_22681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22682 biolink:ChemicalEntity azobenzenes Any member of the wide class of molecules that share the core azobenzene structure, comprising two phenyl rings linked by a N=N double bond, which may have different functional groups extending from the rings. Graph azobenzenes azobenzenes http://purl.obolibrary.org/obo/CHEBI_22682 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22689 biolink:ChemicalEntity bafilomycin A1 The most used of the bafilomycins, a family of toxic macrolide antibiotics derived from Streptomyces griseus. beilstein:3640011|beilstein:4730699|cas:88899-55-2|pubmed:10519916|pubmed:11533151|pubmed:17917797|pubmed:19067440|pubmed:19289106|pubmed:20820851|pubmed:22344969|pubmed:22943412|pubmed:23038011|pubmed:23480984|pubmed:24890793|pubmed:24977403|pubmed:25512644|pubmed:26156798|pubmed:26242265|pubmed:7817803|pubmed:8446034|reaxys:4730700 Graph (3Z,5E,7R,8S,9S,11E,13E,15S,16R)-16-{(2S,3R,4S)-4-[(2R,4R,5S,6R)-2,4-dihydroxy-6-isopropyl-5-methyltetrahydro-2H-pyran-2-yl]-3-hydroxypentan-2-yl}-8-hydroxy-3,15-dimethoxy-5,7,9,11-tetramethyloxacyclohexadeca-3,5,11,13-tetraen-2-one (3Z,5E,7R,8S,9S,11E,13E,15S,16R)-16-{(2S,3R,4S)-4-[(2R,4R,5S,6R)-2,4-dihydroxy-6-isopropyl-5-methyltetrahydro-2H-pyran-2-yl]-3-hydroxypentan-2-yl}-8-hydroxy-3,15-dimethoxy-5,7,9,11-tetramethyloxacyclohexadeca-3,5,11,13-tetraen-2-one (3Z,5E,7R,8S,9S,11E,13E,15S,16R)-16-{(2S,3R,4S)-4-[(2R,4R,5S,6R)-2,4-dihydroxy-6-isopropyl-5-methyltetrahydro-2H-pyran-2-yl]-3-hydroxypentan-2-yl}-8-hydroxy-3,15-dimethoxy-5,7,9,11-tetramethyloxacyclohexadeca-3,5,11,13-tetraen-2-one http://purl.obolibrary.org/obo/CHEBI_22689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22691 biolink:ChemicalEntity barbiturate anion Graph barbiturate anions|barbiturates barbiturate anions|barbiturates http://purl.obolibrary.org/obo/CHEBI_22691 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22693 biolink:ChemicalEntity barbiturates Members of the class of pyrimidones consisting of pyrimidine-2,4,6(1H,3H,5H)-trione (barbituric acid) and its derivatives. Largest group of the synthetic sedative/hypnotics, sharing a characteristic six-membered ring structure. Graph barbiturates|barbituric acids barbiturates barbiturates|barbituric acids http://purl.obolibrary.org/obo/CHEBI_22693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22695 biolink:ChemicalEntity base A molecular entity having an available pair of electrons capable of forming a covalent bond with a hydron (Brønsted base) or with the vacant orbital of some other molecular entity (Lewis base). kegg.compound:C00701 Graph Base|Base1|Base2|Basen|Nucleobase|base|bases base Base|Base1|Base2|Basen|Nucleobase|base|bases http://purl.obolibrary.org/obo/CHEBI_22695 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22698 biolink:ChemicalEntity benzaldehydes Any arenecarbaldehyde that consists of a formyl substituted benzene ring and its substituted derivatives thereof. Graph http://purl.obolibrary.org/obo/CHEBI_22698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22702 biolink:ChemicalEntity benzamides Graph http://purl.obolibrary.org/obo/CHEBI_22702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22706 biolink:ChemicalEntity benzenetetrol Any member of the class of benzenes that is benzene substituted by four hydroxy groups at unspecified positions. Graph benzenetetrols benzenetetrols http://purl.obolibrary.org/obo/CHEBI_22706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22707 biolink:ChemicalEntity benzenetriol A triol in which three hydroxy groups are substituted onto a benzene ring. Graph benzenetriols|trihydroxybenzenes benzenetriols|trihydroxybenzenes http://purl.obolibrary.org/obo/CHEBI_22707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22712 biolink:ChemicalEntity benzenes Any benzenoid aromatic compound consisting of the benzene skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22713 biolink:ChemicalEntity arenesulfonate oxoanion Graph arenesulfonates arenesulfonates http://purl.obolibrary.org/obo/CHEBI_22713 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22715 biolink:ChemicalEntity benzimidazoles An organic heterocyclic compound containing a benzene ring fused to an imidazole ring. Graph http://purl.obolibrary.org/obo/CHEBI_22715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22718 biolink:ChemicalEntity benzoates A monocarboxylic acid anion obtained by deprotonation of the carboxy group of any benzoic acid. Graph benzoate anion benzoate anion http://purl.obolibrary.org/obo/CHEBI_22718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22720 biolink:ChemicalEntity benzodiazepine A group of heterocyclic compounds with a core structure containing a benzene ring fused to a diazepine ring. Graph benzodiazepines benzodiazepines http://purl.obolibrary.org/obo/CHEBI_22720 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22723 biolink:ChemicalEntity benzoic acids Any aromatic carboxylic acid that consists of benzene in which at least a single hydrogen has been substituted by a carboxy group. Graph http://purl.obolibrary.org/obo/CHEBI_22723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22726 biolink:ChemicalEntity benzophenones Any aromatic ketone in which the carbonyl group is bonded to 2 phenyl groups. Graph http://purl.obolibrary.org/obo/CHEBI_22726 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22727 biolink:ChemicalEntity benzopyran wikipedia.en:Benzopyran Graph benzopyrans benzopyrans http://purl.obolibrary.org/obo/CHEBI_22727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22728 biolink:ChemicalEntity benzopyrrole Graph benzopyrroles benzopyrroles http://purl.obolibrary.org/obo/CHEBI_22728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22729 biolink:ChemicalEntity benzoquinones Any quinone resulting from the formal oxidation of catechol, hydroquinone, or their C-substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22730 biolink:ChemicalEntity benzosemiquinones A semiquinone derived from a benzoquinone by formal addition of one hydrogen atom with its electron. Graph http://purl.obolibrary.org/obo/CHEBI_22730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22736 biolink:ChemicalEntity benzoyl-CoAs Any aroyl-CoA in which the aroyl group is specified as benzoyl or its substituted derivative. Graph http://purl.obolibrary.org/obo/CHEBI_22736 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2274 biolink:ChemicalEntity 7-methylguanine A methylguanine that is guanine substituted by a methyl group at position 7. It is a metabolite obtained during the methylation of DNA. kegg.compound:C02242|pubmed:16059882 Graph 7-Methylguanine 7-Methylguanine http://purl.obolibrary.org/obo/CHEBI_2274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22743 biolink:ChemicalEntity benzyl alcohols Compounds containing a phenylmethanol skeleton. Graph benzylic alcohol|benzylic alcohols benzylic alcohol|benzylic alcohols http://purl.obolibrary.org/obo/CHEBI_22743 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22744 biolink:ChemicalEntity benzyl group Graph Bn|C6H5-CH2-|benzyl|phenylalanine side-chain|phenylmethyl benzyl Bn|C6H5-CH2-|benzyl|phenylalanine side-chain|phenylmethyl http://purl.obolibrary.org/obo/CHEBI_22744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:227454 biolink:ChemicalEntity Trienomycin A Graph [(8E,10E,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] 2-(cyclohexanecarbonylamino)propanoate [(8E,10E,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] 2-(cyclohexanecarbonylamino)propanoate [(8E,10E,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] 2-(cyclohexanecarbonylamino)propanoate http://purl.obolibrary.org/obo/CHEBI_227454 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22746 biolink:ChemicalEntity 2-benzylsuccinyl-CoA An ω-carboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-benzylsuccinic acid. Graph 2-benzylsuccinoyl-coenzyme A|2-benzylsuccinyl-CoA|2-benzylsuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-benzyl-3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Benzylsuccinyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-benzyl-3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-benzylsuccinoyl-coenzyme A|2-benzylsuccinyl-CoA|2-benzylsuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2-benzyl-3-carboxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|Benzylsuccinyl-CoA http://purl.obolibrary.org/obo/CHEBI_22746 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22748 biolink:ChemicalEntity benzyl 2-methyl-3-hydroxybutanoate A fatty acid ester obtained by the formal condensation of hydroxy group of benzyl alcohol with the carboxy group of 3-hydroxy-2-methylbutanoic acid. Graph benzyl 3-hydroxy-2-methylbutanoate benzyl 3-hydroxy-2-methylbutanoate benzyl 3-hydroxy-2-methylbutanoate http://purl.obolibrary.org/obo/CHEBI_22748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22750 biolink:ChemicalEntity benzylisoquinoline alkaloid Any isoquinoline alkaloid based on a benzylisoquinoline skeleton. Graph benzylisoquinoline alkaloids benzylisoquinoline alkaloids http://purl.obolibrary.org/obo/CHEBI_22750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22754 biolink:ChemicalEntity berberine alkaloid Graph berberine alkaloid|berberine alkaloids|berberines berberine alkaloid|berberine alkaloids|berberines http://purl.obolibrary.org/obo/CHEBI_22754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22778 biolink:ChemicalEntity beta-D-galactosyl groups Any galactosyl group obtained by removing the hydroxy group from the hemiacetal function of β-D-galactose or of an oligosaccharide with β-D-galactose at its reducing end. Graph http://purl.obolibrary.org/obo/CHEBI_22778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22798 biolink:ChemicalEntity beta-D-glucoside Any D-glucoside in which the anomeric centre has β-configuration. kegg.compound:C00963 Graph a beta-D-glucoside|beta-D-glucoside|beta-D-glucosides a beta-D-glucoside|beta-D-glucoside|beta-D-glucosides http://purl.obolibrary.org/obo/CHEBI_22798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22801 biolink:ChemicalEntity beta-D-glucosyl-N-acylsphingosine A D-glucosyl-N-acylsphingosine in which the glucosyl head group has β-configuration at the anomeric centre. metacyc.compound:Glucosyl-acyl-sphingosines|pubmed:10320813|pubmed:1551920|pubmed:19818503|pubmed:2448252|pubmed:7150587|pubmed:9593693 Graph GlcCer|N-[(2S,3R,4E)-1-(beta-D-glucopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]alkanamide|a beta-D-glucosyl-(1<->1')-N-acylsphing-4-enine|beta-D-Glc-(1<->1)-Cer|beta-D-Glc-Cer|beta-D-Glcp-(1<->1)-Cer|beta-D-Glcp-Cer|beta-D-glucosyl-(1<->1)-ceramide|beta-D-glucosylceramide|beta-D-glucosylceramides N-[(2S,3R,4E)-1-(beta-D-glucopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]alkanamide GlcCer|N-[(2S,3R,4E)-1-(beta-D-glucopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]alkanamide|a beta-D-glucosyl-(1<->1')-N-acylsphing-4-enine|beta-D-Glc-(1<->1)-Cer|beta-D-Glc-Cer|beta-D-Glcp-(1<->1)-Cer|beta-D-Glcp-Cer|beta-D-glucosyl-(1<->1)-ceramide|beta-D-glucosylceramide|beta-D-glucosylceramides http://purl.obolibrary.org/obo/CHEBI_22801 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:228138 biolink:ChemicalEntity antinociceptive agent Any agent that inhibits nociception. pubmed:37851902 Graph antinociceptive agents antinociceptive agents http://purl.obolibrary.org/obo/CHEBI_228138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:228187 biolink:ChemicalEntity hexacosanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of twenty-six carbon atoms. Graph hexacosanols|hydroxyhexacosane|hydroxyhexacosanes hexacosanols|hydroxyhexacosane|hydroxyhexacosanes http://purl.obolibrary.org/obo/CHEBI_228187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:228218 biolink:ChemicalEntity urobilinogen(2-) metacyc.compound:CPD-17978|pubmed:38172624 Graph urobilinogen urobilinogen http://purl.obolibrary.org/obo/CHEBI_228218 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22823 biolink:ChemicalEntity beta-alanine derivative Graph beta-alanine derivatives beta-alanine derivatives http://purl.obolibrary.org/obo/CHEBI_22823 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:228231 biolink:ChemicalEntity 1,2-diacyl-3-linoleoylglycerol A triglyceride where at least one of the primary OH groups in the glycerol backbone has a linoleoyl chain. Graph 1-(9Z,12Z-octadecadienoyl)-2,3-diacylglycerol|1-linoleoyl-2,3-diacylglycerol|a 1,2-diacyl-3-(9Z,12Z-octadecadienoyl)-glycerol 1-(9Z,12Z-octadecadienoyl)-2,3-diacylglycerol|1-linoleoyl-2,3-diacylglycerol|a 1,2-diacyl-3-(9Z,12Z-octadecadienoyl)-glycerol http://purl.obolibrary.org/obo/CHEBI_228231 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:228232 biolink:ChemicalEntity 1,3-diacyl-2-linoleoylglycerol A triglyceride where at least the sn-2 position in the glycerol backbone has a linoleoyl chain. Graph 1,3-diacyl-2-(9Z,12Z-octadecadienoyl)-glycerol|a 1,3-diacyl-2-(9Z,12Z-octadecadienoyl)-glycerol 1,3-diacyl-2-(9Z,12Z-octadecadienoyl)-glycerol|a 1,3-diacyl-2-(9Z,12Z-octadecadienoyl)-glycerol http://purl.obolibrary.org/obo/CHEBI_228232 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:228254 biolink:ChemicalEntity beta-D-galactosyl-5''-O-queuosine 5'-phosphate(1-) residue pubmed:37992713 Graph beta-D-galactosyl-5''-O-queuosine 5'-phosphate residue beta-D-galactosyl-5''-O-queuosine 5'-phosphate residue http://purl.obolibrary.org/obo/CHEBI_228254 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:228255 biolink:ChemicalEntity (R)-3-methyl-2-oxovalerate pubmed:31420577 Graph (3R)-3-methyl-2-oxopentanoate|(R)-3-methyl-2-oxopentanoate (3R)-3-methyl-2-oxopentanoate|(R)-3-methyl-2-oxopentanoate http://purl.obolibrary.org/obo/CHEBI_228255 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:228307 biolink:ChemicalEntity Glucogallin chemspider:110791 Graph [(3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl] 3,4,5-trihydroxybenzoate [(3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl] 3,4,5-trihydroxybenzoate [(3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl] 3,4,5-trihydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_228307 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:228364 biolink:ChemicalEntity NMR chemical shift reference compound Any compound that produces a peak used as reference frequency in the δ chemical shift scale. Graph NMR chemical shift reference compounds|NMR chemical shift standard|NMR chemical shift standards|NMR internal standard|NMR internal standards|NMR reference standard|NMR reference standards NMR chemical shift reference compounds|NMR chemical shift standard|NMR chemical shift standards|NMR internal standard|NMR internal standards|NMR reference standard|NMR reference standards http://purl.obolibrary.org/obo/CHEBI_228364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22838 biolink:ChemicalEntity beta-cyclopiazonic acid Graph beta-Cyclopiazonsaeure|beta-Zyklopiazonsaeure beta-Cyclopiazonsaeure|beta-Zyklopiazonsaeure http://purl.obolibrary.org/obo/CHEBI_22838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22860 biolink:ChemicalEntity amino-acid betaine Any amino acid-derived zwitterion - such as glycine betaine (N,N,N-trimethylammonioacetate) - in which the ammonium nitrogen carries methyl substituents and bears no hydrogen atoms. Graph amino acid betaines|amino-acid betaines|betaines amino acid betaines|amino-acid betaines|betaines http://purl.obolibrary.org/obo/CHEBI_22860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22861 biolink:ChemicalEntity betalain Any of a group of coloured alkaloids occurring widely in plants of the order Centrospermae. They are divided into two groups, betacyanins and betaxanthins, and both occur in plant vacuoles. cas:37279-84-8 Graph betalains betalains http://purl.obolibrary.org/obo/CHEBI_22861 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22866 biolink:ChemicalEntity bilanes wikipedia.en:Bilane Graph bilanes|bilinogen bilanes|bilinogen http://purl.obolibrary.org/obo/CHEBI_22866 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22868 biolink:ChemicalEntity bile salt A sodium salt of the conjugate of any bile acid with either glycine or taurine. kegg.compound:C01558 Graph Bile acid|bile salts Bile acid|bile salts http://purl.obolibrary.org/obo/CHEBI_22868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22869 biolink:ChemicalEntity bilins Graph bilins bilins http://purl.obolibrary.org/obo/CHEBI_22869 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:22872 biolink:ChemicalEntity (glucosyluronic acid)bilirubin Graph (glucosyluronic acid)bilirubins|bilirubin glucuronosides (glucosyluronic acid)bilirubins|bilirubin glucuronosides http://purl.obolibrary.org/obo/CHEBI_22872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2288 biolink:ChemicalEntity 7alpha,12alpha-dihydroxy-5beta-cholestan-3-one A 3-oxo-5β-steroid that is 5β-cholestan-3-one bearing two additional hydroxy substituents at positions 7α and 12α. hmdb:HMDB0006887|kegg.compound:C05453|lipidmaps:LMST04030113|metacyc.compound:CPD-10503|reaxys:3163548 Graph 5beta-Cholesten-7alpha,12alpha-diol-3-one|5beta-cholestane-7alpha,12alpha-diol-3-one|7-alpha,12-alpha-dihydroxy-5-beta-cholestan-3-one|7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one|7alpha,12alpha-dihydroxy-5beta-cholestan-3-one 7alpha,12alpha-dihydroxy-5beta-cholestan-3-one 5beta-Cholesten-7alpha,12alpha-diol-3-one|5beta-cholestane-7alpha,12alpha-diol-3-one|7-alpha,12-alpha-dihydroxy-5-beta-cholestan-3-one|7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one|7alpha,12alpha-dihydroxy-5beta-cholestan-3-one http://purl.obolibrary.org/obo/CHEBI_2288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:228804 biolink:ChemicalEntity primary methyl ammonium ion An ammonium ion derivative resulting from the protonation of the nitrogen atom of a primary methyl amino compound. Major species at pH 7.3. Graph a primary methyl amine a primary methyl amine http://purl.obolibrary.org/obo/CHEBI_228804 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22881 biolink:ChemicalEntity biopterins metacyc.compound:All-Biopterines Graph http://purl.obolibrary.org/obo/CHEBI_22881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22888 biolink:ChemicalEntity biphenyls Benzenoid aromatic compounds containing two phenyl or substituted-phenyl groups which are joined together by a single bond. Graph http://purl.obolibrary.org/obo/CHEBI_22888 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22894 biolink:ChemicalEntity Mo(=O)-bis(molybdopterin guanine dinucleotide) An Mo-molybdopterin cofactor comprising two molecules of molybdopterin guanine dinucleotide attached via their sulfur atoms to a central Mo(=O) moiety. Graph Mo(Dtpp-mGDP)2|bis(molybdopterin guanine dinucleotide)molybdenum|bis{5'-O-[{[{[(5aR,8R,9aR)-2-amino-4-oxo-6,7-bis(sulfanyl-kappaS)-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosinato(2-)}(oxido)molybdenum|molybdate-bis(molybdopterin guanine dinucleotide) bis{5'-O-[{[{[(5aR,8R,9aR)-2-amino-4-oxo-6,7-bis(sulfanyl-kappaS)-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosinato(2-)}(oxido)molybdenum Mo(Dtpp-mGDP)2|bis(molybdopterin guanine dinucleotide)molybdenum|bis{5'-O-[{[{[(5aR,8R,9aR)-2-amino-4-oxo-6,7-bis(sulfanyl-kappaS)-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosinato(2-)}(oxido)molybdenum|molybdate-bis(molybdopterin guanine dinucleotide) http://purl.obolibrary.org/obo/CHEBI_22894 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22899 biolink:ChemicalEntity bisdechlorogeodin beilstein:1299115|cas:3209-31-2 Graph 4-hydroxy-6'-methoxy-6-methyl-3,4'-dioxo-spiro(benzofuran-2(3H),1'-(2,5)cyclohexadiene)-2'-carboxylic acid methyl ester|bis-dechlorogeodin|bisdechlorogeodin|methyl 4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate methyl 4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate 4-hydroxy-6'-methoxy-6-methyl-3,4'-dioxo-spiro(benzofuran-2(3H),1'-(2,5)cyclohexadiene)-2'-carboxylic acid methyl ester|bis-dechlorogeodin|bisdechlorogeodin|methyl 4-hydroxy-6-methyl-4'-oxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate http://purl.obolibrary.org/obo/CHEBI_22899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2290 biolink:ChemicalEntity 7alpha-hydroxy-5beta-cholestan-3-one A 3-oxo-5β-steroid that is 5β-cholestan-3-one bearing an additional hydroxy substituent at position 7α . beilstein:2300476|hmdb:HMDB0006892|kegg.compound:C05451|lipidmaps:LMST04030112|metacyc.compound:CPD-10548|reaxys:3159830 Graph 5beta-Cholestan-7alpha-ol-3-one|5beta-cholestan-7alpha-ol-3-one|7-alpha-hydroxy-5-beta-cholestan-3-one|7alpha-Hydroxy-5beta-cholestan-3-one|7alpha-hydroxy-5beta-cholestan-3-one 7alpha-hydroxy-5beta-cholestan-3-one 5beta-Cholestan-7alpha-ol-3-one|5beta-cholestan-7alpha-ol-3-one|7-alpha-hydroxy-5-beta-cholestan-3-one|7alpha-Hydroxy-5beta-cholestan-3-one|7alpha-hydroxy-5beta-cholestan-3-one http://purl.obolibrary.org/obo/CHEBI_2290 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22901 biolink:ChemicalEntity bisphenol By usage, the methylenediphenols, HOC6H4CH2C6H4OH, commonly p,p-methylenediphenol, and their substitution products (generally derived from condensation of two equivalent amounts of a phenol with an aldehyde or ketone). The term also includes analogues in the the methylene (or substituted methylene) group has been replaced by a heteroatom. wikipedia.en:Bisphenol Graph bisphenols bisphenols http://purl.obolibrary.org/obo/CHEBI_22901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22902 biolink:ChemicalEntity bisphosphoglyceric acid A glyceric acid phosphate in which both of the hydroxy groups have been phosphorylated. Graph bisphosphoglyceric acid|bisphosphoglyceric acids bisphosphoglyceric acid|bisphosphoglyceric acids http://purl.obolibrary.org/obo/CHEBI_22902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22905 biolink:ChemicalEntity blasticidin Graph blasticidins blasticidins http://purl.obolibrary.org/obo/CHEBI_22905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22907 biolink:ChemicalEntity bleomycin A glycopeptide produced by the bacterium Streptomyces verticillus. The term, 'bleomycin' refers to a family of structurally related compounds. When used as an anti-cancer agent, the chemotherapeutical forms are primarily bleomycin A2 and B2. drugbank:DB00290|wikipedia.en:Bleomycin Graph http://purl.obolibrary.org/obo/CHEBI_22907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22908 biolink:ChemicalEntity borate gmelin:164057 Graph (BO3)3-|BO3(3-)|[BO3](3-)|borate|borate ion|trioxidoborate(3-)|trioxoborate(3-) ion|trioxoborate(III) anion borate|trioxidoborate(3-) (BO3)3-|BO3(3-)|[BO3](3-)|borate|borate ion|trioxidoborate(3-)|trioxoborate(3-) ion|trioxoborate(III) anion http://purl.obolibrary.org/obo/CHEBI_22908 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22909 biolink:ChemicalEntity borate ion Any inorganic anion that is formally derived from boric acid. The term includes polymeric anions containing chains of BO3 structural units sharing one oxygen atom (e.g. di-, tri-, and tetraborates) as well as chains or rings sharing two oxygen atoms (e.g. metaborates). wikipedia.en:Borate Graph borate anions|borate ion|borate ions borate anions|borate ion|borate ions http://purl.obolibrary.org/obo/CHEBI_22909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22912 biolink:ChemicalEntity bornane monoterpenoid Graph bornane monoterpenoids bornane monoterpenoids http://purl.obolibrary.org/obo/CHEBI_22912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22916 biolink:ChemicalEntity boron molecular entity Graph boron compounds|boron molecular entities|boron molecular entity boron compounds|boron molecular entities|boron molecular entity http://purl.obolibrary.org/obo/CHEBI_22916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22917 biolink:ChemicalEntity phytogenic insecticide An insecticide compound naturally occurring in plants. Graph botanical insecticide|botanical insecticides|phytogenic insecticides botanical insecticide|botanical insecticides|phytogenic insecticides http://purl.obolibrary.org/obo/CHEBI_22917 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22918 biolink:ChemicalEntity branched-chain amino acid Any amino acid in which the parent hydrocarbon chain has one or more alkyl substituents Graph branched chain amino acids branched chain amino acids http://purl.obolibrary.org/obo/CHEBI_22918 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22921 biolink:ChemicalEntity brassinosteroid wikipedia.en:Brassinosteroid Graph brassinosteroids brassinosteroids http://purl.obolibrary.org/obo/CHEBI_22921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22925 biolink:ChemicalEntity bromide salt Graph bromide salts|bromides bromide salts|bromides http://purl.obolibrary.org/obo/CHEBI_22925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22926 biolink:ChemicalEntity bromohydrocarbon A compound derived from a hydrocarbon by replacing a hydrogen atom with a bromine atom. Graph brominated hydrocarbons|bromohydrocarbons brominated hydrocarbons|bromohydrocarbons http://purl.obolibrary.org/obo/CHEBI_22926 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22927 biolink:ChemicalEntity bromine atom webelements:Br Graph 35Br|Br|Brom|brome|bromine|bromo|bromum bromine 35Br|Br|Brom|brome|bromine|bromo|bromum http://purl.obolibrary.org/obo/CHEBI_22927 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22928 biolink:ChemicalEntity bromine molecular entity Graph bromine compounds|bromine molecular entities|bromine molecular entity bromine compounds|bromine molecular entities|bromine molecular entity http://purl.obolibrary.org/obo/CHEBI_22928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22929 biolink:ChemicalEntity bromoalkane Any haloalkane that consists of an alkane substituted by at least one bromine atom. Graph alkyl bromide|alkyl bromides|bromoalkanes alkyl bromide|alkyl bromides|bromoalkanes http://purl.obolibrary.org/obo/CHEBI_22929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22930 biolink:ChemicalEntity bromoamino acid An amino acid containing at least one bromo substituent. Graph http://purl.obolibrary.org/obo/CHEBI_22930 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22934 biolink:ChemicalEntity bufanolide Graph bufanolide bufanolide bufanolide http://purl.obolibrary.org/obo/CHEBI_22934 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22939 biolink:ChemicalEntity butanals An aldehyde based on a butanal skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22939 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22944 biolink:ChemicalEntity butanediols A diol that is a butanediol or a derivative of a butanediol. Graph http://purl.obolibrary.org/obo/CHEBI_22944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229467 biolink:ChemicalEntity D-hexose 6-phosphate(2-) A D-hexose phosphate(2−) that is the conjugate base of D-hexose 6-phosphate resulting from the deprotonation of the phosphate OH groups; Major microspecies at pH 7.3. Graph a D-hexose 6-phosphate a D-hexose 6-phosphate http://purl.obolibrary.org/obo/CHEBI_229467 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22950 biolink:ChemicalEntity butan-4-olide Any γ-lactone having the lactone moiety derived from 4-hydroxybutanoic acid. Graph butan-4-olides|butanolide butan-4-olides|butanolide http://purl.obolibrary.org/obo/CHEBI_22950 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22951 biolink:ChemicalEntity butanone Any ketone that is butane substituted by an oxo group at unspecified position. Graph butanones butanones http://purl.obolibrary.org/obo/CHEBI_22951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229537 biolink:ChemicalEntity rebaudioside B A rebaudioside that is steviol in which the hydroxy group is replaced by a β-D-glucopyranosyl-(1→2)-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl group. cas:58543-17-2|foodb.food:FDB013542|hmdb:HMDB0034949|knapsack:C00057458|lipidmaps:LMPR01040125|pubmed:10737190|pubmed:22580424|pubmed:23203115|pubmed:23451373|pubmed:23896597|pubmed:24361573|pubmed:25296637|pubmed:27513814|pubmed:30897351|pubmed:31491712|pubmed:33218179 Graph (4alpha)-13-[(O-beta-D-Glucopyranosyl-(1->2)-O-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl)oxy]kaur-16-en-18-oic acid|13alpha-{[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|Reb B|stevioside a4 13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid (4alpha)-13-[(O-beta-D-Glucopyranosyl-(1->2)-O-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl)oxy]kaur-16-en-18-oic acid|13alpha-{[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|13alpha-{[beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl]oxy}-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid|Reb B|stevioside a4 http://purl.obolibrary.org/obo/CHEBI_229537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22954 biolink:ChemicalEntity butanoyl-CoAs Any short-chain fatty acyl-CoA in which the acyl group specified is butanoyl or its substituted derivative. Graph butanoyl-CoAs butanoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_22954 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229543 biolink:ChemicalEntity sulbactam(1-) A monocarboxylic acid anion that is the conjugate base of sulbactam resulting from the deprotonation of the carboxy group; Major species at pH 7.3. Graph (2S,5R)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4,4-dioxide|sulbactam anion (2S,5R)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4,4-dioxide (2S,5R)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4,4-dioxide|sulbactam anion http://purl.obolibrary.org/obo/CHEBI_229543 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229555 biolink:ChemicalEntity 6-O-methyldeacetylisoipecoside(1+) An organic cation that is the conjugate acid of 6-O-methyldeacetylisoipecoside, arising from protonation of the secondary amino group; major species at pH 7.3 Graph 6-O-methyldeacetylisoipecoside 6-O-methyldeacetylisoipecoside http://purl.obolibrary.org/obo/CHEBI_229555 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229556 biolink:ChemicalEntity 6-O-methyldeacetylisoipecoside aglycone(1+) An organic cation that is the conjugate acid of 6-O-methyldeacetylisoipecoside aglycone, arising from protonation of the secondary amino group; major species at pH 7.3. metacyc.compound:CPD-14813|pubmed:18927081 Graph 6-O-methyldeacetylisoipecoside aglycone 6-O-methyldeacetylisoipecoside aglycone http://purl.obolibrary.org/obo/CHEBI_229556 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229573 biolink:ChemicalEntity puerarin(1-) pubmed:25199800|pubmed:34728636 Graph puerarin puerarin http://purl.obolibrary.org/obo/CHEBI_229573 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229578 biolink:ChemicalEntity a 2-iminiocarboxylate Graph a 2-iminocarboxylate a 2-iminocarboxylate http://purl.obolibrary.org/obo/CHEBI_229578 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229579 biolink:ChemicalEntity di-L-cysteinyl-trisulfide residue Two L-cysteine residues linked by a trisulfide bridge pubmed:26680199 Graph di-L-cysteinyl-trisulfide residue di-L-cysteinyl-trisulfide residue http://purl.obolibrary.org/obo/CHEBI_229579 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22958 biolink:ChemicalEntity butenedioic acid beilstein:8132074 Graph 2-butenedioic acid|but-2-enedioic acid but-2-enedioic acid 2-butenedioic acid|but-2-enedioic acid http://purl.obolibrary.org/obo/CHEBI_22958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22959 biolink:ChemicalEntity butenoic acid Any C4, straight-chain fatty acid containing one double bond. drugbank:DB02074 Graph butenoic acid butenoic acid butenoic acid http://purl.obolibrary.org/obo/CHEBI_22959 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22961 biolink:ChemicalEntity butenoyl-CoA Graph butenoyl-CoAs butenoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_22961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229627 biolink:ChemicalEntity long-chain fatty acyl-L-carnitine Graph a long-chain fatty acyl-L-carnitine|long-chain fatty acyl-(R)-carnitine a long-chain fatty acyl-L-carnitine|long-chain fatty acyl-(R)-carnitine http://purl.obolibrary.org/obo/CHEBI_229627 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229628 biolink:ChemicalEntity medium-chain fatty acyl-L-carnitine Graph a medium-chain fatty acyl-L-carnitine|medium-chain fatty acyl-(R)-carnitine a medium-chain fatty acyl-L-carnitine|medium-chain fatty acyl-(R)-carnitine http://purl.obolibrary.org/obo/CHEBI_229628 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229629 biolink:ChemicalEntity short-chain fatty acyl-L-carnitine Graph a short-chain fatty acyl-L-carnitine|short-chain fatty acyl-(R)-carnitine a short-chain fatty acyl-L-carnitine|short-chain fatty acyl-(R)-carnitine http://purl.obolibrary.org/obo/CHEBI_229629 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229639 biolink:ChemicalEntity S-(alpha-chlorocarboxymethyl)glutathione Product of glutathion transfer onto dichloroacette (DCA), catalyzed by GSTZ1 pubmed:11327815 Graph http://purl.obolibrary.org/obo/CHEBI_229639 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229647 biolink:ChemicalEntity gepirone(1+) A tertiary ammonium ion that is conjugate acid of gepirone resulting from the protonation of the piperazine nitrogen; Major species at pH 7.3. Graph 1-[4-(4,4-dimethyl-2,6-dioxopiperidin-1-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium|gepirone cation 1-[4-(4,4-dimethyl-2,6-dioxopiperidin-1-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium 1-[4-(4,4-dimethyl-2,6-dioxopiperidin-1-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium|gepirone cation http://purl.obolibrary.org/obo/CHEBI_229647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22965 biolink:ChemicalEntity butanamides A fatty amide derived based on a butanamide skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_22965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229668 biolink:ChemicalEntity complement component 5 inhibitor Any inhibitor of complement component 5. wikipedia.en:Complement_component_5 Graph C5 inhibitor|C5 inhibitors|complement component 5 inhibitors C5 inhibitor|C5 inhibitors|complement component 5 inhibitors http://purl.obolibrary.org/obo/CHEBI_229668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229684 biolink:ChemicalEntity fatty amide anion The conjugate base of a fatty amide, arising from deprotonation of the carboxylic acid group of the corresponding fatty amide. Graph fatty amide anions fatty amide anions http://purl.obolibrary.org/obo/CHEBI_229684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229687 biolink:ChemicalEntity pentostatin(1+) An organic cation that is the conjugate acid of pentostatin arising from protonation of the imine nitrogen; Major microspecies at pH 7.3. pubmed:29056419 Graph (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-8-hydroxy-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-4-ium|pentostatin|pentostatin cation (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-8-hydroxy-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-4-ium (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-8-hydroxy-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-4-ium|pentostatin|pentostatin cation http://purl.obolibrary.org/obo/CHEBI_229687 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22970 biolink:ChemicalEntity butynediol Any acetylenic compound that is butyne substituted by two hydroxy groups at unspecified positions. Graph butynediols butynediols http://purl.obolibrary.org/obo/CHEBI_22970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229701 biolink:ChemicalEntity cis-4-hydroxycyclohexane-1-carboxylate The conjugate base of cis-4-hydroxycyclohexane-1-carboxylic acid; major species at pH 7.3. metacyc.compound:CPD-26867|pubmed:34583900 Graph cis-4-hydroxycyclohexane-1-carboxylate cis-4-hydroxycyclohexane-1-carboxylate http://purl.obolibrary.org/obo/CHEBI_229701 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229709 biolink:ChemicalEntity N-choloyl-L-alpha-amino acid anion The conjugate base of an N-choloyl-L-α-amino acid. pubmed:38326608|pubmed:38326609 Graph an N-choloyl-L-alpha-amino acid an N-choloyl-L-alpha-amino acid http://purl.obolibrary.org/obo/CHEBI_229709 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229710 biolink:ChemicalEntity L-alanocholate pubmed:38326608|pubmed:38326609 Graph AlaCA|L-alanocholate|N-choloyl-L-alanine(1-) AlaCA|L-alanocholate|N-choloyl-L-alanine(1-) http://purl.obolibrary.org/obo/CHEBI_229710 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229711 biolink:ChemicalEntity L-serocholate pubmed:38326608|pubmed:38326609 Graph L-serocholate|N-choloyl-L-serine(1-)|SerCA L-serocholate|N-choloyl-L-serine(1-)|SerCA http://purl.obolibrary.org/obo/CHEBI_229711 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229712 biolink:ChemicalEntity L-histidocholate pubmed:38326608 Graph HisCA|L-histidocholate|N-choloyl-L-histidine(1-) HisCA|L-histidocholate|N-choloyl-L-histidine(1-) http://purl.obolibrary.org/obo/CHEBI_229712 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229713 biolink:ChemicalEntity L-arginocholate pubmed:38326608 Graph ArgCA|L-arginocholate|N-choloyl-L-arginine ArgCA|L-arginocholate|N-choloyl-L-arginine http://purl.obolibrary.org/obo/CHEBI_229713 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229714 biolink:ChemicalEntity L-phenylalanocholate pubmed:38326608 Graph L-phenylalanocholate|N-choloyl-L-penylalanine(1-)|PheCA L-phenylalanocholate|N-choloyl-L-penylalanine(1-)|PheCA http://purl.obolibrary.org/obo/CHEBI_229714 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229723 biolink:ChemicalEntity S-(hydroxysulfenamide)glutathione(1-) An hydroxysulfenamide glutathione peptide anion; major microspecies at pH 7.3. metacyc.compound:CPD-19217|pubmed:30795534 Graph GSNHOH|S-(hydroxysulfenamide)glutathione GSNHOH|S-(hydroxysulfenamide)glutathione http://purl.obolibrary.org/obo/CHEBI_229723 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:229728 biolink:ChemicalEntity 3,4-dimethoxy-(E)-cinnamate A cinnamate that is the conjugate base of 3,4-dimethoxycinnamic acid resulting from the deprotonation of the carboxy group; Major microspecies at pH 7.3. pubmed:38415939 Graph (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate|(E)-3,4-dimethoxycinnamate|(E)-3-(3,4-dimethoxyphenyl)prop-2-enoate|3,4-dimethoxy-(E)-cinnamate|3,4-dimethoxy-trans-cinnamate|3,4-dimethoxycinnamate|3-(3,4-dimethoxyphenyl)-(E)-2-propenoate (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate|(E)-3,4-dimethoxycinnamate|(E)-3-(3,4-dimethoxyphenyl)prop-2-enoate|3,4-dimethoxy-(E)-cinnamate|3,4-dimethoxy-trans-cinnamate|3,4-dimethoxycinnamate|3-(3,4-dimethoxyphenyl)-(E)-2-propenoate http://purl.obolibrary.org/obo/CHEBI_229728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22976 biolink:ChemicalEntity cadinene Any sesquiterpene having a cadinane skeleton containing one or more C=C bonds. wikipedia.en:Cadinene Graph cadinenes cadinenes http://purl.obolibrary.org/obo/CHEBI_22976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22977 biolink:ChemicalEntity cadmium atom cas:7440-43-9|kegg.compound:C01413|webelements:Cd Graph 48Cd|Cd|Kadmium|cadmio|cadmium cadmium 48Cd|Cd|Kadmium|cadmio|cadmium http://purl.obolibrary.org/obo/CHEBI_22977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22978 biolink:ChemicalEntity cadmium molecular entity Graph cadmium compounds|cadmium molecular entities cadmium compounds|cadmium molecular entities http://purl.obolibrary.org/obo/CHEBI_22978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22984 biolink:ChemicalEntity calcium atom cas:7440-70-2|drugbank:DB01373|kegg.compound:C00076|webelements:Ca Graph 20Ca|Ca|Calcium|Kalzium|calcio|calcium calcium 20Ca|Ca|Calcium|Kalzium|calcio|calcium http://purl.obolibrary.org/obo/CHEBI_22984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22985 biolink:ChemicalEntity calcium molecular entity Graph calcium compounds|calcium molecular entities|calcium molecular entity calcium compounds|calcium molecular entities|calcium molecular entity http://purl.obolibrary.org/obo/CHEBI_22985 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22986 biolink:ChemicalEntity calcium ionophore Graph calcium ionophores calcium ionophores http://purl.obolibrary.org/obo/CHEBI_22986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:22990 biolink:ChemicalEntity camalexin An indole phytoalexin that is indole substituted at position 3 by a 1,3-thiazol-2-yl group. metacyc.compound:THIAZOL-YL-INDOLE|pubmed:19567706|pubmed:21239642|pubmed:21910963|pubmed:21985584|pubmed:22209038|pubmed:22295908|pubmed:22342657|pubmed:22350766|pubmed:22392279|pubmed:22522512|pubmed:22624950|pubmed:22783269|reaxys:4310041 Graph 3-(1,3-thiazol-2-yl)-1H-indole|3-thiazol-2'-yl-indole|camalexin 3-(1,3-thiazol-2-yl)-1H-indole 3-(1,3-thiazol-2-yl)-1H-indole|3-thiazol-2'-yl-indole|camalexin http://purl.obolibrary.org/obo/CHEBI_22990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:229947 biolink:ChemicalEntity CMP-N-beta-acetyl-9-O-acetylneuraminate(2-) pubmed:18508039|pubmed:26169044 Graph CMP-N-acetyl-9-O-acetyl-beta-neuraminate|CMP-Neu5,9Ac2(2-) CMP-N-acetyl-9-O-acetyl-beta-neuraminate|CMP-Neu5,9Ac2(2-) http://purl.obolibrary.org/obo/CHEBI_229947 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:22998 biolink:ChemicalEntity canadine A berberine alkaloid that is 5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline substituted by methoxy groups at positions 9 and 10. cas:522-97-4|lincs.smallmolecule:LSM-21633|pubmed:23747414|pubmed:24324259|pubmed:25093987|reaxys:96683|wikipedia.en:Canadine Graph 5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine|5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)benzo-1,3-dioxolo(5,6-a)quinolizine|9,10-dimethoxy-2,3-(methylenedioxy)berbine|9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|Canadin|tetrahydroberberine|xanthopuccine 9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline 5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine|5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)benzo-1,3-dioxolo(5,6-a)quinolizine|9,10-dimethoxy-2,3-(methylenedioxy)berbine|9,10-dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline|Canadin|tetrahydroberberine|xanthopuccine http://purl.obolibrary.org/obo/CHEBI_22998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23000 biolink:ChemicalEntity caprolactams A lactam in which the amide bond is contained within a seven-membered ring, which includes the amide nitrogen and the carbonyl carbon. Graph http://purl.obolibrary.org/obo/CHEBI_23000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23003 biolink:ChemicalEntity carbamate ester Any ester of carbamic acid or its N-substituted derivatives. wikipedia.en:Carbamate Graph carbamate esters|carbamates carbamate esters|carbamates http://purl.obolibrary.org/obo/CHEBI_23003 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23004 biolink:ChemicalEntity carbamoyl group The univalent carboacyl group formed by loss of -OH from the carboxy group of carbamic acid. pubmed:24168430 Graph -C(O)NH2|-CONH2|aminocarbonyl|carbamoyl|carbamyl|carbamyl group|carboxamide carbamoyl -C(O)NH2|-CONH2|aminocarbonyl|carbamoyl|carbamyl|carbamyl group|carboxamide http://purl.obolibrary.org/obo/CHEBI_23004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23007 biolink:ChemicalEntity carbohydrate-containing antibiotic Any carbohydrate derivative that exhibits antibiotic activity. Graph http://purl.obolibrary.org/obo/CHEBI_23007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23012 biolink:ChemicalEntity carbon disulfide cas:75-15-0|kegg.compound:C19033|ppdb:2724|umbbd.compound:c0561 Graph CS2|Carbon disulfide|carbon disulfide|carbon disulphide|disulfidocarbon carbon disulfide|disulfidocarbon CS2|Carbon disulfide|carbon disulfide|carbon disulphide|disulfidocarbon http://purl.obolibrary.org/obo/CHEBI_23012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23014 biolink:ChemicalEntity carbon oxide Graph carbon oxides|oxides of carbon carbon oxides|oxides of carbon http://purl.obolibrary.org/obo/CHEBI_23014 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23016 biolink:ChemicalEntity carbonates Organooxygen compounds that are salts or esters of carbonic acid, H2CO3. Graph http://purl.obolibrary.org/obo/CHEBI_23016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23018 biolink:ChemicalEntity EC 4.2.1.1 (carbonic anhydrase) inhibitor An EC 4.2.1.* (hydro-lyases) inhibitor that interferes with the action of carbonic anhydrase (EC 4.2.1.1). Such compounds reduce the secretion of H+ ions by the proximal kidney tubule. wikipedia.en:Carbonic_anhydrase_inhibitor Graph EC 4.2.1.1 (carbonic anhydrase) inhibitors|EC 4.2.1.1 inhibitor|EC 4.2.1.1 inhibitors|anhydrase inhibitor|anhydrase inhibitors|carbonate anhydrase inhibitor|carbonate anhydrase inhibitors|carbonate dehydratase inhibitor|carbonate dehydratase inhibitors|carbonate hydro-lyase (carbon-dioxide-forming) inhibitor|carbonate hydro-lyase (carbon-dioxide-forming) inhibitors|carbonate hydro-lyase inhibitor|carbonate hydro-lyase inhibitors|carbonic acid anhydrase inhibitor|carbonic acid anhydrase inhibitors|carbonic anhydrase (EC 4.2.1.1) inhibitor|carbonic anhydrase (EC 4.2.1.1) inhibitors|carbonic anhydrase A inhibitor|carbonic anhydrase A inhibitors|carbonic anhydrase inhibitor|carbonic anhydrase inhibitors|carboxyanhydrase inhibitor|carboxyanhydrase inhibitors EC 4.2.1.1 (carbonic anhydrase) inhibitors|EC 4.2.1.1 inhibitor|EC 4.2.1.1 inhibitors|anhydrase inhibitor|anhydrase inhibitors|carbonate anhydrase inhibitor|carbonate anhydrase inhibitors|carbonate dehydratase inhibitor|carbonate dehydratase inhibitors|carbonate hydro-lyase (carbon-dioxide-forming) inhibitor|carbonate hydro-lyase (carbon-dioxide-forming) inhibitors|carbonate hydro-lyase inhibitor|carbonate hydro-lyase inhibitors|carbonic acid anhydrase inhibitor|carbonic acid anhydrase inhibitors|carbonic anhydrase (EC 4.2.1.1) inhibitor|carbonic anhydrase (EC 4.2.1.1) inhibitors|carbonic anhydrase A inhibitor|carbonic anhydrase A inhibitors|carbonic anhydrase inhibitor|carbonic anhydrase inhibitors|carboxyanhydrase inhibitor|carboxyanhydrase inhibitors http://purl.obolibrary.org/obo/CHEBI_23018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23019 biolink:ChemicalEntity carbonyl group Graph >C=O|carbonyl|carbonyl group carbonyl >C=O|carbonyl|carbonyl group http://purl.obolibrary.org/obo/CHEBI_23019 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23022 biolink:ChemicalEntity carboxy-2-hydroxymuconate semialdehyde Graph carboxy-2-hydroxymuconate semialdehyde carboxy-2-hydroxymuconate semialdehyde http://purl.obolibrary.org/obo/CHEBI_23022 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23041 biolink:ChemicalEntity carotenal Graph carotenals carotenals http://purl.obolibrary.org/obo/CHEBI_23041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23042 biolink:ChemicalEntity carotene Hydrocarbon carotenoids. Graph carotene|carotenes carotenes carotene|carotenes http://purl.obolibrary.org/obo/CHEBI_23042 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23043 biolink:ChemicalEntity epoxycarotenoid Graph carotenoid epoxides|epoxycarotenoids carotenoid epoxides|epoxycarotenoids http://purl.obolibrary.org/obo/CHEBI_23043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23044 biolink:ChemicalEntity carotenoid One of a class of tetraterpenoids (C40), formally derived from the acyclic parent, ψ,ψ-carotene by hydrogenation, dehydrogenation, cyclization, oxidation, or combination of these processes. This class includes carotenes, xanthophylls and certain compounds that arise from rearrangement of the skeleton of ψ,ψ-carotene or by loss of part of this structure. Retinoids are excluded. cas:36-88-4 Graph carotenes and carotenoids|carotenoid|carotenoids carotenoid carotenes and carotenoids|carotenoid|carotenoids http://purl.obolibrary.org/obo/CHEBI_23044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23045 biolink:ChemicalEntity carotenol Graph carotenols|hydroxycarotenoids carotenols|hydroxycarotenoids http://purl.obolibrary.org/obo/CHEBI_23045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23046 biolink:ChemicalEntity carveol A limonene monoterpenoid that is cyclohex-2-en-1-ol substituted by a methyl group at position 2 and a prop-1-en-2-yl group at position 5. cas:99-48-9|pubmed:23545130|pubmed:24488719|reaxys:1861032 Graph 2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|5-Isopropenyl-2-methyl-2-cyclohexen-1-ol|p-Mentha-1,8-dien-6-ol|p-Mentha-6,8-dien-2-ol 2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol 2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol|5-Isopropenyl-2-methyl-2-cyclohexen-1-ol|p-Mentha-1,8-dien-6-ol|p-Mentha-6,8-dien-2-ol http://purl.obolibrary.org/obo/CHEBI_23046 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:230471 biolink:ChemicalEntity EC 2.4.1.34 (1,3-beta-glucan synthase) inhibitor A EC 2.4.1.* (hexosyltransferase) inhibitor that inhibits the action of 1,3-β-glucan synthase (EC 2.4.1.34). wikipedia.en:1,3-Beta-glucan_synthase Graph (1,3)-beta-glucan (callose) synthase inhibitor|(1,3)-beta-glucan (callose) synthase inhibitors|1,3-beta-D-glucan synthase inhibitor|1,3-beta-D-glucan synthase inhibitors|1,3-beta-D-glucan synthetase inhibitor|1,3-beta-D-glucan synthetase inhibitors|1,3-beta-D-glucan--UDP glucosyltransferase inhibitor|1,3-beta-D-glucan--UDP glucosyltransferase inhibitors|1,3-beta-D-glucan-UDP glucosyltransferase inhibitor|1,3-beta-D-glucan-UDP glucosyltransferase inhibitors|1,3-beta-glucan synthase inhibitor|1,3-beta-glucan synthase inhibitors|1,3-beta-glucan-uridine diphosphoglucosyltransferase inhibitor|1,3-beta-glucan-uridine diphosphoglucosyltransferase inhibitors|EC 2.4.1.34 (1,3-beta-glucan synthase) inhibitors|EC 2.4.1.34 inhibitor|EC 2.4.1.34 inhibitors|GS-II inhibitor|GS-II inhibitors|UDP-glucose--1,3-beta-D-glucan glucosyltransferase inhibitor|UDP-glucose--1,3-beta-D-glucan glucosyltransferase inhibitors|UDP-glucose-1,3-beta-D-glucan glucosyltransferase inhibitor|UDP-glucose-1,3-beta-D-glucan glucosyltransferase inhibitors|UDP-glucose-1,3-beta-glucan glucosyltransferase inhibitor|UDP-glucose-1,3-beta-glucan glucosyltransferase inhibitors|UDP-glucose-beta-glucan glucosyltransferase inhibitor|UDP-glucose-beta-glucan glucosyltransferase inhibitors|UDP-glucose:(1,3)beta-glucan synthase inhibitor|UDP-glucose:(1,3)beta-glucan synthase inhibitors|UDP-glucose:1,3-beta-D-glucan 3-beta-D-glucosyltransferase inhibitor|UDP-glucose:1,3-beta-D-glucan 3-beta-D-glucosyltransferase inhibitors|beta-1,3-glucan synthase inhibitor|beta-1,3-glucan synthase inhibitors|beta-1,3-glucan synthetase inhibitor|beta-1,3-glucan synthetase inhibitors|callose synthase inhibitor|callose synthase inhibitors|callose synthetase inhibitor|callose synthetase inhibitors|paramylon synthetase inhibitor|paramylon synthetase inhibitors|uridine diphosphoglucose-1,3-beta-glucan glucosyltransferase inhibitor|uridine diphosphoglucose-1,3-beta-glucan glucosyltransferase inhibitors (1,3)-beta-glucan (callose) synthase inhibitor|(1,3)-beta-glucan (callose) synthase inhibitors|1,3-beta-D-glucan synthase inhibitor|1,3-beta-D-glucan synthase inhibitors|1,3-beta-D-glucan synthetase inhibitor|1,3-beta-D-glucan synthetase inhibitors|1,3-beta-D-glucan--UDP glucosyltransferase inhibitor|1,3-beta-D-glucan--UDP glucosyltransferase inhibitors|1,3-beta-D-glucan-UDP glucosyltransferase inhibitor|1,3-beta-D-glucan-UDP glucosyltransferase inhibitors|1,3-beta-glucan synthase inhibitor|1,3-beta-glucan synthase inhibitors|1,3-beta-glucan-uridine diphosphoglucosyltransferase inhibitor|1,3-beta-glucan-uridine diphosphoglucosyltransferase inhibitors|EC 2.4.1.34 (1,3-beta-glucan synthase) inhibitors|EC 2.4.1.34 inhibitor|EC 2.4.1.34 inhibitors|GS-II inhibitor|GS-II inhibitors|UDP-glucose--1,3-beta-D-glucan glucosyltransferase inhibitor|UDP-glucose--1,3-beta-D-glucan glucosyltransferase inhibitors|UDP-glucose-1,3-beta-D-glucan glucosyltransferase inhibitor|UDP-glucose-1,3-beta-D-glucan glucosyltransferase inhibitors|UDP-glucose-1,3-beta-glucan glucosyltransferase inhibitor|UDP-glucose-1,3-beta-glucan glucosyltransferase inhibitors|UDP-glucose-beta-glucan glucosyltransferase inhibitor|UDP-glucose-beta-glucan glucosyltransferase inhibitors|UDP-glucose:(1,3)beta-glucan synthase inhibitor|UDP-glucose:(1,3)beta-glucan synthase inhibitors|UDP-glucose:1,3-beta-D-glucan 3-beta-D-glucosyltransferase inhibitor|UDP-glucose:1,3-beta-D-glucan 3-beta-D-glucosyltransferase inhibitors|beta-1,3-glucan synthase inhibitor|beta-1,3-glucan synthase inhibitors|beta-1,3-glucan synthetase inhibitor|beta-1,3-glucan synthetase inhibitors|callose synthase inhibitor|callose synthase inhibitors|callose synthetase inhibitor|callose synthetase inhibitors|paramylon synthetase inhibitor|paramylon synthetase inhibitors|uridine diphosphoglucose-1,3-beta-glucan glucosyltransferase inhibitor|uridine diphosphoglucose-1,3-beta-glucan glucosyltransferase inhibitors http://purl.obolibrary.org/obo/CHEBI_230471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23048 biolink:ChemicalEntity carvones Any p-menthane monoterpenoid having the carvone skeleton as part of its structure. Graph http://purl.obolibrary.org/obo/CHEBI_23048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23053 biolink:ChemicalEntity catechin Members of the class of hydroxyflavan that have a flavan-3-ol skeleton and its substituted derivatives. kegg.compound:C17590|lincs.smallmolecule:LSM-1682 Graph (+/-)-Catechin|catechin|catechins (+/-)-Catechin|catechin|catechins http://purl.obolibrary.org/obo/CHEBI_23053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23064 biolink:ChemicalEntity cephalosporanic acid Graph (6R)-3-[(acetyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R)-3-[(acetyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R)-3-[(acetyloxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_23064 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23066 biolink:ChemicalEntity cephalosporin A class of β-lactam antibiotics differing from the penicillins in having a 6-membered, rather than a 5-membered, side ring. Although cephalosporins are among the most commonly used antibiotics in the treatment of routine infections, and their use is increasing over time, they can cause a range of hypersensitivity reactions, from mild, delayed-onset cutaneous reactions to life-threatening anaphylaxis in patients with immunoglobulin E (IgE)-mediated allergy. kegg.compound:C00875|pubmed:10069359|pubmed:11936371|pubmed:12833570|pubmed:24269048|pubmed:3320614|pubmed:6762896|pubmed:8426246|wikipedia.en:Cephalosporin Graph Cephalosporin|cephalosphorin|cephalosphorins|cephalosporins Cephalosporin|cephalosphorin|cephalosphorins|cephalosporins http://purl.obolibrary.org/obo/CHEBI_23066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23073 biolink:ChemicalEntity glycopentaosylceramide An oligoglycosylceramide consisting of a glycopentaosyl moiety attached to the ceramide oxygen with an unspecified N-acyl substituent attached to the ceramide nitrogen. Graph http://purl.obolibrary.org/obo/CHEBI_23073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23075 biolink:ChemicalEntity glycotetraosylceramide An oligoglycosylceramide consisting of a glycotetraosyl moiety attached to the ceramide oxygen with an unspecified N-acyl substituent attached to the ceramide nitrogen. Graph glycotetraosylceramides glycotetraosylceramides http://purl.obolibrary.org/obo/CHEBI_23075 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23079 biolink:ChemicalEntity cerebroside Any member of a group of glycosphingolipids, also known as monoglycosylceramides, which are important components in animal muscle and nerve cell membranes. Graph cerebrosides|monoglycosylceramide|monoglycosylceramides cerebrosides|monoglycosylceramide|monoglycosylceramides http://purl.obolibrary.org/obo/CHEBI_23079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23084 biolink:ChemicalEntity cetraxates Graph cetraxates cetraxates http://purl.obolibrary.org/obo/CHEBI_23084 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23086 biolink:ChemicalEntity chalcones A ketone that is 1,3-diphenylpropenone (benzylideneacetophenone), ArCH=CH(=O)Ar, and its derivatives formed by substitution. kegg.compound:C15589 Graph chalcones|chalconoid|chalconoids chalcones chalcones|chalconoid|chalconoids http://purl.obolibrary.org/obo/CHEBI_23086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23089 biolink:ChemicalEntity chelate-forming peptide Graph chelate-forming peptides chelate-forming peptides http://purl.obolibrary.org/obo/CHEBI_23089 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23092 biolink:ChemicalEntity chemosterilant A substance intended to sterilize any organism. wikipedia.en:Chemosterilant Graph chemosterilants chemosterilants http://purl.obolibrary.org/obo/CHEBI_23092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23098 biolink:ChemicalEntity chiro-inositol Graph chiro-inositol|chiro-inositols chiro-inositol|chiro-inositols http://purl.obolibrary.org/obo/CHEBI_23098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23101 biolink:ChemicalEntity N,N'-diacetylchitobioses Any of the chitobioses acetylated on both amino nitrogens. Graph http://purl.obolibrary.org/obo/CHEBI_23101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23102 biolink:ChemicalEntity chitobiosyldiphosphodolichol kegg.compound:C03854 Graph chitobiosyldiphosphodolichols chitobiosyldiphosphodolichols http://purl.obolibrary.org/obo/CHEBI_23102 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:231086 biolink:ChemicalEntity Octadec-9-enoic acid anion Graph http://purl.obolibrary.org/obo/CHEBI_231086 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:2311 biolink:ChemicalEntity Oplophorus luciferin An imidazopyrazine that is imidazo[1,2-a]pyrazin-3(7H)-one in which positions 2, 6, and 8 are substituted by 4-hydroxybenzyl, 4-hydroxyphenyl, and benzyl groups, respectively. beilstein:902535|cas:55779-48-1|kegg.compound:C15037|metacyc.compound:OPLOPHORUS-LUCIFERIN Graph 8-Benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo-[1,2a]pyrazin-3(7H)-one|8-benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one|Coelenterazine|Oplophorus luciferin|coelenterate luciferin|coelenterazine 8-benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one 8-Benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo-[1,2a]pyrazin-3(7H)-one|8-benzyl-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3(7H)-one|Coelenterazine|Oplophorus luciferin|coelenterate luciferin|coelenterazine http://purl.obolibrary.org/obo/CHEBI_2311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23114 biolink:ChemicalEntity chloride salt Graph chloride salts|chlorides chloride salts|chlorides http://purl.obolibrary.org/obo/CHEBI_23114 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23115 biolink:ChemicalEntity chlorohydrocarbon A compound derived from a hydrocarbon by replacing at least one hydrogen atom with a chlorine atom. Graph chlorinated hydrocarbons|chlorohydrocarbons chlorinated hydrocarbons|chlorohydrocarbons http://purl.obolibrary.org/obo/CHEBI_23115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23116 biolink:ChemicalEntity chlorine atom webelements:Cl Graph 17Cl|Chlor|Cl|chlore|chlorine|chlorum|cloro chlorine 17Cl|Chlor|Cl|chlore|chlorine|chlorum|cloro http://purl.obolibrary.org/obo/CHEBI_23116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23117 biolink:ChemicalEntity chlorine molecular entity A halogen molecular entity containing one or more atoms of chlorine. Graph http://purl.obolibrary.org/obo/CHEBI_23117 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23123 biolink:ChemicalEntity chloroacetate A haloacetate(1−) resulting from the deprotonation of the carboxy group of chloroacetic acid. cas:14526-03-5|metacyc.compound:CHLOROACETIC-ACID|reaxys:1903575|umbbd.compound:c0007 Graph Chloroacetic acid ion(1-)|chloroacetate|chloroacetate anion|chloroacetate(1-)|mono-chloroacetate|monochloroacetate anion|monochloroacetic acid anion chloroacetate Chloroacetic acid ion(1-)|chloroacetate|chloroacetate anion|chloroacetate(1-)|mono-chloroacetate|monochloroacetate anion|monochloroacetic acid anion http://purl.obolibrary.org/obo/CHEBI_23123 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23127 biolink:ChemicalEntity chloroalanine Any chloroamino acid in which the the amino acid specified is alanine. Graph chloroalanines chloroalanines http://purl.obolibrary.org/obo/CHEBI_23127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23128 biolink:ChemicalEntity chloroalkane Any haloalkane that consists of an alkane substituted by at least one chloro group. Graph alkyl chloride|alkyl chlorides|chloroalkane|chloroalkanes alkyl chloride|alkyl chlorides|chloroalkane|chloroalkanes http://purl.obolibrary.org/obo/CHEBI_23128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23129 biolink:ChemicalEntity chloroamino acid A haloamino acid that is an amino acid carrying at least one halogen atom. Graph chloroamino acids chloroamino acids http://purl.obolibrary.org/obo/CHEBI_23129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23130 biolink:ChemicalEntity chloroaniline Any substituted aniline carrying at least one chloro group. Graph http://purl.obolibrary.org/obo/CHEBI_23130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23132 biolink:ChemicalEntity chlorobenzenes Any organochlorine compound containing a benzene ring which is substituted by one or more chlorines. Graph http://purl.obolibrary.org/obo/CHEBI_23132 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23133 biolink:ChemicalEntity chlorobenzoate Any member of the class of benzoates in which the benzene ring is substituted by at least one chloro group. Graph chlorobenzoates chlorobenzoates http://purl.obolibrary.org/obo/CHEBI_23133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23134 biolink:ChemicalEntity chlorobenzoic acid Any member of the class of benzoic acids in which the benzene ring is substituted by at least one chloro group. Graph chlorobenzoic acids chlorobenzoic acids http://purl.obolibrary.org/obo/CHEBI_23134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23135 biolink:ChemicalEntity chlorobenzophenone A member of the class of benzophenones that is any substituted benzophenone in which at least one of the substituents is a chlorine. Graph chlorobenzophenones chlorobenzophenones http://purl.obolibrary.org/obo/CHEBI_23135 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23136 biolink:ChemicalEntity chlorobenzoyl-CoA A member of the class of benzoyl-CoAs in which the acyl group specified is chlorobenzoyl. Graph http://purl.obolibrary.org/obo/CHEBI_23136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23138 biolink:ChemicalEntity chlorocatechol Any member of the class of catechols that is catechol substituted by at least one chloro group. Graph chlorocatechols chlorocatechols http://purl.obolibrary.org/obo/CHEBI_23138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23140 biolink:ChemicalEntity chlorodienelactone Graph chlorodienelactones chlorodienelactones http://purl.obolibrary.org/obo/CHEBI_23140 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23142 biolink:ChemicalEntity chloroethenes A chloroalkene that is ethene in which one or more of the hydrogens has been replaced by chlorine. Graph chloroethylenes chloroethylenes http://purl.obolibrary.org/obo/CHEBI_23142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231423 biolink:ChemicalEntity 2-hexadecenal A hexadecenal that carries a double bond at position 2. pubmed:17126823|pubmed:31038222|pubmed:36418741 Graph 2-hexadecenal|hexadec-2-enal hexadec-2-enal 2-hexadecenal|hexadec-2-enal http://purl.obolibrary.org/obo/CHEBI_231423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231424 biolink:ChemicalEntity (S)-tolvaptan The (S)-enantiomer of tolvaptan. cas:331947-44-5|pubmed:35604424 Graph (-)-tolvaptan|(5S)-tolvaptan|(S)-(-)-OPC 41061|(S)-(-)-tolvaptan|(S)-OPC 41061|N-(4-{[(5S)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide N-(4-{[(5S)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide (-)-tolvaptan|(5S)-tolvaptan|(S)-(-)-OPC 41061|(S)-(-)-tolvaptan|(S)-OPC 41061|N-(4-{[(5S)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide http://purl.obolibrary.org/obo/CHEBI_231424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231425 biolink:ChemicalEntity N-{4-[(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl}-2-methylbenzamide A member of the class of benzazepines that is 2,3,4,5-tetrahydro-1H-1-benzazepine substituted by 2-methyl-4-(2-methylbenzamido)benzoyl, hydroxy, and chloro groups at positions 1, 5, and 7, respectively. Graph 1-[4-(2-methylbenzoylamino)-2-methylbenzoyl]-7-chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-ol|N-[4-[(7-chloro-2,3,4,5-tetrahydro-5-hydroxy-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide|N-{4-[(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl}-2-methylbenzamide N-{4-[(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl}-2-methylbenzamide 1-[4-(2-methylbenzoylamino)-2-methylbenzoyl]-7-chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-ol|N-[4-[(7-chloro-2,3,4,5-tetrahydro-5-hydroxy-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide|N-{4-[(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl}-2-methylbenzamide http://purl.obolibrary.org/obo/CHEBI_231425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231426 biolink:ChemicalEntity (R)-tolvaptan The (R)-enantiomer of tolvaptan. cas:331947-66-1|pubmed:35604424 Graph (+)-tolvaptan|(5R)-tolvaptan|(R)-(+)-OPC 41061|(R)-(+)-tolvaptan|(R)-OPC 41061|N-(4-{[(5R)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide N-(4-{[(5R)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide (+)-tolvaptan|(5R)-tolvaptan|(R)-(+)-OPC 41061|(R)-(+)-tolvaptan|(R)-OPC 41061|N-(4-{[(5R)-7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl}-3-methylphenyl)-2-methylbenzamide http://purl.obolibrary.org/obo/CHEBI_231426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231427 biolink:ChemicalEntity (E)-2'-hydroxy-chalcones Graph a (E)-2'-hydroxy-chalcone a (E)-2'-hydroxy-chalcone http://purl.obolibrary.org/obo/CHEBI_231427 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231468 biolink:ChemicalEntity 2,3-dimethylmalate(2-) A 2-hydroxydicarboxylate(2−) resulting from the deprotonation of the two carboxy groups of 2,3-dimethylmalic acid; Major species at pH 7.3. Graph 2,3-dimethylmalate|2,3-dimethylmalic acid dianion|2-hydroxy-2,3-dimethylbutanedioate|2-hydroxy-2,3-dimethylsuccinate 2-hydroxy-2,3-dimethylbutanedioate 2,3-dimethylmalate|2,3-dimethylmalic acid dianion|2-hydroxy-2,3-dimethylbutanedioate|2-hydroxy-2,3-dimethylsuccinate http://purl.obolibrary.org/obo/CHEBI_231468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23147 biolink:ChemicalEntity chlorohydroquinones Any member of the class of hydroquinones that is hydroquinone carrying at least one chloro substituent at unspecified position. Graph http://purl.obolibrary.org/obo/CHEBI_23147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231470 biolink:ChemicalEntity (S)-lactoyl-AMP(1-) Graph (S)-lactoyl-AMP|lactyl-AMP(1-) (S)-lactoyl-AMP|lactyl-AMP(1-) http://purl.obolibrary.org/obo/CHEBI_231470 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23148 biolink:ChemicalEntity chloromethanes A halomethane that is methane in which one or more hydrogens has been replaced by chlorine. Graph http://purl.obolibrary.org/obo/CHEBI_23148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231484 biolink:ChemicalEntity 2''-O-(S)-lactoyl-ADP-D-ribose(2-) pubmed:38512451 Graph 2''-O-(S)-lactoyl-ADP-D-ribose 2''-O-(S)-lactoyl-ADP-D-ribose http://purl.obolibrary.org/obo/CHEBI_231484 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23150 biolink:ChemicalEntity chlorophenol A halophenol that is any phenol containing one or more covalently bonded chlorine atoms. wikipedia.en:Chlorophenol Graph chlorophenols chlorophenols http://purl.obolibrary.org/obo/CHEBI_23150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23151 biolink:ChemicalEntity chlorophenoxyacetate anion A monocarboxylic acid anion obtained by deprotonation of the carboxy group of any chlorophenoxyacetic acid. Graph http://purl.obolibrary.org/obo/CHEBI_23151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23152 biolink:ChemicalEntity chlorophenoxyacetic acid A monocarboxylic acid that is phenoxyacetic acid in which at least one of the phenyl hydrogens is replaced by chlorine. Graph chlorophenoxyacetic acids chlorophenoxyacetic acids http://purl.obolibrary.org/obo/CHEBI_23152 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231527 biolink:ChemicalEntity N(6)-[(S)-lactoyl]-L-lysine residue An N6-acyl-L-lysine residue that has (S)-lactoyl as the N6-acyl group. pubmed:31645732 Graph N(6)-[(S)-lactoyl]-L-lysine residue N(6)-[(S)-lactoyl]-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_231527 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231528 biolink:ChemicalEntity (S)-lactoyl-CoA(4-) pubmed:31645732 Graph (S)-lactoyl-CoA (S)-lactoyl-CoA http://purl.obolibrary.org/obo/CHEBI_231528 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231534 biolink:ChemicalEntity (S)-azetidine-2-carboxylate zwitterion metacyc.compound:CPD-20867|pubmed:18487339 Graph (S)-azetidine-2-carboxylate (S)-azetidine-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_231534 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23154 biolink:ChemicalEntity chlorophenylethane Any chlorohydrocarbon that is phenylethane substituted by at least one chloro group at unspecified position. Graph chlorophenylethanes chlorophenylethanes http://purl.obolibrary.org/obo/CHEBI_23154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231540 biolink:ChemicalEntity nucleotide derivative A nucleoside phosphate that is derived from a nucleotide. Graph nucleotide derivatives nucleotide derivatives http://purl.obolibrary.org/obo/CHEBI_231540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231546 biolink:ChemicalEntity saturated fatty acyl-CoA A fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any saturated fatty acid. Graph saturated FA-CoA|saturated fatty acyl CoA|saturated fatty acyl-CoAs|saturated fatty acyl-coenzyme A saturated FA-CoA|saturated fatty acyl CoA|saturated fatty acyl-CoAs|saturated fatty acyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_231546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231547 biolink:ChemicalEntity unsaturated fatty aldehyde Any fatty aldehyde containing at least one C=C or C≡C bond. Graph unsaturated fatty aldehydes unsaturated fatty aldehydes http://purl.obolibrary.org/obo/CHEBI_231547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23155 biolink:ChemicalEntity chlorophenylethylene A chlorohydrocarbon that is consists of ethylene in which one or more hydrogens are replaced by chlorophenyl groups. Graph http://purl.obolibrary.org/obo/CHEBI_23155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231550 biolink:ChemicalEntity azithromycin(2+) A tertiary ammonium ion resulting from the protonation of the two amino groups of azithromycin; major species at pH 7.3. Graph (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-15-oxo-11-{[3,4,6-trideoxy-3-(dimethylazaniumyl)-beta-D-xylo-hexopyranosyl]oxy}-1-oxa-6-azoniacyclopentadecan-13-yl 2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranoside|azithromycin dication (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-15-oxo-11-{[3,4,6-trideoxy-3-(dimethylazaniumyl)-beta-D-xylo-hexopyranosyl]oxy}-1-oxa-6-azoniacyclopentadecan-13-yl 2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranoside (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-15-oxo-11-{[3,4,6-trideoxy-3-(dimethylazaniumyl)-beta-D-xylo-hexopyranosyl]oxy}-1-oxa-6-azoniacyclopentadecan-13-yl 2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranoside|azithromycin dication http://purl.obolibrary.org/obo/CHEBI_231550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231553 biolink:ChemicalEntity levofloxacin(1-) An oxo monocarboxylic acid anion that is the conjugate base of levofloxacin resulting from the deprotonation of the carboxy group; major species at pH 7.3. Graph (3S)-9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylate|levofloxacin anion (3S)-9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylate (3S)-9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylate|levofloxacin anion http://purl.obolibrary.org/obo/CHEBI_231553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23156 biolink:ChemicalEntity chlorophenylmethane A chlorohydrocarbon that is phenylmethane substituted by a chloro group at unspecified position. Graph chlorophenylmethanes chlorophenylmethanes http://purl.obolibrary.org/obo/CHEBI_23156 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231587 biolink:ChemicalEntity cephaeline(2+) metacyc.compound:CPD-14816 Graph cephaeline cephaeline http://purl.obolibrary.org/obo/CHEBI_231587 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231594 biolink:ChemicalEntity 17-ethynyl-17-hydroxy-18a-homoestr-4-en-3-one A 3-oxo-Δ4 steroid that is gon-4-en-3-one that carries ethyl, hydroxy, and ethynyl groups at positions 13, 17 and 17, respectively. Graph 11a-ethyl-1-ethynyl-1-hydroxy-1,2,3,3a,3b,4,5,8,9,9a,9b,10,11,11a-tetradecahydro-7H-cyclopenta[a]phenanthren-7-one|13-ethyl-17-ethynyl-17-hydroxy-4-gonen-3-one|13-ethyl-17-ethynyl-17-hydroxygon-4-en-3-one 11a-ethyl-1-ethynyl-1-hydroxy-1,2,3,3a,3b,4,5,8,9,9a,9b,10,11,11a-tetradecahydro-7H-cyclopenta[a]phenanthren-7-one 11a-ethyl-1-ethynyl-1-hydroxy-1,2,3,3a,3b,4,5,8,9,9a,9b,10,11,11a-tetradecahydro-7H-cyclopenta[a]phenanthren-7-one|13-ethyl-17-ethynyl-17-hydroxy-4-gonen-3-one|13-ethyl-17-ethynyl-17-hydroxygon-4-en-3-one http://purl.obolibrary.org/obo/CHEBI_231594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23162 biolink:ChemicalEntity chloropropene Any chloroalkene that is propene substituted by at least one chloro group at unspecified position. Graph chloropropenes chloropropenes http://purl.obolibrary.org/obo/CHEBI_23162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231623 biolink:ChemicalEntity di-trans,poly-cis-polyprenal A polyprenal in which all linkages of the isoprene units are cis, except for the two furthest from the aldehyde group which are trans. pubmed:38821050 Graph di-trans,poly-cis-polyprenal di-trans,poly-cis-polyprenal http://purl.obolibrary.org/obo/CHEBI_231623 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231637 biolink:ChemicalEntity di-trans,poly-cis-dolichal A dolichal in which all linkages of the isoprene units are cis, except for the two furthest from the aldehyde group which are trans. pubmed:38821050 Graph di-trans,poly-cis-dolichal di-trans,poly-cis-dolichal http://purl.obolibrary.org/obo/CHEBI_231637 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231641 biolink:ChemicalEntity (R)-hydroxy ester An hydroxyester where (R)-hydroxyl group and ester functionalities are on adjacent atoms. pubmed:11306085 Graph an (R)-hydroxy ester an (R)-hydroxy ester http://purl.obolibrary.org/obo/CHEBI_231641 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231704 biolink:ChemicalEntity ramipril(1-) A dicarboxylic acid monoester(1−) that is the conjugate base of ramipril resulting from the deprotontion of the carboxy group; Major microspecies at pH 7.3. Graph (2S,3aS,6aS)-1-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}octahydrocyclopenta[b]pyrrole-2-carboxylate|ramipril anion (2S,3aS,6aS)-1-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}octahydrocyclopenta[b]pyrrole-2-carboxylate (2S,3aS,6aS)-1-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}octahydrocyclopenta[b]pyrrole-2-carboxylate|ramipril anion http://purl.obolibrary.org/obo/CHEBI_231704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231705 biolink:ChemicalEntity ramiprilat(1-) A dicarboxylic acid dianion that results from the deprotonation of the two carboxy groups and protonation of the secondary amino group of ramiprilat; Major microspecies at pH 7.3 Graph (2S,3aS,6aS)-1-[(2S)-2-{[(1S)-1-carboxylato-3-phenylpropyl]azaniumyl}propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylate (2S,3aS,6aS)-1-[(2S)-2-{[(1S)-1-carboxylato-3-phenylpropyl]azaniumyl}propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylate (2S,3aS,6aS)-1-[(2S)-2-{[(1S)-1-carboxylato-3-phenylpropyl]azaniumyl}propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_231705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231764 biolink:ChemicalEntity 5,6-dihydroxyindoline-2-carboxylic acid A member of the class of indoles that is indoline substituted by hydroxy groups at positions C-5 and C-6 and by a carboxy group at position C-2. cas:18791-20-3|pubmed:29958449|pubmed:34579453|pubmed:38835170 Graph 2-carboxy-5,6-dihydroxy-2,3-dihydro-1H-indole|2-carboxy-5,6-dihydroxyindoline|5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylic acid|cyclo-DOPA 5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylic acid 2-carboxy-5,6-dihydroxy-2,3-dihydro-1H-indole|2-carboxy-5,6-dihydroxyindoline|5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylic acid|cyclo-DOPA http://purl.obolibrary.org/obo/CHEBI_231764 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231765 biolink:ChemicalEntity 5,6-dihydroxyindoline-2-carboxylate A hydroxy monocarboxylic acid anion that is the conjugate base of 5,6-dihydroxyindoline-2-carboxylic acid, resulting from the deprotonation of the carboxy group; Major microspecies at pH 7.3. pubmed:38835170 Graph 2-carboxy-5,6-dihydroxyindoline anion|2-carboxy-5,6-dihydroxyindoline(1-)|5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylate|cyclo-DOPA(1-) 5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylate 2-carboxy-5,6-dihydroxyindoline anion|2-carboxy-5,6-dihydroxyindoline(1-)|5,6-dihydroxy-2,3-dihydro-1H-indole-2-carboxylate|cyclo-DOPA(1-) http://purl.obolibrary.org/obo/CHEBI_231765 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231766 biolink:ChemicalEntity leucodopachrome zwitterion A zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of leucodopachrome; Major microspecies at pH 7.3. metacyc.compound:CPD-8652|pubmed:38835170 Graph (2S)-5,6-dihydroxy-2,3-dihydro-1H-indolium-2-carboxylate|(S)-5,6-dihydroxyindolinium-2-carboxylate|cyclo-dopa zwitterion|leucodopachrome (2S)-5,6-dihydroxy-2,3-dihydro-1H-indolium-2-carboxylate (2S)-5,6-dihydroxy-2,3-dihydro-1H-indolium-2-carboxylate|(S)-5,6-dihydroxyindolinium-2-carboxylate|cyclo-dopa zwitterion|leucodopachrome http://purl.obolibrary.org/obo/CHEBI_231766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23178 biolink:ChemicalEntity cholest-7-ene Graph cholest-7-ene cholest-7-ene cholest-7-ene http://purl.obolibrary.org/obo/CHEBI_23178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231790 biolink:ChemicalEntity cardiolipin ketone(2-) a cardiolipin with an oxidized glycerol molecule pubmed:26338420 Graph 1',3'-bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerone(2-)|a diphosphatidylglycerone|diphosphatidylglycerone(2-) 1',3'-bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerone(2-)|a diphosphatidylglycerone|diphosphatidylglycerone(2-) http://purl.obolibrary.org/obo/CHEBI_231790 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231792 biolink:ChemicalEntity 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerone)(1-) a phosphatidylglycerol with an ketone group at position 2' of the glycerol pubmed:26338420 Graph PG ketone(1-)|a 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerone) PG ketone(1-)|a 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerone) http://purl.obolibrary.org/obo/CHEBI_231792 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231807 biolink:ChemicalEntity sphingofungin B zwitterion metacyc.compound:CPD-26567|pubmed:35023724 Graph sphingofungin B sphingofungin B http://purl.obolibrary.org/obo/CHEBI_231807 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231825 biolink:ChemicalEntity 3-demethylubiquinone(1-) pubmed:38425362 Graph 3-demethylubiquinone 3-demethylubiquinone http://purl.obolibrary.org/obo/CHEBI_231825 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231829 biolink:ChemicalEntity 2-methoxy-5-methyl-6-all-trans-polyprenylbenzoquinone An all-trans-polyprenylbenzoquinone in which the polyprenyl substituent is at C-2 together with additional methyl and methoxy groups present at C3 and C-6 respectively. kegg.compound:C17561|pubmed:38425362 Graph 2-all-trans-polyprenyl-3-methyl-6-methoxy-1,4-benzoquinone|a 2-methoxy-5-methyl-6-all-trans-polyprenyl-1,4-benzoquinone 2-all-trans-polyprenyl-3-methyl-6-methoxy-1,4-benzoquinone|a 2-methoxy-5-methyl-6-all-trans-polyprenyl-1,4-benzoquinone http://purl.obolibrary.org/obo/CHEBI_231829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:231840 biolink:ChemicalEntity tin cation Any tin ion that is positively charged. Graph tin cations tin cations http://purl.obolibrary.org/obo/CHEBI_231840 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231853 biolink:ChemicalEntity gold cation Any gold ion that is positively charged. Graph gold cations gold cations http://purl.obolibrary.org/obo/CHEBI_231853 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231885 biolink:ChemicalEntity N(6)-[(R)-lactoyl]-L-lysine residue An N6-acyl-L-lysine residue that has (R)-lactoyl as the N6-acyl group. pubmed:35500056 Graph N(6)-[(R)-lactoyl]-L-lysine residue N(6)-[(R)-lactoyl]-L-lysine residue http://purl.obolibrary.org/obo/CHEBI_231885 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:231935 biolink:ChemicalEntity glycerol 1-phosphate(2-) An organophosphate oxoanion that is the dianion of glycerol 1-phosphate arising from deprotonation of the phosphate OH groups; major species at pH 7.3. gmelin:602374|reaxys:1873731 Graph 2,3-dihydroxypropyl phosphate|glycerol 1-phosphate|glycerol 1-phosphate dianion 2,3-dihydroxypropyl phosphate 2,3-dihydroxypropyl phosphate|glycerol 1-phosphate|glycerol 1-phosphate dianion http://purl.obolibrary.org/obo/CHEBI_231935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23197 biolink:ChemicalEntity cholestanoyl-CoA A steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any cholestan-26-oic acid. Graph cholestanoyl-CoAs|cholestanoyl-coenzyme A|cholestanoyl-coenzyme As cholestanoyl-CoAs|cholestanoyl-coenzyme A|cholestanoyl-coenzyme As http://purl.obolibrary.org/obo/CHEBI_23197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232045 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminyl-(2->3)]-beta-D-galactoside(1-) A carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of any N-acetyl-β-D-galactosaminyl-(1→4)-[N-acetyl-α-neuraminyl-(2→3)]-β-D-galactoside; major species at pH 7.3. pubmed:24112972|pubmed:36287346 Graph an N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminyl-(2->3)]-beta-D-galactosyl derivative an N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminyl-(2->3)]-beta-D-galactosyl derivative http://purl.obolibrary.org/obo/CHEBI_232045 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:232067 biolink:ChemicalEntity 3-hydroxy-3-methylglutaryl-CoA(5-) An acyl-CoA oxoanion that results from the removal of all five protons from the phosphate and carboxylic acid groups of 3-hydroxy-3-methylglutaryl-CoA. pubmed:38915184 Graph 3-hydroxy-3-methylglutaryl-CoA 3-hydroxy-3-methylglutaryl-CoA http://purl.obolibrary.org/obo/CHEBI_232067 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:232093 biolink:ChemicalEntity long-chain 3-hydroxysterol ester A steroid ester obtained by formal condensation of the carboxy group of a long-chain fatty acid with the 3-hydroxy group of a sterol Graph a long-chain 3-hydroxysterol ester|a long-chain sterol ester a long-chain 3-hydroxysterol ester|a long-chain sterol ester http://purl.obolibrary.org/obo/CHEBI_232093 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23213 biolink:ChemicalEntity choline ester Graph choline esters choline esters http://purl.obolibrary.org/obo/CHEBI_23213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23216 biolink:ChemicalEntity choline sulfates Graph http://purl.obolibrary.org/obo/CHEBI_23216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23217 biolink:ChemicalEntity cholines A quaternary ammonium ion based on the choline ion and its substituted derivatives thereof. Graph http://purl.obolibrary.org/obo/CHEBI_23217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23218 biolink:ChemicalEntity choloyl-CoAs A steroidal acyl-CoA formed by thioester formation between coenzyme A and any cholic acid. Graph choloyl-CoA|choloyl-coenzyme As|cholyl-CoA|cholyl-coenzyme A choloyl-CoA|choloyl-coenzyme As|cholyl-CoA|cholyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_23218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23219 biolink:ChemicalEntity bile acid taurine conjugate A bile acid conjugate resulting from the formal condensation of a bile acid with the amino group of taurine. Graph bile acid taurine conjugates bile acid taurine conjugates http://purl.obolibrary.org/obo/CHEBI_23219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23229 biolink:ChemicalEntity chromanol Any member of the class of chromanes that is chromane substituted by one or more hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_23229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23230 biolink:ChemicalEntity chromanes Graph http://purl.obolibrary.org/obo/CHEBI_23230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23232 biolink:ChemicalEntity chromenes Graph http://purl.obolibrary.org/obo/CHEBI_23232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23234 biolink:ChemicalEntity dichromic acid cas:13530-68-2|gmelin:101517 Graph Dichromsaeure|H2Cr2O7|[(HO)Cr(O)2OCr(O)2(OH)]|chromic acid|dichromic(VI) acid|dihydrogen(heptaoxidodichromate)|mu-oxido-bis(hydroxidodioxidochromium)|mu-oxo-hexaoxodichromic acid dihydrogen(heptaoxidodichromate)|mu-oxido-bis(hydroxidodioxidochromium)|mu-oxo-hexaoxodichromic acid Dichromsaeure|H2Cr2O7|[(HO)Cr(O)2OCr(O)2(OH)]|chromic acid|dichromic(VI) acid|dihydrogen(heptaoxidodichromate)|mu-oxido-bis(hydroxidodioxidochromium)|mu-oxo-hexaoxodichromic acid http://purl.obolibrary.org/obo/CHEBI_23234 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232361 biolink:ChemicalEntity 3,3',5'-triiodo-D-thyronine The D-enantiomer of 3,3',5'-triiodothyronine. cas:66701-15-3 Graph (2R)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenyl]propanoic acid|3,3',5'-triiodo-D-thyronine|3-iodo-O-(3,5-diiodo-4-hydroxyphenyl)-D-tyrosine|D-3,3',5'-triiodothyronine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodo-D-tyrosine 3,3',5'-triiodo-D-thyronine (2R)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenyl]propanoic acid|3,3',5'-triiodo-D-thyronine|3-iodo-O-(3,5-diiodo-4-hydroxyphenyl)-D-tyrosine|D-3,3',5'-triiodothyronine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodo-D-tyrosine http://purl.obolibrary.org/obo/CHEBI_232361 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23237 biolink:ChemicalEntity chromium molecular entity Graph chromium compounds|chromium molecular entities|chromium molecular entity chromium compounds|chromium molecular entities|chromium molecular entity http://purl.obolibrary.org/obo/CHEBI_23237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232372 biolink:ChemicalEntity C-terminal N-glycylaminoethanethioate(1-) residue pubmed:39311576 Graph C-terminal N-glycylaminoethanethioate residue C-terminal N-glycylaminoethanethioate residue http://purl.obolibrary.org/obo/CHEBI_232372 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23238 biolink:ChemicalEntity chromones A chromenone that consists of a 1,4-benzopyrone skeleton and its substituted derivatives thereof. Graph 1,4-benzopyrones 1,4-benzopyrones http://purl.obolibrary.org/obo/CHEBI_23238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23239 biolink:ChemicalEntity chromopeptide Graph chromopeptides chromopeptides http://purl.obolibrary.org/obo/CHEBI_23239 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23240 biolink:ChemicalEntity chromophore The part (atom or group of atoms) of a molecular entity in which the electronic transition responsible for a given spectral band is approximately localized. wikipedia.en:Chromophore Graph chromophore|chromophores chromophore chromophore|chromophores http://purl.obolibrary.org/obo/CHEBI_23240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23243 biolink:ChemicalEntity cineole Graph cineoles cineoles http://purl.obolibrary.org/obo/CHEBI_23243 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232436 biolink:ChemicalEntity calcium chelator A chelator that is any compound containing a ligand (typically organic) which is able to form a bond to a central calcium atom at two or more points. Graph calcium chelating agent|calcium chelating agents|calcium chelators calcium chelating agent|calcium chelating agents|calcium chelators http://purl.obolibrary.org/obo/CHEBI_232436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23245 biolink:ChemicalEntity cinnamaldehydes An enal based on a cinnamaldehyde skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_23245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23246 biolink:ChemicalEntity cinnamamide The simplest member of the class of cinnamamides that consists of acrylamide bearing a phenyl substituent at the 3-position. cas:621-79-4|reaxys:8198107 Graph 3-phenyl-acrylamide|3-phenylprop-2-enamide 3-phenylprop-2-enamide 3-phenyl-acrylamide|3-phenylprop-2-enamide http://purl.obolibrary.org/obo/CHEBI_23246 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23247 biolink:ChemicalEntity cinnamamides An enamide which is cinnamamide or a derivative of cinnamamide obtained by replacement of one or more of its hydrogens. Graph http://purl.obolibrary.org/obo/CHEBI_23247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23248 biolink:ChemicalEntity cinnamate A member of the class of cinnamates that results from the deprotonation of the carboxy group of cinnamic acid. beilstein:3904519|cas:4151-45-5|gmelin:328657 Graph 3-phenyl-2-propenoate|3-phenyl-2-propenoic acid, ion(1-)|3-phenylacrylate|3-phenylprop-2-enoate|cinnamate|cinnamic acid, ion(1-) 3-phenylprop-2-enoate 3-phenyl-2-propenoate|3-phenyl-2-propenoic acid, ion(1-)|3-phenylacrylate|3-phenylprop-2-enoate|cinnamate|cinnamic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_23248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23252 biolink:ChemicalEntity cinnamic acids Any α,β-unsaturated monocarboxylic acid based on the cinnamic acid skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_23252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232628 biolink:ChemicalEntity (R,S)-2,2'-lysobisphophatidate(1-) pubmed:37708259 Graph (R,S)-2,2'-lysobisphophatidylglycerol(1-)|1-acyl-sn-glycero-3-phospho-(3'-acyl-sn-1'-glycerol) (R,S)-2,2'-lysobisphophatidylglycerol(1-)|1-acyl-sn-glycero-3-phospho-(3'-acyl-sn-1'-glycerol) http://purl.obolibrary.org/obo/CHEBI_232628 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23286 biolink:ChemicalEntity cis-3,4-dihydrophenanthrene-3,4-diol beilstein:4679676|umbbd.compound:c0434 Graph cis-3,4-dihydro-3,4-dihydroxyphenanthrene|cis-3,4-dihydrophenanthrene-3,4-diol|cis-3,4-dihydroxy-3,4-dihydrophenanthrene|phenanthrene-cis-3,4-dihydrodiol|rel-(3S,4R)-3,4-dihydrophenanthrene-3,4-diol rel-(3S,4R)-3,4-dihydrophenanthrene-3,4-diol cis-3,4-dihydro-3,4-dihydroxyphenanthrene|cis-3,4-dihydrophenanthrene-3,4-diol|cis-3,4-dihydroxy-3,4-dihydrophenanthrene|phenanthrene-cis-3,4-dihydrodiol|rel-(3S,4R)-3,4-dihydrophenanthrene-3,4-diol http://purl.obolibrary.org/obo/CHEBI_23286 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:232876 biolink:ChemicalEntity N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucose(1-) Graph N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucose N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucose http://purl.obolibrary.org/obo/CHEBI_232876 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:233080 biolink:ChemicalEntity Leu-Phe zwitterion An L-aminoacyl-L-amino acid zwitterion resulting from transfer of a proton from the carboxy to the amino group of L-leucyl-L-phenylalanine; major species at pH 7.3. pubmed:15938642 Graph L-leucyl-L-phenylalanine L-leucyl-L-phenylalanine http://purl.obolibrary.org/obo/CHEBI_233080 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23315 biolink:ChemicalEntity citraconoyl group Graph (2Z)-2-methylbut-2-enedioyl|2-methylmaleyl|citraconoyl|citraconoyl group (2Z)-2-methylbut-2-enedioyl (2Z)-2-methylbut-2-enedioyl|2-methylmaleyl|citraconoyl|citraconoyl group http://purl.obolibrary.org/obo/CHEBI_23315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2332 biolink:ChemicalEntity 9-(5-phosphoribofuranosyl)-6-mercaptopurine cas:53-83-8|hmdb:HMDB0060416|kegg.compound:C04646 Graph 6-Thioinosine-5'-monophosphate|9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purine-6-thiol|9-(5-Phospho-1-ribofuranosyl)-6-mercaptopurine 9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purine-6-thiol 6-Thioinosine-5'-monophosphate|9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purine-6-thiol|9-(5-Phospho-1-ribofuranosyl)-6-mercaptopurine http://purl.obolibrary.org/obo/CHEBI_2332 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:233202 biolink:ChemicalEntity paromomycin(5+) pubmed:21040710 Graph paromomycin paromomycin http://purl.obolibrary.org/obo/CHEBI_233202 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:233231 biolink:ChemicalEntity (S)-xanthopterin-B2 Graph (S)-xanthopterin-B2 (S)-xanthopterin-B2 http://purl.obolibrary.org/obo/CHEBI_233231 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23324 biolink:ChemicalEntity citrullines Graph citrullines citrullines http://purl.obolibrary.org/obo/CHEBI_23324 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23333 biolink:ChemicalEntity cob(III)alamins Graph http://purl.obolibrary.org/obo/CHEBI_23333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23334 biolink:ChemicalEntity cobalamins Graph http://purl.obolibrary.org/obo/CHEBI_23334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23336 biolink:ChemicalEntity cobalt cation Graph cobalt cation|cobalt cations cobalt cation cobalt cation|cobalt cations http://purl.obolibrary.org/obo/CHEBI_23336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23341 biolink:ChemicalEntity cobamides kegg.compound:C00210 Graph cobamides cobamides http://purl.obolibrary.org/obo/CHEBI_23341 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:233423 biolink:ChemicalEntity antifibrotic agent Any agent which acts to reduce fibrosis. wikipedia.en:Fibrosis Graph anti-fibrotic agent|anti-fibrotic agents|antifibrosis agent|antifibrosis agents|antifibrotic agents|antifibrotic drug|antifibrotic drugs anti-fibrotic agent|anti-fibrotic agents|antifibrosis agent|antifibrosis agents|antifibrotic agents|antifibrotic drug|antifibrotic drugs http://purl.obolibrary.org/obo/CHEBI_233423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233443 biolink:ChemicalEntity N-acetyl-L-alpha-amino acid anion Graph an N-acetyl-L-alpha-amino acid an N-acetyl-L-alpha-amino acid http://purl.obolibrary.org/obo/CHEBI_233443 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23345 biolink:ChemicalEntity cobyric acid beilstein:4122664|cas:14708-92-0 Graph Cby|Factor V1a|cobyric acid|cobyrinic a,b,c,d,e,g-hexaamide|cobyrinic acid-abcdeg-hexamide Cby|Factor V1a|cobyric acid|cobyrinic a,b,c,d,e,g-hexaamide|cobyrinic acid-abcdeg-hexamide http://purl.obolibrary.org/obo/CHEBI_23345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233453 biolink:ChemicalEntity valacyclovir(1+) pubmed:32196348 Graph valacyclovir valacyclovir http://purl.obolibrary.org/obo/CHEBI_233453 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23347 biolink:ChemicalEntity coclaurine Graph http://purl.obolibrary.org/obo/CHEBI_23347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233500 biolink:ChemicalEntity post-transition metal atom A group of metal atoms that are located in the periodic table between transition metals and metalloids. wikipedia.en:Post-transition_metal Graph other metal atom|other metal atoms|p-block metal atom|p-block metal atoms|poor metal atom|poor metal atoms|post transition metal atom|post transition metal atoms|post-transition element atom|post-transition element atoms|post-transition metal atoms other metal atom|other metal atoms|p-block metal atom|p-block metal atoms|poor metal atom|poor metal atoms|post transition metal atom|post transition metal atoms|post-transition element atom|post-transition element atoms|post-transition metal atoms http://purl.obolibrary.org/obo/CHEBI_233500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233516 biolink:ChemicalEntity keratan sulfate proteoglycan A proteoglycan whose glycosaminoglycan units are keratan sulfate. pubmed:11310499|pubmed:11328728|pubmed:12040068|pubmed:14724244|pubmed:15042600|pubmed:15453615|pubmed:16094279|pubmed:18515583|pubmed:20495072|pubmed:22457484|pubmed:33287953|pubmed:38950418|pubmed:8639718|pubmed:9152235 Graph KSPG|KSPGs|keratan sulfate proteoglycans KSPG|KSPGs|keratan sulfate proteoglycans http://purl.obolibrary.org/obo/CHEBI_233516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233528 biolink:ChemicalEntity heparin proteoglycan A proteoglycan whose glycosaminoglycan units are heparin. pubmed:10329611|pubmed:10508424|pubmed:11073864|pubmed:11858484|pubmed:2115517|pubmed:2176084|pubmed:25393636|pubmed:2590178|pubmed:30071479|pubmed:3353378|pubmed:34773471|pubmed:3827857|pubmed:7575459|pubmed:7588746|pubmed:8172612|pubmed:8925890|pubmed:9437208|pubmed:9915776 Graph HEP-PG|HEP-PGs|heparin proteoglycans HEP-PG|HEP-PGs|heparin proteoglycans http://purl.obolibrary.org/obo/CHEBI_233528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23354 biolink:ChemicalEntity coenzyme A low-molecular-weight, non-protein organic compound participating in enzymatic reactions as dissociable acceptor or donor of chemical groups or electrons. Graph coenzyme|coenzymes coenzyme coenzyme|coenzymes http://purl.obolibrary.org/obo/CHEBI_23354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23356 biolink:ChemicalEntity S-substituted coenzyme M Graph S-substituted coenzymes M S-substituted coenzymes M http://purl.obolibrary.org/obo/CHEBI_23356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23357 biolink:ChemicalEntity cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group). wikipedia.en:Cofactor_(biochemistry) Graph cofactor|cofactors cofactors cofactor|cofactors http://purl.obolibrary.org/obo/CHEBI_23357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23359 biolink:ChemicalEntity colchicine An alkaloid that is a carbotricyclic compound comprising 5,6,7,9-tetrahydrobenzo[a]heptalene having four methoxy substituents at the 1-, 2-, 3- and 10-positions as well as an oxo group at the 9-position and an acetamido group at the 7-position. It has been isolated from the plants belonging to genus Colchicum. cas:54192-66-4|drugbank:DB01394|hmdb:HMDB0015466|lincs.smallmolecule:LSM-6449|pubmed:10680067|pubmed:24074178|pubmed:7200520|pubmed:9819133|reaxys:2228812 Graph N-(1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide N-(1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide N-(1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide http://purl.obolibrary.org/obo/CHEBI_23359 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23366 biolink:ChemicalEntity compatible osmolytes Graph compatible osmolytes compatible osmolytes http://purl.obolibrary.org/obo/CHEBI_23366 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23367 biolink:ChemicalEntity molecular entity Any constitutionally or isotopically distinct atom, molecule, ion, ion pair, radical, radical ion, complex, conformer etc., identifiable as a separately distinguishable entity. Graph entidad molecular|entidades moleculares|entite moleculaire|molecular entities|molecular entity|molekulare Entitaet molecular entity entidad molecular|entidades moleculares|entite moleculaire|molecular entities|molecular entity|molekulare Entitaet http://purl.obolibrary.org/obo/CHEBI_23367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23375 biolink:ChemicalEntity copalyl diphosphate kegg.compound:C06089 Graph 3-methyl-5-(5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl)pent-2-en-1-yl trihydrogen phosphate 3-methyl-5-(5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl)pent-2-en-1-yl trihydrogen phosphate 3-methyl-5-(5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl)pent-2-en-1-yl trihydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_23375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23377 biolink:ChemicalEntity copper molecular entity Graph copper compounds|copper molecular entities|copper molecular entity copper compounds|copper molecular entities|copper molecular entity http://purl.obolibrary.org/obo/CHEBI_23377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23378 biolink:ChemicalEntity copper cation Graph Cu cation|copper cation|copper cations copper cation Cu cation|copper cation|copper cations http://purl.obolibrary.org/obo/CHEBI_23378 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:233808 biolink:ChemicalEntity N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioyl-D-alanine(2-) Graph N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioyl-D-alanine N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_233808 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:233809 biolink:ChemicalEntity N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioate(2-) Graph N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioate N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-meso-2,6-diaminoheptanedioate http://purl.obolibrary.org/obo/CHEBI_233809 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:233822 biolink:ChemicalEntity 5,6-epoxycholesterol An epoxy steroid that is cholesterol which has an epoxy group whose oxygen is attached to the 5 and 6-positions. cas:55700-78-2|pubmed:14565083|pubmed:17572462|pubmed:20117071|pubmed:29626102|pubmed:31009661|pubmed:32696532|pubmed:34359648 Graph 5,6-epoxy-5xi-cholestan-3beta-ol|5,6-epoxycholestan-3beta-ol|6H-5,6-epoxycholesterol 5,6-epoxycholestan-3beta-ol 5,6-epoxy-5xi-cholestan-3beta-ol|5,6-epoxycholestan-3beta-ol|6H-5,6-epoxycholesterol http://purl.obolibrary.org/obo/CHEBI_233822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23389 biolink:ChemicalEntity cobalt-corrinoid heptacarboxylic acid Graph cobalt-corrinoid heptacarboxylic acids|corrinoid heptaacids cobalt-corrinoid heptacarboxylic acids|corrinoid heptaacids http://purl.obolibrary.org/obo/CHEBI_23389 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23390 biolink:ChemicalEntity cobalt-corrinoid hexaamide Graph cobalt-corrinoid hexaamides|corrinoid hexaamides cobalt-corrinoid hexaamides|corrinoid hexaamides http://purl.obolibrary.org/obo/CHEBI_23390 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23392 biolink:ChemicalEntity corrins metacyc.compound:Corrins Graph corrins corrins http://purl.obolibrary.org/obo/CHEBI_23392 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23396 biolink:ChemicalEntity cortisol ester Graph cortisol esters cortisol esters http://purl.obolibrary.org/obo/CHEBI_23396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23399 biolink:ChemicalEntity coumarate A member of the class of cinnamates obtained by the deprotonation of the carboxy group of coumaric acid. Graph courmarate courmarate http://purl.obolibrary.org/obo/CHEBI_23399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2340 biolink:ChemicalEntity docebenone A member of the class of benzoquinones that is p-benzoquinone in which the hydrogens are substituted by three methyl groups and a 12-hydroxydodeca-5,10-diyn-1-yl group. cas:80809-81-0|kegg.compound:C01349|kegg.drug:D03882|pubmed:16903934|pubmed:17645780|pubmed:2447953|reaxys:4262656 Graph 2,3,5-trimethyl-6-(12-hydroxy-5,10-dodecadiynyl)-1,4-benzoquinone|2-(12-Hydroxy-5,10-dodecadiynyl)-3,5,6-trimethyl-p-benzoquinone|2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione|2-(12-hydroxydodeca-5,10-diynyl)-3,5,6-trimethyl-1,4-benzoquinone|6-(12-hydroxydodeca-5,10-diyn-1-yl)-2,3,5-trimethyl-1,4-benzoquinone|AA-861|AA861|Docebenone|docebenona|docebenone|docebenonum 2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione 2,3,5-trimethyl-6-(12-hydroxy-5,10-dodecadiynyl)-1,4-benzoquinone|2-(12-Hydroxy-5,10-dodecadiynyl)-3,5,6-trimethyl-p-benzoquinone|2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione|2-(12-hydroxydodeca-5,10-diynyl)-3,5,6-trimethyl-1,4-benzoquinone|6-(12-hydroxydodeca-5,10-diyn-1-yl)-2,3,5-trimethyl-1,4-benzoquinone|AA-861|AA861|Docebenone|docebenona|docebenone|docebenonum http://purl.obolibrary.org/obo/CHEBI_2340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23401 biolink:ChemicalEntity coumaric acid A monohydroxycinnamic acid that is prop-2-enoic acid substituted by a hydroxyphenyl group at position 3. cas:25429-38-3 Graph 3-(hydroxyphenyl)-2-propenoic acid|3-(hydroxyphenyl)prop-2-enoic acid|hydroxycinnamic acid 3-(hydroxyphenyl)prop-2-enoic acid 3-(hydroxyphenyl)-2-propenoic acid|3-(hydroxyphenyl)prop-2-enoic acid|hydroxycinnamic acid http://purl.obolibrary.org/obo/CHEBI_23401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234025 biolink:ChemicalEntity asiatate metacyc.compound:CPD-25695|pubmed:40215734 Graph asiatate asiatate http://purl.obolibrary.org/obo/CHEBI_234025 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23403 biolink:ChemicalEntity coumarins Graph http://purl.obolibrary.org/obo/CHEBI_23403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234081 biolink:ChemicalEntity ursolate metacyc.compound:CPD-14496 Graph ursolate ursolate http://purl.obolibrary.org/obo/CHEBI_234081 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:234087 biolink:ChemicalEntity arjunolate Graph arjunolate arjunolate http://purl.obolibrary.org/obo/CHEBI_234087 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:2341 biolink:ChemicalEntity AACOCF3 A fatty acid derivative that is arachidonic acid in which the OH part of the carboxy group has been replaced by a trifluoromethyl group cas:149301-79-1|kegg.compound:C01397|reaxys:7593118 Graph (6Z,9Z,12Z,15Z)-1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one|AACOCF3|Arachidonic acid trifluoromethyl ketone|Arachidonyl trifluoromethyl ketone|Arachidonyltrifluoromethane (6Z,9Z,12Z,15Z)-1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one (6Z,9Z,12Z,15Z)-1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one|AACOCF3|Arachidonic acid trifluoromethyl ketone|Arachidonyl trifluoromethyl ketone|Arachidonyltrifluoromethane http://purl.obolibrary.org/obo/CHEBI_2341 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23410 biolink:ChemicalEntity cumate A member of the class of benzoates obtained by the deprotonation of the carboxy group of cumic acid. Graph cumate|cumates cumate|cumates http://purl.obolibrary.org/obo/CHEBI_23410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23412 biolink:ChemicalEntity cumic acid A member of the class of benzoic acids that is cumene substituted by at least one carboxy group. Graph cumic acids cumic acids http://purl.obolibrary.org/obo/CHEBI_23412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23414 biolink:ChemicalEntity copper(II) sulfate A metal sulfate compound having copper(2+) as the metal ion. cas:7758-98-7|gmelin:8294|kegg.compound:C18713|ppdb:178|pubmed:10469300|pubmed:29079364|pubmed:8566016|wikipedia.en:Copper(II)_sulfate Graph Copper(II) sulfate|CuSO4|Cupric sulfate|copper sulfate|copper(2+) sulfate|copper(II) sulfate|cupric sulfate anhydrous copper(2+) sulfate|copper(II) sulfate Copper(II) sulfate|CuSO4|Cupric sulfate|copper sulfate|copper(2+) sulfate|copper(II) sulfate|cupric sulfate anhydrous http://purl.obolibrary.org/obo/CHEBI_23414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234158 biolink:ChemicalEntity echinocystate pubmed:39043959 Graph echinocystate echinocystate http://purl.obolibrary.org/obo/CHEBI_234158 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23417 biolink:ChemicalEntity cutins Polyester macromolecules consisting of ω-hydroxy acid monomers connected via ester linkages. kegg.compound:C07299|wikipedia.en:Cutin Graph http://purl.obolibrary.org/obo/CHEBI_23417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23420 biolink:ChemicalEntity cyanates Salts and esters of cyanic acid, HOC≡N; compounds carrying the cyanate functional group -O-C≡N. Graph cyanates cyanates cyanates http://purl.obolibrary.org/obo/CHEBI_23420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23423 biolink:ChemicalEntity pseudohalogen oxoacid Graph pseudohalogen oxoacid|pseudohalogen oxoacids pseudohalogen oxoacid|pseudohalogen oxoacids http://purl.obolibrary.org/obo/CHEBI_23423 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23424 biolink:ChemicalEntity cyanides Salts and C-organyl derivatives of hydrogen cyanide, HC≡N. Graph cyanides cyanides cyanides http://purl.obolibrary.org/obo/CHEBI_23424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23436 biolink:ChemicalEntity cyanogenic glycoside A glycoside in which the aglycone contains a cyanide group. A cyanogenic glycoside can release poisonous hydrogen cyanide if acted upon by some enzyme. Graph cyanogenic glycosides cyanogenic glycosides http://purl.obolibrary.org/obo/CHEBI_23436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23437 biolink:ChemicalEntity cyanohydrin An α-hydroxynitrile resulting from the formal addition of hydrogen cyanide to the C=O bond of an aldehyde or ketone. kegg.compound:C05712 Graph Cyanohydrin|cyanohydrins Cyanohydrin|cyanohydrins http://purl.obolibrary.org/obo/CHEBI_23437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23438 biolink:ChemicalEntity cyanopyridine Any pyridine carrying at least one cyano substituent. Graph cyanopyridines cyanopyridines http://purl.obolibrary.org/obo/CHEBI_23438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234420 biolink:ChemicalEntity (S)-noradrenaline(1+) An organic cation that is the conjugate acid of (S)-noradrenaline, obtained by protonation of the primary amino group; major species at pH 7.3. Graph (2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethan-1-aminium|(2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium|(S)-noradrenaline cation|(S)-noradrenalinium cation|(S)-noradrenalinium(1+) (2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium (2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethan-1-aminium|(2S)-2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium|(S)-noradrenaline cation|(S)-noradrenalinium cation|(S)-noradrenalinium(1+) http://purl.obolibrary.org/obo/CHEBI_234420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23443 biolink:ChemicalEntity cyclic amide Graph cyclic amide|cyclic amides cyclic amide|cyclic amides http://purl.obolibrary.org/obo/CHEBI_23443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234435 biolink:ChemicalEntity punicalagin(4-) metacyc.compound:CPD-27794 Graph punicalagin punicalagin http://purl.obolibrary.org/obo/CHEBI_234435 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23445 biolink:ChemicalEntity cyclic hydroxamic acid A lactam having a hydroxy substituent on the amide nitrogen. Graph N-hydroxylactam|N-hydroxylactams|cyclic hydroxamic acids N-hydroxylactam|N-hydroxylactams|cyclic hydroxamic acids http://purl.obolibrary.org/obo/CHEBI_23445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23446 biolink:ChemicalEntity cyclic monoterpene ketone A cyclic terpene ketone in which the terpene specified is monoterpene. Graph cyclic monoterpene ketones cyclic monoterpene ketones http://purl.obolibrary.org/obo/CHEBI_23446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23447 biolink:ChemicalEntity cyclic nucleotide Graph cyclic nucleotides cyclic nucleotides http://purl.obolibrary.org/obo/CHEBI_23447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23448 biolink:ChemicalEntity cyclic oligosaccharide Graph cyclic oligosaccharides cyclic oligosaccharides http://purl.obolibrary.org/obo/CHEBI_23448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234480 biolink:ChemicalEntity L-(4-hydroxymethyl)glycine zwitterion pubmed:24375143 Graph L-(4-hydroxymethyl)glycine L-(4-hydroxymethyl)glycine http://purl.obolibrary.org/obo/CHEBI_234480 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23449 biolink:ChemicalEntity cyclic peptide Graph Cyclopeptid|Zyklopeptid|cyclic peptides|peptide cyclique|peptido ciclico Cyclopeptid|Zyklopeptid|cyclic peptides|peptide cyclique|peptido ciclico http://purl.obolibrary.org/obo/CHEBI_23449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23450 biolink:ChemicalEntity cyclitol phosphate Graph cyclitol phosphates cyclitol phosphates http://purl.obolibrary.org/obo/CHEBI_23450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23451 biolink:ChemicalEntity cyclitol A polyol consisting of a cycloalkane containing at least three hydroxy groups, each attached to a different ring carbon atom. Graph cyclitols cyclitols cyclitols http://purl.obolibrary.org/obo/CHEBI_23451 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23453 biolink:ChemicalEntity cycloalkane Saturated monocyclic hydrocarbons (with or without side chains). Graph Zyklan|Zykloalkan|Zykloparaffin|cyclane|cycloalkane|cycloalkanes|cycloparaffin cycloalkane|cycloalkanes Zyklan|Zykloalkan|Zykloparaffin|cyclane|cycloalkane|cycloalkanes|cycloparaffin http://purl.obolibrary.org/obo/CHEBI_23453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23456 biolink:ChemicalEntity cyclodextrin A macrocycle composed of five or more D-glucopyranose units bonded via (1→4)-linkages. wikipedia.en:Cyclodextrin Graph cyclodextrins cyclodextrins http://purl.obolibrary.org/obo/CHEBI_23456 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23457 biolink:ChemicalEntity cyclodiene organochlorine insecticide A sub-category of organochlorine insecticides, the members of which are all derived from hexachlorocyclopentadiene. They possess a structure based on two 3-dimensional carbon ring units, one of which is heavily chlorinated. Graph cyclodiene organochlorine insecticide cyclodiene organochlorine insecticide http://purl.obolibrary.org/obo/CHEBI_23457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:234572 biolink:ChemicalEntity protein aggregation inhibitor Any chemical that inhibits the aggregation of proteins. pubmed:27810360|pubmed:33642983|pubmed:33818499|pubmed:35995346|wikipedia.en:Protein_aggregation Graph protein aggregation inhibitors protein aggregation inhibitors http://purl.obolibrary.org/obo/CHEBI_234572 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23466 biolink:ChemicalEntity cyclohexadienecarboxylate Graph cyclohexadienecarboxylate|cyclohexadienecarboxylates cyclohexadienecarboxylate|cyclohexadienecarboxylates http://purl.obolibrary.org/obo/CHEBI_23466 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23468 biolink:ChemicalEntity cyclohexadienecarboxylic acid Any cyclohexadiene substituted by a carboxylic group at unspecified position. Graph cyclohexadienecarboxylic acid|cyclohexadienecarboxylic acids cyclohexadienecarboxylic acid|cyclohexadienecarboxylic acids http://purl.obolibrary.org/obo/CHEBI_23468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23469 biolink:ChemicalEntity cyclohexadienediol Any cyclohexadiene in which two hydroxy groups are located on the cyclohexadiene ring. Graph cyclohexadienediol|cyclohexadienediols cyclohexadienediol|cyclohexadienediols http://purl.obolibrary.org/obo/CHEBI_23469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23478 biolink:ChemicalEntity cyclohexanedione Cyclohexanones carrying two oxo substituents. Graph Cyclohexandion|Zyklohexandion|cyclohexanedione Cyclohexandion|Zyklohexandion|cyclohexanedione http://purl.obolibrary.org/obo/CHEBI_23478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23480 biolink:ChemicalEntity cyclohexanols An alcohol in which one or more hydroxy groups are attached to a cyclohexane skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_23480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23482 biolink:ChemicalEntity cyclohexanones Any alicyclic ketone based on a cyclohexane skeleton and its substituted derivatives thereof. Graph http://purl.obolibrary.org/obo/CHEBI_23482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23483 biolink:ChemicalEntity cyclohexenecarboxylic acid Graph cyclohexenecarboxylic acids cyclohexenecarboxylic acids http://purl.obolibrary.org/obo/CHEBI_23483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23493 biolink:ChemicalEntity cyclopentanes Cyclopentane and its derivatives formed by substitution. Graph http://purl.obolibrary.org/obo/CHEBI_23493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23495 biolink:ChemicalEntity cyclopentanols An alcohol in which one or more hydroxy groups are attached to a cyclopentane skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_23495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23500 biolink:ChemicalEntity cyclopropanecarboxylic acid beilstein:969839|cas:1759-53-1|gmelin:2246|kegg.compound:C16267 Graph carboxycyclopropane|cyclopropanecarboxylic acid|cyclopropylcarboxylic acid cyclopropanecarboxylic acid carboxycyclopropane|cyclopropanecarboxylic acid|cyclopropylcarboxylic acid http://purl.obolibrary.org/obo/CHEBI_23500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23503 biolink:ChemicalEntity 4-amino-1,2-oxazolidin-3-one A member of the class of oxazolidines that is isoxazoldin-3-one which is substituted at position 4 by an amino group. cas:68-39-3|kegg.compound:C06682 Graph 4-amino-1,2-oxazolidin-3-one|cycloserine 4-amino-1,2-oxazolidin-3-one 4-amino-1,2-oxazolidin-3-one|cycloserine http://purl.obolibrary.org/obo/CHEBI_23503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23505 biolink:ChemicalEntity cystathionines kegg.compound:C00542 Graph cystathionines cystathionines http://purl.obolibrary.org/obo/CHEBI_23505 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23509 biolink:ChemicalEntity cysteine derivative An amino acid derivative resulting from reaction of cysteine at the amino group, carboxy group, or thiol group, or from the replacement of any hydrogen of cysteine by a heteroatom. The definition normally excludes peptides containing cysteine residues. Graph cysteine derivative|cysteine derivatives cysteine derivative|cysteine derivatives http://purl.obolibrary.org/obo/CHEBI_23509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23511 biolink:ChemicalEntity cysteinyl group Graph 2-amino-3-sulfanylpropanoyl|cysteinyl 2-amino-3-sulfanylpropanoyl 2-amino-3-sulfanylpropanoyl|cysteinyl http://purl.obolibrary.org/obo/CHEBI_23511 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23521 biolink:ChemicalEntity cytidine 5'-phosphate Graph cytidine 5'-phosphates cytidine 5'-phosphates http://purl.obolibrary.org/obo/CHEBI_23521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23523 biolink:ChemicalEntity cytidine phosphate Graph cytidine phosphates cytidine phosphates http://purl.obolibrary.org/obo/CHEBI_23523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23524 biolink:ChemicalEntity cytidines Graph http://purl.obolibrary.org/obo/CHEBI_23524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23527 biolink:ChemicalEntity cytochalasin B An organic heterotricyclic compound, that is a mycotoxin which is cell permeable an an inhibitor of cytoplasmic division by blocking the formation of contractile microfilaments. agr:IND605251338|agr:IND605574141|cas:14930-96-2|kegg.compound:C19954|knapsack:C00011322|lipidmaps:LMPK11000002|metacyc.compound:CPD-20745|pubmed:10716458|pubmed:15869745|pubmed:22882828|pubmed:27581081|pubmed:29050297|pubmed:33070838|pubmed:33996522|pubmed:7327176|pubmed:7378656|pubmed:9568120|reaxys:1096210|wikipedia.en:Cytochalasin_B Graph (3E,5R,9R,11E,12aS,13S,15S,15aS,16S,18aS)-16-benzyl-5,13-dihydroxy-9,15-dimethyl-14-methylidene-6,7,8,9,10,12a,13,14,15,15a,16,17-dodecahydro-2H-oxacyclotetradecino[2,3-d]isoindole-2,18(5H)-dione|Phomin|cytochalasin B (3E,5R,9R,11E,12aS,13S,15S,15aS,16S,18aS)-16-benzyl-5,13-dihydroxy-9,15-dimethyl-14-methylidene-6,7,8,9,10,12a,13,14,15,15a,16,17-dodecahydro-2H-oxacyclotetradecino[2,3-d]isoindole-2,18(5H)-dione (3E,5R,9R,11E,12aS,13S,15S,15aS,16S,18aS)-16-benzyl-5,13-dihydroxy-9,15-dimethyl-14-methylidene-6,7,8,9,10,12a,13,14,15,15a,16,17-dodecahydro-2H-oxacyclotetradecino[2,3-d]isoindole-2,18(5H)-dione|Phomin|cytochalasin B http://purl.obolibrary.org/obo/CHEBI_23527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23528 biolink:ChemicalEntity cytochalasin wikipedia.en:Cytochalasin Graph cytochalasins cytochalasins http://purl.obolibrary.org/obo/CHEBI_23528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23530 biolink:ChemicalEntity cytokinin A phytohormone that promote cell division, or cytokinesis, in plant roots and shoots. wikipedia.en:Cytokinin Graph http://purl.obolibrary.org/obo/CHEBI_23530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:235343 biolink:ChemicalEntity ellagic acid(2-) pubmed:26915983 Graph ellagic acid ellagic acid http://purl.obolibrary.org/obo/CHEBI_235343 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:235375 biolink:ChemicalEntity Graph http://purl.obolibrary.org/obo/CHEBI_235375
CHEBI:235457 biolink:ChemicalEntity N(6),N(6)-dimethyl-AMP(2-) pubmed:40840445 Graph N(6),N(6)-dimethyl-AMP N(6),N(6)-dimethyl-AMP http://purl.obolibrary.org/obo/CHEBI_235457 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:235517 biolink:ChemicalEntity D-histidinol A histidinol that has D-configuration. cas:70142-15-3 Graph (2R)-2-amino-3-(1H-imidazol-4-yl)-1-propanol|(2R)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol|(R)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol (2R)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol (2R)-2-amino-3-(1H-imidazol-4-yl)-1-propanol|(2R)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol|(R)-2-amino-3-(1H-imidazol-4-yl)propan-1-ol http://purl.obolibrary.org/obo/CHEBI_235517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:235521 biolink:ChemicalEntity N-glycoloyl-D-glucosamine 6-phosphate(2-) pubmed:22692205 Graph N-glycoloyl-D-glucosamine 6-phosphate N-glycoloyl-D-glucosamine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_235521 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23557 biolink:ChemicalEntity dTDP-sugar Graph dTDP-sugar|dTDP-sugars dTDP-sugar|dTDP-sugars http://purl.obolibrary.org/obo/CHEBI_23557 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23582 biolink:ChemicalEntity defoliant A herbicide which when sprayed or dusted on plants causes its leaves to fall off. Graph Defoliationsmittel|Entlaubungsmittel|defoliants Defoliationsmittel|Entlaubungsmittel|defoliants http://purl.obolibrary.org/obo/CHEBI_23582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23591 biolink:ChemicalEntity dehydroamino acid An amino acid derivative that is an amino acid whose side-chain has undergone formal dehydrogenation. wikipedia.en:Dehydroamino_acid Graph dehydroamino acid|dehydroamino acids dehydroamino acid|dehydroamino acids http://purl.obolibrary.org/obo/CHEBI_23591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23612 biolink:ChemicalEntity deoxyadenosine phosphate Graph deoxyadenosine phosphates deoxyadenosine phosphates http://purl.obolibrary.org/obo/CHEBI_23612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23614 biolink:ChemicalEntity deoxycholate beilstein:3629953|gmelin:1774558 Graph 3alpha,12alpha-dihydroxy-5beta-cholan-24-oate|3alpha,12alpha-dihydroxy-5beta-cholanate|Desoxycholat|deoxycholate 3alpha,12alpha-dihydroxy-5beta-cholan-24-oate 3alpha,12alpha-dihydroxy-5beta-cholan-24-oate|3alpha,12alpha-dihydroxy-5beta-cholanate|Desoxycholat|deoxycholate http://purl.obolibrary.org/obo/CHEBI_23614 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23618 biolink:ChemicalEntity deoxycortisol A 3,20-dioxo steroid having the structure of cortisol but lacking one or more of its hydroxy groups. Graph deoxycortisols deoxycortisols http://purl.obolibrary.org/obo/CHEBI_23618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23621 biolink:ChemicalEntity deoxycytidine phosphate Graph deoxycytidine phosphates deoxycytidine phosphates http://purl.obolibrary.org/obo/CHEBI_23621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23622 biolink:ChemicalEntity deoxygalactose Graph deoxygalactose|deoxygalactoses deoxygalactose|deoxygalactoses http://purl.obolibrary.org/obo/CHEBI_23622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23623 biolink:ChemicalEntity deoxyglucose A deoxyhexose comprising glucose having at least one hydroxy group replaced by hydrogen. Graph deoxyglucose|deoxyglucoses deoxyglucose|deoxyglucoses http://purl.obolibrary.org/obo/CHEBI_23623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23625 biolink:ChemicalEntity deoxyguanosine phosphate Graph deoxyguanosine phosphates deoxyguanosine phosphates http://purl.obolibrary.org/obo/CHEBI_23625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23627 biolink:ChemicalEntity deoxyaldohexose phosphate Graph deoxyaldohexose phosphate|deoxyaldohexose phosphates deoxyaldohexose phosphate|deoxyaldohexose phosphates http://purl.obolibrary.org/obo/CHEBI_23627 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23628 biolink:ChemicalEntity deoxyhexose Any C6 deoxy sugar having at least one hydroxy group replaced by hydrogen. Graph deoxyhexose|deoxyhexoses deoxyhexose|deoxyhexoses http://purl.obolibrary.org/obo/CHEBI_23628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23630 biolink:ChemicalEntity deoxyinosine phosphate Graph deoxyinosine phosphates deoxyinosine phosphates http://purl.obolibrary.org/obo/CHEBI_23630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23634 biolink:ChemicalEntity deoxyaldopentose phosphate Graph deoxyaldopentose phosphates|deoxypentose phosphate deoxyaldopentose phosphates|deoxypentose phosphate http://purl.obolibrary.org/obo/CHEBI_23634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23635 biolink:ChemicalEntity deoxypentose Graph deoxypentose|deoxypentoses deoxypentose|deoxypentoses http://purl.obolibrary.org/obo/CHEBI_23635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23636 biolink:ChemicalEntity deoxyribonucleoside Graph deoxyribonucleosides deoxyribonucleosides http://purl.obolibrary.org/obo/CHEBI_23636 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23638 biolink:ChemicalEntity deoxyribulose phosphate Graph deoxyribulose phosphate|deoxyribulose phosphates deoxyribulose phosphate|deoxyribulose phosphates http://purl.obolibrary.org/obo/CHEBI_23638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23639 biolink:ChemicalEntity deoxy sugar Any sugar having a hydroxy group replaced with a hydrogen atom. Graph deoxy sugars|deoxysugar|deoxysugars deoxy sugars|deoxysugar|deoxysugars http://purl.obolibrary.org/obo/CHEBI_23639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23641 biolink:ChemicalEntity deoxyuridine phosphate Graph deoxyuridine phosphates deoxyuridine phosphates http://purl.obolibrary.org/obo/CHEBI_23641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23643 biolink:ChemicalEntity depsipeptide A natural or synthetic compound having a sequence of amino and hydroxy carboxylic acid residues (usually α-amino and α-hydroxy acids), commonly but not necessarily regularly alternating. Graph Depsipeptid|depsipeptides depsipeptides Depsipeptid|depsipeptides http://purl.obolibrary.org/obo/CHEBI_23643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2365 biolink:ChemicalEntity (+)-abscisic acid The naturally occurring (1'S)-(+) enantiomer of abscisic acid. It is an important sesquiterpenoid plant hormone which acts as a regulator of plant responses to environmental stresses such as drought and cold. beilstein:4190247|bpdb:2486|cas:21293-29-8|hmdb:HMDB0035140|kegg.compound:C06082|knapsack:C00000134|lipidmaps:LMPR0103050001|pubmed:10915053|pubmed:12114582|pubmed:16169217|pubmed:17582774|pubmed:17741533|pubmed:19898420|pubmed:19956245|reaxys:2130328|wikipedia.en:Abscisic_acid Graph (+)-(S)-ABA|(+)-Abscisic acid|(+)-S-ABA|(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid|(7E,9Z)-(6S)-6-hydroxy-3-oxo-11-apo-epsilon-caroten-11-oic acid|(S)-(+)-abscisic acid|2-cis,4-trans-abscisic acid|ABA|Abscisic acid|abscisin II (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid (+)-(S)-ABA|(+)-Abscisic acid|(+)-S-ABA|(2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid|(7E,9Z)-(6S)-6-hydroxy-3-oxo-11-apo-epsilon-caroten-11-oic acid|(S)-(+)-abscisic acid|2-cis,4-trans-abscisic acid|ABA|Abscisic acid|abscisin II http://purl.obolibrary.org/obo/CHEBI_2365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2366 biolink:ChemicalEntity absinthin A dimeric sesquiterpene lactone that is produced by the plant Artemisia absinthium (Wormwood). The bitter tasting constituent of Absinthe. agr:IND43864075|cas:1362-42-1|hmdb:HMDB0035742|kegg.compound:C09286|knapsack:C00000172|patent:CN101658656|patent:SE530687|pubmed:15631427|pubmed:25037681|reaxys:4730201|wikipedia.en:Absinthin Graph (+)-absinthin|(1R,2R,5S,8S,9S,12S,13R,14S,15S,16R,17S,20S,21S,24S)-12,17-dihydroxy-3,8,12,17,21,25-hexamethyl-6,23-dioxaheptacyclo[13.9.2.0(1,16).0(2,14).0(4,13).0(5,9).0(20,24)]hexacosa-3,25-diene-7,22-dione|Absinthin|Absynthin (1R,2R,5S,8S,9S,12S,13R,14S,15S,16R,17S,20S,21S,24S)-12,17-dihydroxy-3,8,12,17,21,25-hexamethyl-6,23-dioxaheptacyclo[13.9.2.0(1,16).0(2,14).0(4,13).0(5,9).0(20,24)]hexacosa-3,25-diene-7,22-dione (+)-absinthin|(1R,2R,5S,8S,9S,12S,13R,14S,15S,16R,17S,20S,21S,24S)-12,17-dihydroxy-3,8,12,17,21,25-hexamethyl-6,23-dioxaheptacyclo[13.9.2.0(1,16).0(2,14).0(4,13).0(5,9).0(20,24)]hexacosa-3,25-diene-7,22-dione|Absinthin|Absynthin http://purl.obolibrary.org/obo/CHEBI_2366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23665 biolink:ChemicalEntity dialkylarylamine kegg.compound:C02401 Graph Dialkylarylamine|dialkylarylamines Dialkylarylamine|dialkylarylamines http://purl.obolibrary.org/obo/CHEBI_23665 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23666 biolink:ChemicalEntity diamine Any polyamine that contains two amino groups. Graph diamines diamines diamines http://purl.obolibrary.org/obo/CHEBI_23666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23671 biolink:ChemicalEntity 2,6-diaminopimelate(2-) A dicarboxylic acid dianion that is the conjugate base of 2,6-diaminopimelic acid. Graph 2,6-diaminoheptanedioate|diaminoheptanedioate|diaminopimelate 2,6-diaminoheptanedioate 2,6-diaminoheptanedioate|diaminoheptanedioate|diaminopimelate http://purl.obolibrary.org/obo/CHEBI_23671 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23673 biolink:ChemicalEntity 2,6-diaminopimelic acid The amino dicarboxylic acid that is heptanedioic acid with amino substituents at C-2 and C-6. cas:583-93-7|drugbank:DB03590|pubmed:10930630|pubmed:13984704|pubmed:23913026|reaxys:1787719 Graph 2,6-diaminoheptanedioic acid|Diaminopimelic acid|Dpm|alpha,epsilon-diaminopimelic acid 2,6-diaminoheptanedioic acid 2,6-diaminoheptanedioic acid|Diaminopimelic acid|Dpm|alpha,epsilon-diaminopimelic acid http://purl.obolibrary.org/obo/CHEBI_23673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23677 biolink:ChemicalEntity diazole An azole that is either one of a pair of heterocyclic organic compounds comprising three carbon atoms and two nitrogen atoms arranged in a ring. Graph diazoles diazoles http://purl.obolibrary.org/obo/CHEBI_23677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23681 biolink:ChemicalEntity dibenzothiophene A mancude organic heterotricyclic parent that consists of a thiophene ring flanked by two benzene rings ortho-fused across the 2,3- and 4,5-positions. cas:132-65-0|gmelin:83631|kegg.drug:D03777|pubmed:15092946|pubmed:16232582|pubmed:16268154|pubmed:16391083|pubmed:17616875|pubmed:21750993|reaxys:121101|umbbd.compound:c0118|wikipedia.en:Dibenzothiophene Graph 9-thiafluorene|[1,1'-biphenyl]-2,2'-diyl sulfide|alpha-thiafluorene|dibenzo[b,d]thiophene|dibenzothiophene|diphenylene sulfide dibenzo[b,d]thiophene 9-thiafluorene|[1,1'-biphenyl]-2,2'-diyl sulfide|alpha-thiafluorene|dibenzo[b,d]thiophene|dibenzothiophene|diphenylene sulfide http://purl.obolibrary.org/obo/CHEBI_23681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23683 biolink:ChemicalEntity dibenzothiophene 5-oxide A member of the class of dibenzothiophenes that is the 5-oxo derivative of dibenzothiophene. cas:1013-23-6|reaxys:126504 Graph DBTO|dibenzo[b,d]thiophene 5-oxide|dibenzothiophene 5-oxide dibenzo[b,d]thiophene 5-oxide DBTO|dibenzo[b,d]thiophene 5-oxide|dibenzothiophene 5-oxide http://purl.obolibrary.org/obo/CHEBI_23683 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23684 biolink:ChemicalEntity dibenzothiophenes Graph http://purl.obolibrary.org/obo/CHEBI_23684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23690 biolink:ChemicalEntity dicarboxylic acid amide Graph dicarboxylic acid amides dicarboxylic acid amides http://purl.obolibrary.org/obo/CHEBI_23690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23696 biolink:ChemicalEntity dichloroaniline cas:27134-27-6|wikipedia.en:Dichloroaniline Graph Dichloranilin|dichloroaniline|dichloroanilines dichloroaniline Dichloranilin|dichloroaniline|dichloroanilines http://purl.obolibrary.org/obo/CHEBI_23696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23697 biolink:ChemicalEntity dichlorobenzene Any member of the class of chlorobenzenes carrying two chloro groups at unspecified positions. Graph Dichlorbenzol|dichlorobenzene|dichlorobenzenes dichlorobenzene Dichlorbenzol|dichlorobenzene|dichlorobenzenes http://purl.obolibrary.org/obo/CHEBI_23697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23698 biolink:ChemicalEntity dichlorobenzoyl-CoA Any chlorobenzoyl-CoA having dichlorobenzoyl as the aroyl substituent. Graph dichlorobenzoyl-CoAs dichlorobenzoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_23698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23699 biolink:ChemicalEntity dichlorocatechol A chlorocatechol carrying two chloro groups at unspecified positions. Graph http://purl.obolibrary.org/obo/CHEBI_23699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23700 biolink:ChemicalEntity dichlorohydroquinone A member of the class of chlorohydroquinones carrying two chloro substituents at unspecified positions. Graph http://purl.obolibrary.org/obo/CHEBI_23700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23702 biolink:ChemicalEntity dichlorophenol Any chlorophenol carrying chloro substituents. wikipedia.en:Dichlorophenol Graph http://purl.obolibrary.org/obo/CHEBI_23702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23703 biolink:ChemicalEntity dideoxyhexose Graph dideoxyhexose|dideoxyhexoses dideoxyhexose|dideoxyhexoses http://purl.obolibrary.org/obo/CHEBI_23703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23711 biolink:ChemicalEntity diethyl 2-methyl-3-hydroxysuccinate Graph diethyl-2-methyl-3-hydroxysuccinates diethyl-2-methyl-3-hydroxysuccinates http://purl.obolibrary.org/obo/CHEBI_23711 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23730 biolink:ChemicalEntity 5-oxo-2-furylacetic acid An oxo monocarboxylic acid that is 2,5-dihydrofuran-2-ylacetic acid substituted by an oxo group at position 5. Graph 5-oxo-2-furylacetic acids 5-oxo-2-furylacetic acids http://purl.obolibrary.org/obo/CHEBI_23730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23736 biolink:ChemicalEntity 4,5-dihydrocortisone A 3-oxo steroid that is cortisone in which the double bond between positions 4 and 5 has been reduced to a single bond. reaxys:4206949 Graph dihydrocortisone dihydrocortisone http://purl.obolibrary.org/obo/CHEBI_23736 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23738 biolink:ChemicalEntity dihydrophenanthrenediol Graph dihydrophenanthrenediols dihydrophenanthrenediols http://purl.obolibrary.org/obo/CHEBI_23738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23743 biolink:ChemicalEntity dihydrofolic acids A group of heterocyclic compounds based on the 7,8-dihydropteroic acid skeleton conjugated with one or more L-glutamic acid units. Graph dihydrofolate|dihydrofolates|dihydrofolic acid dihydrofolate|dihydrofolates|dihydrofolic acid http://purl.obolibrary.org/obo/CHEBI_23743 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23745 biolink:ChemicalEntity 3,4-dihydroisocoumarin The simplest member of the class of dihydroisocoumarins that is the 3,4-dihydro derivative of isocoumarin. cas:4702-34-5|reaxys:124656 Graph 1-oxo-isochroman|3,4-dihydro-1H-2-benzopyran-1-one|3,4-dihydro-1H-isochromen-1-one|dihydroisocoumarin 3,4-dihydro-1H-isochromen-1-one 1-oxo-isochroman|3,4-dihydro-1H-2-benzopyran-1-one|3,4-dihydro-1H-isochromen-1-one|dihydroisocoumarin http://purl.obolibrary.org/obo/CHEBI_23745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2376 biolink:ChemicalEntity acarbose A tetrasaccharide derivative consisting of a dideoxy-4-{[4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl C7 cyclitol moiety [called valienol (or valienamine)] linked via nitrogen to isomaltotriose. cas:56180-94-0|chemspider:38116|drugbank:DB00284|drugcentral:39|hmdb:HMDB0014429|kegg.compound:C06802|kegg.drug:D00216|knapsack:C00016021|lincs.smallmolecule:LSM-4345|patent:DE2347782|patent:US4062950|pubmed:11937512|pubmed:18248270|pubmed:24245565|pubmed:25044702|pubmed:8893066|pubmed:9805641|wikipedia.en:Acarbose Graph 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|Glucobay|Precose|acarbosa|acarbose|acarbosum 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucopyranose|Glucobay|Precose|acarbosa|acarbose|acarbosum http://purl.obolibrary.org/obo/CHEBI_2376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23763 biolink:ChemicalEntity pyrroline Any organic heteromonocyclic compound with a structure based on a dihydropyrrole. wikipedia.en:Pyrroline Graph dihydropyrrole|pyrroline|pyrrolines dihydropyrrole|pyrroline|pyrrolines http://purl.obolibrary.org/obo/CHEBI_23763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23765 biolink:ChemicalEntity quinolone Graph quinolones quinolones http://purl.obolibrary.org/obo/CHEBI_23765 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23775 biolink:ChemicalEntity dihydroxy-5beta-cholanic acid A hydroxy-5β-cholanic acid carrying two hydroxy groups at unspecified positions. Graph dihydroxy-5beta-cholanic acids dihydroxy-5beta-cholanic acids http://purl.obolibrary.org/obo/CHEBI_23775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23776 biolink:ChemicalEntity dihydroxyacetophenone A hydroxyacetophenone carrying two hydroxy substituents. Graph dihydroxyacetophenones dihydroxyacetophenones http://purl.obolibrary.org/obo/CHEBI_23776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23778 biolink:ChemicalEntity dihydroxybenzoic acid Any member of the class of hydroxybenzoic acids carrying two phenolic hydroxy groups on the benzene ring and its derivatives. Graph dihydroxybenzoic acids dihydroxybenzoic acids http://purl.obolibrary.org/obo/CHEBI_23778 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23781 biolink:ChemicalEntity dihydroxyindole Any member of the class of hydroxyindoles carrying two hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_23781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23783 biolink:ChemicalEntity naphthalenediols Any hydroxynaphthalene derivative that has two hydroxy substituents. Graph dihydroxynaphthalenes dihydroxynaphthalenes http://purl.obolibrary.org/obo/CHEBI_23783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2379 biolink:ChemicalEntity acebutolol An ether that is the 2-acetyl-4-(butanoylamino)phenyl ether of the primary hydroxy group of 3-(propan-2-ylamino)propane-1,2-diol. beilstein:2162244|cas:37517-30-9|drugbank:DB01193|drugcentral:40|gmelin:2179873|kegg.compound:C06803|kegg.drug:D02338|lincs.smallmolecule:LSM-4384|patent:US3857952|patent:ZA6808345|pubmed:1378852|wikipedia.en:Acebutolol Graph (+-)-acebutolol|3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide|5'-butyramido-2'-(2-hydroxy-3-isopropylaminopropoxy)acetophenone|Acebutolol|N-(3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl)butanamide|N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]butanamide|N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide|acebutolol|acebutololum|acetobutolol N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide (+-)-acebutolol|3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide|5'-butyramido-2'-(2-hydroxy-3-isopropylaminopropoxy)acetophenone|Acebutolol|N-(3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl)butanamide|N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]butanamide|N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide|acebutolol|acebutololum|acetobutolol http://purl.obolibrary.org/obo/CHEBI_2379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23792 biolink:ChemicalEntity dihydroxypteridine Graph dihydroxypteridines dihydroxypteridines http://purl.obolibrary.org/obo/CHEBI_23792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23793 biolink:ChemicalEntity dihydroxypyridine Graph dihydroxypyridines dihydroxypyridines http://purl.obolibrary.org/obo/CHEBI_23793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:237958 biolink:ChemicalEntity ({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(9H-purin-9-yl)oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate Graph http://purl.obolibrary.org/obo/CHEBI_237958 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:23796 biolink:ChemicalEntity diiodotyrosine A dihalogenated L-tyrosine which has two iodo-substituents on the benzyl moiety. Graph http://purl.obolibrary.org/obo/CHEBI_23796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23798 biolink:ChemicalEntity dimethoxyflavone Any methoxyflavone with two methoxy substituents. Graph dimethoxyflavones dimethoxyflavones http://purl.obolibrary.org/obo/CHEBI_23798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23806 biolink:ChemicalEntity dimethylaniline A methylaniline carrying at least two methyl groups. Graph dimethylanilines dimethylanilines http://purl.obolibrary.org/obo/CHEBI_23806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23809 biolink:ChemicalEntity dimethylbenzimidazole Graph dimethylbenzimidazoles dimethylbenzimidazoles http://purl.obolibrary.org/obo/CHEBI_23809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23812 biolink:ChemicalEntity dimethylmaleic acid A dicarboxylic acid that is maleic acid in which each of the hydrogens that is attached to a carbon atom is substituted by a methyl group. cas:488-21-1|kegg.compound:C00922|metacyc.compound:DIMETHYLMAL-CPD|pubmed:5266166|reaxys:1723592 Graph (2Z)-2,3-dimethylbut-2-enedioic acid|2,3-dimethylmaleic acid|Dimethylmaleic acid|alpha,beta-Dimethylmaleic acid (2Z)-2,3-dimethylbut-2-enedioic acid (2Z)-2,3-dimethylbut-2-enedioic acid|2,3-dimethylmaleic acid|Dimethylmaleic acid|alpha,beta-Dimethylmaleic acid http://purl.obolibrary.org/obo/CHEBI_23812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23816 biolink:ChemicalEntity dimethylsilanediol beilstein:1731569|cas:1066-42-8|gmelin:404726|umbbd.compound:c0356 Graph (CH3)2Si(OH)2|Si(OH)2Me2|dimethylsilanediol dimethylsilanediol (CH3)2Si(OH)2|Si(OH)2Me2|dimethylsilanediol http://purl.obolibrary.org/obo/CHEBI_23816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23818 biolink:ChemicalEntity dimethylxanthine Graph dimethylxanthines dimethylxanthines http://purl.obolibrary.org/obo/CHEBI_23818 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23821 biolink:ChemicalEntity dinitroglycerol A nitroglycerol carrying two nitro groups at unspecified positions. Graph dinitroglycerols dinitroglycerols http://purl.obolibrary.org/obo/CHEBI_23821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23824 biolink:ChemicalEntity diol A compound that contains two hydroxy groups, generally assumed to be, but not necessarily, alcoholic. Aliphatic diols are also called glycols. wikipedia.en:Diol Graph diols diols diols http://purl.obolibrary.org/obo/CHEBI_23824 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23825 biolink:ChemicalEntity dibenzodioxine Oxanthrene (formerly dibenzo[b,e][1,4]dioxine) and its derivatives. Graph dibenzodioxines|dibenzodioxins|dioxins|oxanthrenes dibenzodioxines|dibenzodioxins|dioxins|oxanthrenes http://purl.obolibrary.org/obo/CHEBI_23825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23843 biolink:ChemicalEntity disaccharide phosphate Graph disaccharide phosphates disaccharide phosphates http://purl.obolibrary.org/obo/CHEBI_23843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23847 biolink:ChemicalEntity diterpene alkaloid Graph diterpene alkaloids diterpene alkaloids http://purl.obolibrary.org/obo/CHEBI_23847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23849 biolink:ChemicalEntity diterpenoid Any terpenoid derived from a diterpene. The term includes compounds in which the C20 skeleton of the parent diterpene has been rearranged or modified by the removal of one or more skeletal atoms (generally methyl groups). lipidmaps_class:LMPR0104 Graph C20 isoprenoids|diterpenoides|diterpenoids diterpenoids C20 isoprenoids|diterpenoides|diterpenoids http://purl.obolibrary.org/obo/CHEBI_23849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23853 biolink:ChemicalEntity dithiol Graph dithiols dithiols http://purl.obolibrary.org/obo/CHEBI_23853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23855 biolink:ChemicalEntity divalent carboacyl group A divalent carboacyl group is a group formed by loss of OH from two carboxy groups of a polycarboxylic acid. Graph divalent acyl group|divalent carboacyl groups|divalent carboxylic acyl groups divalent acyl group|divalent carboacyl groups|divalent carboxylic acyl groups http://purl.obolibrary.org/obo/CHEBI_23855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23858 biolink:ChemicalEntity behenate A straight-chain saturated fatty acid anion that is the conjugate base of behenic acid, arising from deprotonation of the carboxylic acid group. gmelin:351197|kegg.compound:C08281 Graph CH3-[CH2]20-COO(-)|Docosanoate|behenate|docosanoate docosanoate CH3-[CH2]20-COO(-)|Docosanoate|behenate|docosanoate http://purl.obolibrary.org/obo/CHEBI_23858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23866 biolink:ChemicalEntity dodecanol A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of twelve carbon atoms. cas:27342-88-7 Graph dodecanols|hydroxydodecane|hydroxydodecanes dodecanols|hydroxydodecane|hydroxydodecanes http://purl.obolibrary.org/obo/CHEBI_23866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23867 biolink:ChemicalEntity dodecenoic acid A C12, straight-chain fatty acid carrying a double bond at any position. cas:1289-45-8|pubmed:18565910|pubmed:4955727 Graph 12:1|C12:1|Dodecensaeure|dodecenoic acid|lauroleic acid dodecenoic acid 12:1|C12:1|Dodecensaeure|dodecenoic acid|lauroleic acid http://purl.obolibrary.org/obo/CHEBI_23867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23869 biolink:ChemicalEntity dodecenoyl-CoA A monounsaturated fatty acyl-CoA in which the S-acyl moiety contains 12 carbons and 1 double bond. Graph http://purl.obolibrary.org/obo/CHEBI_23869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:238698 biolink:ChemicalEntity bevantolol A propanolamine that is 3-aminopropane-1,2-diol in which the hydrogen of the primary hydroxy group is substituted by 3-methylphenyl and one of the hydrogens attached to the nitrogen is substituted by 2-(3,4-dimethoxyphenyl)ethyl. A β1 adrenoceptor antagonist, it has been shown to be as effective as other β-blockers for the treatment of angina pectoris and hypertension. cas:59170-23-9|drugbank:DB01295|drugcentral:360|patent:BE790165|patent:US3857891|patent:US4994618|pubmed:2871781|pubmed:2894292|reaxys:2769444 Graph (+-)-bevantolol|1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol|1-(3,4-dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol|1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol|1-[2-(3,4-Dimethoxy-phenyl)-ethylamino]-3-m-tolyloxy-propan-2-ol|1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol|bevantolol|bevantololum 1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol (+-)-bevantolol|1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol|1-(3,4-dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol|1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol|1-[2-(3,4-Dimethoxy-phenyl)-ethylamino]-3-m-tolyloxy-propan-2-ol|1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol|bevantolol|bevantololum http://purl.obolibrary.org/obo/CHEBI_238698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23870 biolink:ChemicalEntity dodecyl group Graph CH3-[CH2]11-|Dod|dodecan-1-yl|dodecyl|lauryl dodecyl CH3-[CH2]11-|Dod|dodecan-1-yl|dodecyl|lauryl http://purl.obolibrary.org/obo/CHEBI_23870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23872 biolink:ChemicalEntity dodecyl sulfate beilstein:1820003|drugbank:DB03967|gmelin:336103|umbbd.compound:c0563 Graph dodecyl sulfate dodecyl sulfate dodecyl sulfate http://purl.obolibrary.org/obo/CHEBI_23872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23875 biolink:ChemicalEntity dolichol phosphate An isoprenoid phosphate in which the isoprenoid specified is dolichol. Graph dolichol phosphates dolichol phosphates http://purl.obolibrary.org/obo/CHEBI_23875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23888 biolink:ChemicalEntity drug Any substance which when absorbed into a living organism may modify one or more of its functions. The term is generally accepted for a substance taken for a therapeutic purpose, but is also commonly used for abused substances. Graph drugs|medicine drugs|medicine http://purl.obolibrary.org/obo/CHEBI_23888 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23893 biolink:ChemicalEntity ecdysone phosphate Graph ecdysone phosphates ecdysone phosphates http://purl.obolibrary.org/obo/CHEBI_23893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23895 biolink:ChemicalEntity ecdysteroid ester Graph ecdysteroid esters ecdysteroid esters http://purl.obolibrary.org/obo/CHEBI_23895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23897 biolink:ChemicalEntity ecdysteroid A class of steroids that include insect moulting and sex hormones. wikipedia.en:Ecdysteroid Graph ecdysteroid hormones|ecdysteroids ecdysteroid hormones|ecdysteroids http://purl.obolibrary.org/obo/CHEBI_23897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23899 biolink:ChemicalEntity icosanoid Any member of the group of signalling molecules arising from oxidation of the three C20 essential fatty acids (EFAs) icosapentaenoic acid (EPA), arachidonic acid (AA) and dihomo-gamma-linolenic acid (DGLA). lipidmaps_class:LMFA03|pubmed:12697726|pubmed:16107763|pubmed:19160658|pubmed:2657063|wikipedia.en:Eicosanoid Graph eicosanoid|eicosanoids|icosanoid|icosanoids eicosanoid|eicosanoids|icosanoid|icosanoids http://purl.obolibrary.org/obo/CHEBI_23899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23902 biolink:ChemicalEntity icosenoic acid An icosanoid comprising icosanoic acid having one C=C bond at any position. pubmed:10478934|pubmed:6035971 Graph 20:1|C20:1|eicosenoic acids|iconsenoic acid|icosenoic acids 20:1|C20:1|eicosenoic acids|iconsenoic acid|icosenoic acids http://purl.obolibrary.org/obo/CHEBI_23902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23905 biolink:ChemicalEntity monoatomic anion Graph monoatomic anions monoatomic anions http://purl.obolibrary.org/obo/CHEBI_23905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23906 biolink:ChemicalEntity monoatomic cation Graph monoatomic cations monoatomic cations http://purl.obolibrary.org/obo/CHEBI_23906 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23909 biolink:ChemicalEntity ellagitannin A form of hydrolysable tannin produced from ellagic acid. Ellagitannins are glucosides which are readily hydrolysed by water to regenerate ellagic acid when the plants are eaten. wikipedia.en:Ellagitannin Graph ellagitannins ellagitannins http://purl.obolibrary.org/obo/CHEBI_23909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23924 biolink:ChemicalEntity enzyme inhibitor A compound or agent that combines with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. Graph enzyme inhibitor|enzyme inhibitors|inhibidor enzimatico|inhibidores enzimaticos|inhibiteur enzymatique|inhibiteurs enzymatiques enzyme inhibitor enzyme inhibitor|enzyme inhibitors|inhibidor enzimatico|inhibidores enzimaticos|inhibiteur enzymatique|inhibiteurs enzymatiques http://purl.obolibrary.org/obo/CHEBI_23924 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23925 biolink:ChemicalEntity (+)-5-epi-aristolochene A sesquiterpene that is 1,2,3,4,4a,5,6,7-octahydronaphthalene substituted by methyl groups at positions 4 and 4a and a prop-1-en-2-yl group at position 6 (the 4R,4aR,6R-stereoisomer). beilstein:3588800|pubmed:25286411|reaxys:6500129 Graph (+)-5-epi-aristolochene|(4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH-eremophila-9,11-diene|epi-aristolochene (4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH-eremophila-9,11-diene (+)-5-epi-aristolochene|(4R,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene|4betaH-eremophila-9,11-diene|epi-aristolochene http://purl.obolibrary.org/obo/CHEBI_23925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23929 biolink:ChemicalEntity episterol beilstein:2421473|cas:474-68-0|lipidmaps:LMST01030115 Graph (3beta,5alpha)-ergosta-7,24(28)-dien-3-ol|5alpha-ergosta-7,24(28)-dien-3beta-ol|episterol|ergosta-7,24(28)-dien-3-ol 5alpha-ergosta-7,24(28)-dien-3beta-ol (3beta,5alpha)-ergosta-7,24(28)-dien-3-ol|5alpha-ergosta-7,24(28)-dien-3beta-ol|episterol|ergosta-7,24(28)-dien-3-ol http://purl.obolibrary.org/obo/CHEBI_23929 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23931 biolink:ChemicalEntity epoxy monocarboxylic acid Monocarboxylic acids containing at least one epoxy group. Graph epoxy monocarboxylic acids epoxy monocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_23931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23943 biolink:ChemicalEntity ergot alkaloid Graph ergot alkaloids ergot alkaloids http://purl.obolibrary.org/obo/CHEBI_23943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23953 biolink:ChemicalEntity erythromycins Graph erythromycins erythromycins http://purl.obolibrary.org/obo/CHEBI_23953 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23955 biolink:ChemicalEntity erythronolide Graph erythronolides erythronolides http://purl.obolibrary.org/obo/CHEBI_23955 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:23956 biolink:ChemicalEntity erythrose phosphate Graph erythrose phosphate|erythrose phosphates erythrose phosphate|erythrose phosphates http://purl.obolibrary.org/obo/CHEBI_23956 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23957 biolink:ChemicalEntity erythroses Graph http://purl.obolibrary.org/obo/CHEBI_23957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23958 biolink:ChemicalEntity erythrulose beilstein:1721315|beilstein:1749221|cas:496-55-9|cas:533-50-6|kegg.compound:C02022|kegg.compound:C02045 Graph 1,3,4-trihydroxybutan-2-one|D-glycero-Tetrulose|L-glycero-Tetrulose|erythrulose|glycero-tetrulose 1,3,4-trihydroxybutan-2-one|erythrulose|glycero-tetrulose 1,3,4-trihydroxybutan-2-one|D-glycero-Tetrulose|L-glycero-Tetrulose|erythrulose|glycero-tetrulose http://purl.obolibrary.org/obo/CHEBI_23958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23965 biolink:ChemicalEntity estradiol A 3-hydroxy steroid that is estra-1,3,5(10)-triene substituted by hydroxy groups at positions 3 and 17. pubmed:10696569|pubmed:24084694|wikipedia.en:Estradiol Graph estra-1,3,5(10)-triene-3,17-diol|oestradiol estra-1,3,5(10)-triene-3,17-diol estra-1,3,5(10)-triene-3,17-diol|oestradiol http://purl.obolibrary.org/obo/CHEBI_23965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23966 biolink:ChemicalEntity estrane beilstein:3125721|lipidmaps:LMST02010000 Graph Oestran|estrane|oestrane estrane Oestran|estrane|oestrane http://purl.obolibrary.org/obo/CHEBI_23966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23976 biolink:ChemicalEntity ethanediol Any diol that is ethane or substituted ethane carrying two hydroxy groups. Graph ethanediols ethanediols http://purl.obolibrary.org/obo/CHEBI_23976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23981 biolink:ChemicalEntity ethanolamines Graph ethanolamine ethanolamine http://purl.obolibrary.org/obo/CHEBI_23981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23982 biolink:ChemicalEntity ethanols Any primary alcohol based on an ethanol skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_23982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23990 biolink:ChemicalEntity ethyl ester Any carboxylic ester resulting from the formal condensation of the carboxy group of a carboxylic acid with ethanol. Graph carboxylic acid ethyl ester|carboxylic acid ethyl esters|ethyl carboxylate|ethyl carboxylates|ethyl esters carboxylic acid ethyl ester|carboxylic acid ethyl esters|ethyl carboxylate|ethyl carboxylates|ethyl esters http://purl.obolibrary.org/obo/CHEBI_23990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23994 biolink:ChemicalEntity ethyl methanesulfonate A methanesulfonate ester resulting from the formal condensation of methanesulfonic acid with ethanol. cas:62-50-0|kegg.compound:C19239|pubmed:16039156|pubmed:19797863|pubmed:20102787|pubmed:24475756|pubmed:24524729|pubmed:24531730|pubmed:24728647|pubmed:6936603|pubmed:7285888|reaxys:773969|wikipedia.en:Ethyl_methanesulfonate Graph EMS|ethyl mesylate|ethyl methanesulphonate|methylsulfonic acid ethyl ester|methylsulfonic acid, ethyl ester EMS|ethyl mesylate|ethyl methanesulphonate|methylsulfonic acid ethyl ester|methylsulfonic acid, ethyl ester http://purl.obolibrary.org/obo/CHEBI_23994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:23997 biolink:ChemicalEntity ethyl 3-hydroxyhexanoate A fatty acid ester that is the ethyl ester of 3-hydroxyhexanoic acid. cas:2305-25-1|reaxys:1756736 Graph ethyl 3-hydroxyhexanoate ethyl 3-hydroxyhexanoate ethyl 3-hydroxyhexanoate http://purl.obolibrary.org/obo/CHEBI_23997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24002 biolink:ChemicalEntity ethylene releasers Graph ethylene releasers ethylene releasers http://purl.obolibrary.org/obo/CHEBI_24002 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24009 biolink:ChemicalEntity eumelanin cas:12627-86-0|kegg.compound:C17937 Graph eumelanin eumelanin http://purl.obolibrary.org/obo/CHEBI_24009 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2401 biolink:ChemicalEntity acetophenazine A member of the class of phenothiazines that is 10H-phenothiazine substituted by a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at the nitogen atom and an acetyl group at position 2. cas:2751-68-0|drugbank:DB01063|drugcentral:59|hmdb:HMDB0015196|kegg.compound:C06807|pubmed:13904111|pubmed:13986480|pubmed:14020672|pubmed:14211419|reaxys:57631|wikipedia.en:Acetophenazine Graph 1-(10-{3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-10H-phenothiazin-2-yl)ethanone|Acetophenazine 1-(10-{3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-10H-phenothiazin-2-yl)ethanone 1-(10-{3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-10H-phenothiazin-2-yl)ethanone|Acetophenazine http://purl.obolibrary.org/obo/CHEBI_2401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24012 biolink:ChemicalEntity farnesal beilstein:1723427|cas:19317-11-4|gmelin:1784234|kegg.compound:C16501|knapsack:C00030246 Graph 3,7,11-trimethyl-2,6,10-dodecatrienal|3,7,11-trimethyldodeca-2,6,10-trienal|farnesal 3,7,11-trimethyldodeca-2,6,10-trienal 3,7,11-trimethyl-2,6,10-dodecatrienal|3,7,11-trimethyldodeca-2,6,10-trienal|farnesal http://purl.obolibrary.org/obo/CHEBI_24012 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24018 biolink:ChemicalEntity farnesyl phosphate Graph farnesyl phosphates farnesyl phosphates http://purl.obolibrary.org/obo/CHEBI_24018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24020 biolink:ChemicalEntity fat-soluble vitamin (role) Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess. pubmed:31838543|pubmed:32057251|pubmed:33549284|pubmed:34045883 Graph fat-soluble vitamin|fat-soluble vitamins|fettloesliche Vitamine fat-soluble vitamin|fat-soluble vitamins|fettloesliche Vitamine http://purl.obolibrary.org/obo/CHEBI_24020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24026 biolink:ChemicalEntity fatty alcohol An aliphatic alcohol consisting of a chain of 3 to greater than 27 carbon atoms. Fatty alcohols may be saturated or unsaturated and may be branched or unbranched. lipidmaps_class:LMFA05|metacyc.compound:Fatty-Alcohols|wikipedia.en:Fatty_alcohol Graph Fettalkohol|Fettalkohole|a fatty alcohol|alcool gras|fatty alcohol|fatty alcohols Fettalkohol|Fettalkohole|a fatty alcohol|alcool gras|fatty alcohol|fatty alcohols http://purl.obolibrary.org/obo/CHEBI_24026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24027 biolink:ChemicalEntity fatty-acyl group A fatty-acyl group is a group formed by loss of OH from the carboxy group of a fatty acid. pubmed:15351645 Graph fatty-acyl group|fatty-acyl groups fatty-acyl group|fatty-acyl groups http://purl.obolibrary.org/obo/CHEBI_24027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24028 biolink:ChemicalEntity iron(3+) chelator Graph ferric chelator|ferric chelators|iron(III) chelator ferric chelator|ferric chelators|iron(III) chelator http://purl.obolibrary.org/obo/CHEBI_24028 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24031 biolink:ChemicalEntity ferulic acids Graph http://purl.obolibrary.org/obo/CHEBI_24031 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24040 biolink:ChemicalEntity flavin adenine dinucleotide Graph http://purl.obolibrary.org/obo/CHEBI_24040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24041 biolink:ChemicalEntity flavin mononucleotide Graph http://purl.obolibrary.org/obo/CHEBI_24041 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24043 biolink:ChemicalEntity flavones A member of the class of flavonoid with a 2-aryl-1-benzopyran-4-one (2-arylchromen-4-one) skeleton and its substituted derivatives. metacyc.compound:Flavones|wikipedia.en:Flavone Graph 2-aryl-1-benzopyran-4-one|2-aryl-1-benzopyran-4-ones|2-arylchromen-4-one|2-arylchromen-4-ones|a flavone 2-aryl-1-benzopyran-4-one|2-aryl-1-benzopyran-4-ones|2-arylchromen-4-one|2-arylchromen-4-ones|a flavone http://purl.obolibrary.org/obo/CHEBI_24043 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24057 biolink:ChemicalEntity fluoren-9-ones A member of the class of fluorenes carrying an oxo substituent at position 9. Graph http://purl.obolibrary.org/obo/CHEBI_24057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24059 biolink:ChemicalEntity fluorenes An ortho-fused polycyclic arene in which the skeleton is composed of two benzene rings ortho-fused to cyclopentane. Graph http://purl.obolibrary.org/obo/CHEBI_24059 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24060 biolink:ChemicalEntity fluoride salt Graph fluoride salts|fluorides fluoride salts|fluorides http://purl.obolibrary.org/obo/CHEBI_24060 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24061 biolink:ChemicalEntity fluorine atom cas:7782-41-4|webelements:F Graph 9F|F|Fluor|fluor|fluorine|fluorum fluorine 9F|F|Fluor|fluor|fluorine|fluorum http://purl.obolibrary.org/obo/CHEBI_24061 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24062 biolink:ChemicalEntity fluorine molecular entity Graph fluorine compounds|fluorine molecular entities|fluorine molecular entity fluorine compounds|fluorine molecular entities|fluorine molecular entity http://purl.obolibrary.org/obo/CHEBI_24062 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24067 biolink:ChemicalEntity fluoroalkane A haloalkane that is an alkane in which at least one hydrogen atom has been replaced by a fluorine atom. Graph fluoroalkane|fluoroalkanes fluoroalkane|fluoroalkanes http://purl.obolibrary.org/obo/CHEBI_24067 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24068 biolink:ChemicalEntity fluoroamino acid An organofluorine compound that consists of an amino acid substituted by a fluoro group. Graph fluoroamino acids fluoroamino acids http://purl.obolibrary.org/obo/CHEBI_24068 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24079 biolink:ChemicalEntity formamides Amides with the general formula R1R2NCHO (R1 and R2 can be H). Graph http://purl.obolibrary.org/obo/CHEBI_24079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24085 biolink:ChemicalEntity formimidoyltetrahydrofolic acid Graph http://purl.obolibrary.org/obo/CHEBI_24085 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24090 biolink:ChemicalEntity formyl phosphate(2-) beilstein:3539822 Graph formyl phosphate formyl phosphate formyl phosphate http://purl.obolibrary.org/obo/CHEBI_24090 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24099 biolink:ChemicalEntity formyltetrahydrofolic acid Graph http://purl.obolibrary.org/obo/CHEBI_24099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24103 biolink:ChemicalEntity fructosamine Graph fructosamine|fructosamines fructosamine|fructosamines http://purl.obolibrary.org/obo/CHEBI_24103 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24109 biolink:ChemicalEntity fructosyllysine A glyco-amino acid consisting of a D-fructosyl residue attached to the ε-amino group of L-lysine. agr:IND80109283|cas:21291-40-7|kegg.compound:C16488|pubmed:14641079|pubmed:15080644|pubmed:1556177|pubmed:23609106|pubmed:25538281|pubmed:7718622|reaxys:2420179 Graph 1-{[(5S)-5-amino-5-carboxypentyl]amino}-1-deoxy-D-fructose|Fructose lysine|Fructosyl-lysine|N(6)-(1-deoxy-D-fructos-1-yl)-L-lysine|epsilon-Fructoselysine|epsilon-fructosyl-L-lysine N(6)-(1-deoxy-D-fructos-1-yl)-L-lysine 1-{[(5S)-5-amino-5-carboxypentyl]amino}-1-deoxy-D-fructose|Fructose lysine|Fructosyl-lysine|N(6)-(1-deoxy-D-fructos-1-yl)-L-lysine|epsilon-Fructoselysine|epsilon-fructosyl-L-lysine http://purl.obolibrary.org/obo/CHEBI_24109 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24112 biolink:ChemicalEntity fructuronate Graph fructuronate fructuronate fructuronate http://purl.obolibrary.org/obo/CHEBI_24112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24113 biolink:ChemicalEntity fructuronic acid Graph fructuronic acid fructuronic acid fructuronic acid http://purl.obolibrary.org/obo/CHEBI_24113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24115 biolink:ChemicalEntity fuconate Graph 6-deoxygalactonate 6-deoxygalactonate 6-deoxygalactonate http://purl.obolibrary.org/obo/CHEBI_24115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24116 biolink:ChemicalEntity fuconic acid Graph 6-deoxygalactonic acid 6-deoxygalactonic acid 6-deoxygalactonic acid http://purl.obolibrary.org/obo/CHEBI_24116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24119 biolink:ChemicalEntity fucoside Graph fucoside|fucosides fucoside|fucosides http://purl.obolibrary.org/obo/CHEBI_24119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24127 biolink:ChemicalEntity fungicide A substance used to destroy fungal pests. Graph fungicides fungicides http://purl.obolibrary.org/obo/CHEBI_24127 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24128 biolink:ChemicalEntity furanocoumarin Any furochromene that consists of a furan ring fused with a coumarin. The fusion may occur in different ways in give several isomers. wikipedia.en:Furocoumarin Graph furanocoumarins furanocoumarins http://purl.obolibrary.org/obo/CHEBI_24128 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24129 biolink:ChemicalEntity furans Compounds containing at least one furan ring. Graph oxacyclopenta-2,4-dienes oxacyclopenta-2,4-dienes http://purl.obolibrary.org/obo/CHEBI_24129 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24138 biolink:ChemicalEntity galactaric acid derivative A hexaric acid derivative that is formally obtained from galactaric acid. Graph galactaric acid derivatives|galactaric acids galactaric acid derivatives|galactaric acids http://purl.obolibrary.org/obo/CHEBI_24138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24144 biolink:ChemicalEntity galactoglucomannan A heteroglycan that consists of a backbone of randomly distributed (1→4)-linked mannose and glucose units with (1→6)-linked galactose units attached to mannose units. pubmed:2426444 Graph http://purl.obolibrary.org/obo/CHEBI_24144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24145 biolink:ChemicalEntity galactoglycerolipid Any glycoglycerolipid having galactosyl as the glyco component. Graph http://purl.obolibrary.org/obo/CHEBI_24145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24148 biolink:ChemicalEntity galactonate Graph http://purl.obolibrary.org/obo/CHEBI_24148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24149 biolink:ChemicalEntity galactonic acid A hexonic acid that has been found to increase in red blood cells of galactosemic patients. pubmed:14680973 Graph http://purl.obolibrary.org/obo/CHEBI_24149 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24150 biolink:ChemicalEntity galactonolactone Graph galactonolactones|galacturonic acid lactone galactonolactones|galacturonic acid lactone http://purl.obolibrary.org/obo/CHEBI_24150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24151 biolink:ChemicalEntity galactooligosaccharide An oligosaccharide comprised of galactose residues. Graph galactooligosaccharides galactooligosaccharides http://purl.obolibrary.org/obo/CHEBI_24151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24154 biolink:ChemicalEntity galactosamine phosphate Graph galactosamine phosphate|galactosamine phosphates galactosamine phosphate|galactosamine phosphates http://purl.obolibrary.org/obo/CHEBI_24154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24155 biolink:ChemicalEntity galactosamine sulfate Graph galactosamine sulfates galactosamine sulfates http://purl.obolibrary.org/obo/CHEBI_24155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24156 biolink:ChemicalEntity galactosamine Graph galactosamines galactosamines http://purl.obolibrary.org/obo/CHEBI_24156 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24160 biolink:ChemicalEntity galactosaminyl group A glycosaminyl group obtained by removing the hydroxy group from the hemiacetal function of a galactosamine and, by extension, of a lower oligosaccharide having a galactosamine at the reducing end. Graph http://purl.obolibrary.org/obo/CHEBI_24160 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24163 biolink:ChemicalEntity galactoside Graph galactoside|galactosides galactoside|galactosides http://purl.obolibrary.org/obo/CHEBI_24163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24164 biolink:ChemicalEntity galactosyl group A glycosyl group obtained by removing the hydroxy group from the hemiacetal function of a galactose and, by extension, of a lower oligosaccharide having galactose at the reducing end. Graph http://purl.obolibrary.org/obo/CHEBI_24164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24167 biolink:ChemicalEntity galactosylglycerol phosphate Graph galactosylglycerol phosphates galactosylglycerol phosphates http://purl.obolibrary.org/obo/CHEBI_24167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24168 biolink:ChemicalEntity galactosylglycerol A glycosylglycerol in which the glycosyl residue specified is galactose. Graph galactosylglycerols galactosylglycerols http://purl.obolibrary.org/obo/CHEBI_24168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24174 biolink:ChemicalEntity galacturonan Graph galacturonans galacturonans http://purl.obolibrary.org/obo/CHEBI_24174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24175 biolink:ChemicalEntity galacturonate Graph galacturonates galacturonates http://purl.obolibrary.org/obo/CHEBI_24175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24182 biolink:ChemicalEntity gallotannin A class of hydrolysable tannins obtained by condensation of the carboxy group of gallic acid (and its polymeric derivatives) with the hydroxy groups of a monosaccharide (most commonly glucose). cas:18483-17-5|kegg.compound:C17458|wikipedia.en:Gallotannin Graph 1,3,6-Tri-o-galloyl-beta-D-glucose|gallotannins 1,3,6-Tri-o-galloyl-beta-D-glucose|gallotannins http://purl.obolibrary.org/obo/CHEBI_24182 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24183 biolink:ChemicalEntity galloyl beta-D-glucose A class of β-D-glucose compounds having an unspecified number of O-galloyl groups in undeined positions. Graph galloyl beta-D-glucoses galloyl beta-D-glucoses http://purl.obolibrary.org/obo/CHEBI_24183 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24190 biolink:ChemicalEntity gamma-glutamyl group Graph 4-amino-4-carboxybutanoyl|gamma-glutamyl|glutam-5-yl|isoglutamyl group gamma-glutamyl 4-amino-4-carboxybutanoyl|gamma-glutamyl|glutam-5-yl|isoglutamyl group http://purl.obolibrary.org/obo/CHEBI_24190 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24195 biolink:ChemicalEntity gamma-glutamylcysteine Graph gamma-glutamylcysteines gamma-glutamylcysteines http://purl.obolibrary.org/obo/CHEBI_24195 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24215 biolink:ChemicalEntity gentiobioside Graph gentiobioside|gentiobiosides gentiobioside|gentiobiosides http://purl.obolibrary.org/obo/CHEBI_24215 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24221 biolink:ChemicalEntity 3,7-dimethylocta-2,6-dien-1-ol beilstein:8132082|gmelin:2352439|lincs.smallmolecule:LSM-36962 Graph 3,7-dimethyl-2,6-octadien-1-ol|3,7-dimethylocta-2,6-dien-1-ol 3,7-dimethylocta-2,6-dien-1-ol 3,7-dimethyl-2,6-octadien-1-ol|3,7-dimethylocta-2,6-dien-1-ol http://purl.obolibrary.org/obo/CHEBI_24221 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24229 biolink:ChemicalEntity geranylgeraniol A diterpenoid that is hexadeca-2,6,10,14-tetraene substituted by methyl groups at positions 3, 7, 11 and 15 and a hydroxy group at position 1. cas:7614-21-3|lincs.smallmolecule:LSM-5994|pubmed:23304195|pubmed:23983115|pubmed:24006306|pubmed:24762323|reaxys:1797446 Graph 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol 3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol http://purl.obolibrary.org/obo/CHEBI_24229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2423 biolink:ChemicalEntity acetylleucyl-leucyl-norleucinal A tripeptide composed of N-acetylleucyl, leucyl and norleucinal residues joined in sequence. cas:110044-82-1|kegg.compound:C11306|lincs.smallmolecule:LSM-37060|pdb-ccd:CIB|pubmed:11348878|pubmed:8386372|reaxys:24182910|reaxys:7656053 Graph (2S)-2-[(2S)-2-acetamido-4-methylpentanamido]-N-[(1S)-1-formylpentyl]-4-methylpentanamide|Ac-Leu-leu-nle-al|Acetyl-leucyl-leucyl-norleucine-aldehyde|Acetylleucyl-leucyl-norleucinal|N-Ac-Leu-leu-norleucinal|N-acetyl-L-leucyl-N-[(2S)-1-oxohexan-2-yl]-L-leucinamide|N-acetylleucylleucylnorleucinal (2S)-2-[(2S)-2-acetamido-4-methylpentanamido]-N-[(1S)-1-formylpentyl]-4-methylpentanamide|N-acetyl-L-leucyl-N-[(2S)-1-oxohexan-2-yl]-L-leucinamide (2S)-2-[(2S)-2-acetamido-4-methylpentanamido]-N-[(1S)-1-formylpentyl]-4-methylpentanamide|Ac-Leu-leu-nle-al|Acetyl-leucyl-leucyl-norleucine-aldehyde|Acetylleucyl-leucyl-norleucinal|N-Ac-Leu-leu-norleucinal|N-acetyl-L-leucyl-N-[(2S)-1-oxohexan-2-yl]-L-leucinamide|N-acetylleucylleucylnorleucinal http://purl.obolibrary.org/obo/CHEBI_2423 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24231 biolink:ChemicalEntity geranylgeranyl group Graph (2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraen-1-yl group|(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl (2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl (2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraen-1-yl group|(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl http://purl.obolibrary.org/obo/CHEBI_24231 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24232 biolink:ChemicalEntity geranylgeranylglycerol 1-phosphate Graph geranylgeranylglycerol 1-phosphates geranylgeranylglycerol 1-phosphates http://purl.obolibrary.org/obo/CHEBI_24232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2424 biolink:ChemicalEntity acetylpyruvic acid A dioxo monocarboxylic acid that is pentanoic acid carrying two oxo groups at positions 2 and 4. cas:5699-58-1|kegg.compound:C02132|metacyc.compound:CPD-612|pubmed:1254564|reaxys:1759444 Graph 2,4-Dioxopentanoate|2,4-dioxopentanoic acid|2,4-dioxovaleric acid|Acetylpyruvate|Acetylpyruvic acid 2,4-dioxopentanoic acid 2,4-Dioxopentanoate|2,4-dioxopentanoic acid|2,4-dioxovaleric acid|Acetylpyruvate|Acetylpyruvic acid http://purl.obolibrary.org/obo/CHEBI_2424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24250 biolink:ChemicalEntity gibberellin Graph gibberellins gibberellins http://purl.obolibrary.org/obo/CHEBI_24250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24261 biolink:ChemicalEntity glucocorticoid Glucocorticoids are a class of steroid hormones that regulate a variety of physiological processes, in particular control of the concentration of glucose in blood. Graph glucocorticoids glucocorticoids http://purl.obolibrary.org/obo/CHEBI_24261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24262 biolink:ChemicalEntity glucoglycerolipid Graph http://purl.obolibrary.org/obo/CHEBI_24262 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24265 biolink:ChemicalEntity gluconate Graph gluconate gluconate gluconate http://purl.obolibrary.org/obo/CHEBI_24265 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24266 biolink:ChemicalEntity gluconic acid drugbank:DB04304 Graph http://purl.obolibrary.org/obo/CHEBI_24266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24267 biolink:ChemicalEntity gluconolactone Graph gluconolactones gluconolactones http://purl.obolibrary.org/obo/CHEBI_24267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24268 biolink:ChemicalEntity glucooligosaccharide An oligosaccharide comprised of glucose residues. Graph glucooligosaccharides glucooligosaccharides http://purl.obolibrary.org/obo/CHEBI_24268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24269 biolink:ChemicalEntity glucosamine phosphate A hexosamine phosphate having glucosamine as the amino sugar component. Graph glucosamine phosphate|glucosamine phosphates glucosamine phosphate|glucosamine phosphates http://purl.obolibrary.org/obo/CHEBI_24269 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24271 biolink:ChemicalEntity glucosamines Any hexosamine that is glucose in which at least one of the hydroxy groups has been replaced by an amino group. Graph http://purl.obolibrary.org/obo/CHEBI_24271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24272 biolink:ChemicalEntity glucosaminyl group A glycosaminyl group obtained by removing the hydroxy group from the hemiacetal function of a glucosamine and, by extension, of a lower oligosaccharide having a glucosamine at the reducing end. Graph http://purl.obolibrary.org/obo/CHEBI_24272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24273 biolink:ChemicalEntity glucosaminylamine A member of the class of glucosamines that is 2-amino-2-deoxyglucose in which the anomeric hydroxy group has been replaced by an additional amino group. Graph http://purl.obolibrary.org/obo/CHEBI_24273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24274 biolink:ChemicalEntity glucosaminylphosphodolichol A polyprenyl glycosyl phosphate consisting of a glucosaminyl residue attached to dolichol phosphate. Graph glucosaminylphosphodolichols glucosaminylphosphodolichols http://purl.obolibrary.org/obo/CHEBI_24274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24275 biolink:ChemicalEntity glucosaminylphosphatidylinositol Graph glucosaminylphosphatidylinositols glucosaminylphosphatidylinositols http://purl.obolibrary.org/obo/CHEBI_24275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24278 biolink:ChemicalEntity glucoside Graph glucosides glucosides http://purl.obolibrary.org/obo/CHEBI_24278 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24279 biolink:ChemicalEntity glucosinolate Water-soluble anionic substituted thioglucosides. Glucosinolates have a central C atom which is bonded via an S atom to a glycone group and via an N atom to a sulfonated oxime group, and which also carries a side-group. The side-chain and sulfate group have an anti stereochemical configuration across the C=N double bond. kegg.compound:C17260|pubmed:17139450|pubmed:17461791|pubmed:22405332|wikipedia.en:Glucosinolate Graph glucosinolate|glucosinolates glucosinolate|glucosinolates http://purl.obolibrary.org/obo/CHEBI_24279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24280 biolink:ChemicalEntity D-glucosyl group The glucosyl group formed from D-glucopyranose. Graph D-glucopyranosyl|D-glucopyranosyl group|glucopyranosyl group|glucosyl group D-glucopyranosyl D-glucopyranosyl|D-glucopyranosyl group|glucopyranosyl group|glucosyl group http://purl.obolibrary.org/obo/CHEBI_24280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24281 biolink:ChemicalEntity glucosyl group A glycosyl group obtained by removing the hydroxy group from the hemiacetal function of a glucose and, by extension, of a lower oligosaccharide having glucose at the reducing end. Graph glucosyl groups glucosyl groups http://purl.obolibrary.org/obo/CHEBI_24281 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24282 biolink:ChemicalEntity glucosyl hydroxycinnamic acid Graph glucosyl hydroxycinnamic acids glucosyl hydroxycinnamic acids http://purl.obolibrary.org/obo/CHEBI_24282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24286 biolink:ChemicalEntity glucosylglycerol phosphate Graph glucosylglycerol phosphates glucosylglycerol phosphates http://purl.obolibrary.org/obo/CHEBI_24286 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24287 biolink:ChemicalEntity glucosylglycerol Graph glucosylglycerols glucosylglycerols http://purl.obolibrary.org/obo/CHEBI_24287 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24289 biolink:ChemicalEntity glucosyl-N(6)-isopentenyladenine Graph glucosyl-N(6)-isopentenyladenines|glucosylisopentenyladenines glucosyl-N(6)-isopentenyladenines|glucosylisopentenyladenines http://purl.obolibrary.org/obo/CHEBI_24289 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24297 biolink:ChemicalEntity glucuronate Graph gluconuronate|glucuronate glucuronate gluconuronate|glucuronate http://purl.obolibrary.org/obo/CHEBI_24297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24298 biolink:ChemicalEntity glucuronic acid pubmed:24617284|pubmed:24879518 Graph Glucuronsaeure|Glukuronsaeure|glucuronic acid glucuronic acid Glucuronsaeure|Glukuronsaeure|glucuronic acid http://purl.obolibrary.org/obo/CHEBI_24298 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2430 biolink:ChemicalEntity aconitine A diterpenoid that is 20-ethyl-3α,13,15α-trihydroxy-1α,6α,16β-trimethoxy-4-(methoxymethyl)aconitane-8,14α-diol having acetate and benzoate groups at the 8- and 14-positions respectively. cas:302-27-2|kegg.compound:C06091|knapsack:C00001611|pubmed:12951473|pubmed:14979521|pubmed:16293382|pubmed:16315485|pubmed:16949890|pubmed:17276394|pubmed:17327465|pubmed:18329015|pubmed:18448863|pubmed:19967988|pubmed:20717872|pubmed:20886302|pubmed:20937638|pubmed:20953393|pubmed:21277363|pubmed:21377951|pubmed:21505405|pubmed:21512442|pubmed:21782880|pubmed:9459571|reaxys:74608 Graph 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate|20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate|Aconitine 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate|20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate|Aconitine http://purl.obolibrary.org/obo/CHEBI_2430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24301 biolink:ChemicalEntity glucuronolactone kegg.drug:D01800 Graph glucuronolactones glucuronolactones http://purl.obolibrary.org/obo/CHEBI_24301 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24302 biolink:ChemicalEntity glucosiduronic acid Any substance produced by linking glucuronic acid to another substance via a glycosidic bond. Graph glucosiduronic acids|glucuronide glucosiduronic acids|glucuronide http://purl.obolibrary.org/obo/CHEBI_24302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24309 biolink:ChemicalEntity glutaconic acid A pentenedioic acid that is pent-2-ene substituted by carboxy groups at positions 1 and 5. cas:1724-02-3|pubmed:21431622|pubmed:23859237|pubmed:853337|reaxys:1759560 Graph 2-Pentenedioic acid|Glutaconic acid|Pent-2-ene-1,5-dioic acid|pent-2-enedioic acid pent-2-enedioic acid 2-Pentenedioic acid|Glutaconic acid|Pent-2-ene-1,5-dioic acid|pent-2-enedioic acid http://purl.obolibrary.org/obo/CHEBI_24309 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24311 biolink:ChemicalEntity glutaconyl-CoA A 2-enoyl-CoA that is the glutaconyl derivative of CoA. Graph glutaconyl-CoAs glutaconyl-CoAs http://purl.obolibrary.org/obo/CHEBI_24311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24313 biolink:ChemicalEntity glutamic semialdehyde An aldehydic acid derived from the formal reduction of one of the carboxy groups glutamic acid to a formyl group. Graph glutamic semialdehydes glutamic semialdehydes http://purl.obolibrary.org/obo/CHEBI_24313 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24315 biolink:ChemicalEntity glutamic acid derivative An amino acid derivative resulting from reaction of glutamic acid at the amino group or either of the carboxy groups, or from the replacement of any hydrogen by a heteroatom. The definition normally excludes peptides containing glutamic acid residues. Graph http://purl.obolibrary.org/obo/CHEBI_24315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24317 biolink:ChemicalEntity L-glutamine derivative A proteinogenic amino acid derivative resulting from reaction of L-glutamine at the amino group, the carboxy group, or the carboxamide, or from the replacement of any hydrogen of L-glutamine by a heteroatom. Graph http://purl.obolibrary.org/obo/CHEBI_24317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24318 biolink:ChemicalEntity glutamine family amino acid An L-α-amino acid which is L-glutamic acid or any of the essential amino acids biosynthesised from it (glutamine, proline and arginine). A closed class. pubmed:20716061 Graph glutamine family amino acids glutamine family amino acids http://purl.obolibrary.org/obo/CHEBI_24318 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24319 biolink:ChemicalEntity EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor An EC 6.3.* (C‒N bond-forming ligase) inhibitor that interferes with the action of glutamate—ammonia ligase (EC 6.3.1.2). wikipedia.en:Glutamine_synthetase Graph EC 6.3.1.2 (glutamate--ammonia ligase) inhibitors|EC 6.3.1.2 inhibitor|EC 6.3.1.2 inhibitors|L-glutamate:ammonia ligase (ADP-forming) inhibitor|L-glutamate:ammonia ligase (ADP-forming) inhibitors|L-glutamine synthetase inhibitor|L-glutamine synthetase inhibitors|glutamate--ammonia ligase (EC 6.3.1.2) inhibitor|glutamate--ammonia ligase (EC 6.3.1.2) inhibitors|glutamate--ammonia ligase inhibitor|glutamate--ammonia ligase inhibitors|glutamine synthetase inhibitor|glutamine synthetase inhibitors|glutamylhydroxamic synthetase inhibitor|glutamylhydroxamic synthetase inhibitors EC 6.3.1.2 (glutamate--ammonia ligase) inhibitors|EC 6.3.1.2 inhibitor|EC 6.3.1.2 inhibitors|L-glutamate:ammonia ligase (ADP-forming) inhibitor|L-glutamate:ammonia ligase (ADP-forming) inhibitors|L-glutamine synthetase inhibitor|L-glutamine synthetase inhibitors|glutamate--ammonia ligase (EC 6.3.1.2) inhibitor|glutamate--ammonia ligase (EC 6.3.1.2) inhibitors|glutamate--ammonia ligase inhibitor|glutamate--ammonia ligase inhibitors|glutamine synthetase inhibitor|glutamine synthetase inhibitors|glutamylhydroxamic synthetase inhibitor|glutamylhydroxamic synthetase inhibitors http://purl.obolibrary.org/obo/CHEBI_24319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24321 biolink:ChemicalEntity glutamo group Graph (1,3-dicarboxypropyl)amino|glutamo glutamo (1,3-dicarboxypropyl)amino|glutamo http://purl.obolibrary.org/obo/CHEBI_24321 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24323 biolink:ChemicalEntity glutamyl-L-amino acid A dipeptide in which one of the amino acid residues is glutamine. Graph glutamyl-L-amino acids glutamyl-L-amino acids http://purl.obolibrary.org/obo/CHEBI_24323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24326 biolink:ChemicalEntity glutaramic acid A dicarboxylic acid monoamide that is formally derived from glutaric acid by conversion of one of the two carboxylic acid groups to the corresponding amide. cas:25335-74-4|reaxys:1759038 Graph 4-(aminocarbonyl)butanoic acid|4-carbamoylbutanoic acid|4-carbamoylbutyric acid|4-carboxybutyramide|5-amino-5-oxopentanoic acid|glutaramic acid|glutaric acid monoamide 5-amino-5-oxopentanoic acid 4-(aminocarbonyl)butanoic acid|4-carbamoylbutanoic acid|4-carbamoylbutyric acid|4-carboxybutyramide|5-amino-5-oxopentanoic acid|glutaramic acid|glutaric acid monoamide http://purl.obolibrary.org/obo/CHEBI_24326 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24329 biolink:ChemicalEntity glutarate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of glutaric acid. Graph glutarate anion|glutarates|glutaric acid anion glutarate anion|glutarates|glutaric acid anion http://purl.obolibrary.org/obo/CHEBI_24329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24333 biolink:ChemicalEntity glutaryl-CoAs Any ω-carboxyacyl-CoA in which the acyl group specified is glutaryl or its substituted derivative. Graph glutaryl-CoAs glutaryl-CoAs http://purl.obolibrary.org/obo/CHEBI_24333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24335 biolink:ChemicalEntity glutathione conjugate Any bioconjugate in which glutathione is one of the components Graph http://purl.obolibrary.org/obo/CHEBI_24335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24337 biolink:ChemicalEntity glutathione derivative Any organonitrogen compound derived from the Glu-Cys-Gly tripeptide glutathione. Graph glutathione derivatives glutathione derivatives http://purl.obolibrary.org/obo/CHEBI_24337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24344 biolink:ChemicalEntity 2-phosphoglyceric acid A monophosphoglyceric acid having the phospho group at the 2-position. drugbank:DB01709|wikipedia.en:2-Phosphoglyceric_acid Graph 3-hydroxy-2-(phosphonooxy)propanoic acid 3-hydroxy-2-(phosphonooxy)propanoic acid http://purl.obolibrary.org/obo/CHEBI_24344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24346 biolink:ChemicalEntity phosphoglyceric acid An aldonic acid phosphate where the aldonic acid component is glyceric acid. Graph glyceric acid phosphate|glyceric acid phosphates|glycerophosphate glyceric acid phosphate|glyceric acid phosphates|glycerophosphate http://purl.obolibrary.org/obo/CHEBI_24346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24347 biolink:ChemicalEntity glycerates Graph http://purl.obolibrary.org/obo/CHEBI_24347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24353 biolink:ChemicalEntity glycerol ether Any ether having glyceryl as at least one of the O-substituents. Graph http://purl.obolibrary.org/obo/CHEBI_24353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24356 biolink:ChemicalEntity glycerone phosphates Graph http://purl.obolibrary.org/obo/CHEBI_24356 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24358 biolink:ChemicalEntity glycerone derivative Graph glycerone derivatives|glycerones glycerone derivatives|glycerones http://purl.obolibrary.org/obo/CHEBI_24358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24360 biolink:ChemicalEntity glycerophosphoglycerols Graph http://purl.obolibrary.org/obo/CHEBI_24360 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24367 biolink:ChemicalEntity glycinamide ribonucleotide(2-) pdb-ccd:GAR|wikipedia.en:Glycineamide_ribonucleotide Graph N-glycyl-5-O-phosphonato-beta-D-ribofuranosylamine|glycinamide ribonucleotide N-glycyl-5-O-phosphonato-beta-D-ribofuranosylamine N-glycyl-5-O-phosphonato-beta-D-ribofuranosylamine|glycinamide ribonucleotide http://purl.obolibrary.org/obo/CHEBI_24367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24373 biolink:ChemicalEntity glycine derivative A proteinogenic amino acid derivative resulting from reaction of glycine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Graph http://purl.obolibrary.org/obo/CHEBI_24373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24384 biolink:ChemicalEntity glycogens Graph http://purl.obolibrary.org/obo/CHEBI_24384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24385 biolink:ChemicalEntity glycoglycerolipid Graph glycoglycerolipids glycoglycerolipids http://purl.obolibrary.org/obo/CHEBI_24385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24387 biolink:ChemicalEntity glycolaldehydes An aldehyde derived from a glycol by reduction of one of the hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_24387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24396 biolink:ChemicalEntity glycopeptide Any carbohydrate derivative that consists of glycan moieties covalently attached to the side chains of the amino acid residues that constitute the peptide. Graph glycopeptides glycopeptides glycopeptides http://purl.obolibrary.org/obo/CHEBI_24396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24397 biolink:ChemicalEntity glycophospholipid Any phospholipid that contain both phosphate and carbohydrate as integral structural components. Graph a glycophospholipid|glycophospholipid|glycophospholipids|phosphoglycolipids a glycophospholipid|glycophospholipid|glycophospholipids|phosphoglycolipids http://purl.obolibrary.org/obo/CHEBI_24397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24399 biolink:ChemicalEntity glycosaminyl group A glycosyl group obtained by removing the hydroxy group from the hemiacetal function of a glycosamine and, by extension, of a lower oligosaccharide having a glycosamine at the reducing end. Graph http://purl.obolibrary.org/obo/CHEBI_24399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2440 biolink:ChemicalEntity acrovestone A polyphenol that is isolated from Acronychia pedunculata and exhibits moderate antioxidant and antityrosinase activities. cas:24177-16-0|kegg.compound:C09916|knapsack:C00002978|pubmed:12880321|pubmed:22708987|pubmed:2506892|pubmed:2614422|reaxys:2611012 Graph 1-(3-{1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-methylbutyl}-2,4,6-trihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)ethan-1-one|Acrovestone 1-(3-{1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-methylbutyl}-2,4,6-trihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)ethan-1-one 1-(3-{1-[3-acetyl-2,6-dihydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-methylbutyl}-2,4,6-trihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)ethan-1-one|Acrovestone http://purl.obolibrary.org/obo/CHEBI_2440 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24400 biolink:ChemicalEntity glycoside A glycosyl compound resulting from the attachment of a glycosyl group to a non-acyl group RO‒, RS‒, RSe‒, etc. The bond between the glycosyl group and the non-acyl group is called a glycosidic bond. By extension, the terms N-glycosides and C-glycosides are used as class names for glycosylamines and for compounds having a glycosyl group attached to a hydrocarbyl group respectively. These terms are misnomers and should not be used. The preferred terms are glycosylamines and C-glycosyl compounds, respectively. Graph O-glycoside|O-glycosides|glycosides glycosides O-glycoside|O-glycosides|glycosides http://purl.obolibrary.org/obo/CHEBI_24400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24401 biolink:ChemicalEntity glycosinolate An sulfur oxoanion resulting from the deprotonation of the hydroxy group attached to the sulfur of a glycosinolic acid. Graph glycosinolate|glycosinolates glycosinolate|glycosinolates http://purl.obolibrary.org/obo/CHEBI_24401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24402 biolink:ChemicalEntity glycosphingolipid A glycosphingolipid is a glycolipid that is a carbohydrate-containing derivative of a sphingoid or ceramide. It is understood that the carbohydrate residue is attached by a glycosidic linkage to O-1 of the sphingoid. pubmed:18845618|pubmed:19303901|pubmed:26954668|pubmed:26976737|pubmed:27253729|pubmed:27325407|wikipedia.en:Glycosphingolipid Graph glycosphingolipids glycosphingolipids http://purl.obolibrary.org/obo/CHEBI_24402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24403 biolink:ChemicalEntity glycosyl group An organic group obtained by removing the hydroxy group from the hemiacetal function of a monosaccharide or monosaccharide derivative and, by extension, of a lower oligosaccharide or oligosaccharide derivative. Graph a glycosyl group|glycosyl group|glycosyl groups|groupe glycosyle glycosyl group a glycosyl group|glycosyl group|glycosyl groups|groupe glycosyle http://purl.obolibrary.org/obo/CHEBI_24403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24405 biolink:ChemicalEntity glycosylglucose Graph glycosylglucoses glycosylglucoses http://purl.obolibrary.org/obo/CHEBI_24405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24406 biolink:ChemicalEntity glycosylglycerol A glycoside resulting from the condensation of one of the hydroxy groups of glycerol with a glycosyl group. Graph glyceryl glycoside|glyceryl glycosides|glycosylglycerols glyceryl glycoside|glyceryl glycosides|glycosylglycerols http://purl.obolibrary.org/obo/CHEBI_24406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24407 biolink:ChemicalEntity glycosyl glycoside Any disaccharide in which the two monosaccharide components are connected by a glycosidic linkage between their anomeric centres. Graph glycosyl glycoside|glycosyl glycosides glycosyl glycoside|glycosyl glycosides http://purl.obolibrary.org/obo/CHEBI_24407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24410 biolink:ChemicalEntity glycosylphosphatidylinositol Graph glycophosphatidylinositols|glycosylphosphatidylinositols glycophosphatidylinositols glycophosphatidylinositols|glycosylphosphatidylinositols http://purl.obolibrary.org/obo/CHEBI_24410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24431 biolink:ChemicalEntity chemical entity A chemical entity is a physical entity of interest in chemistry including molecular entities, parts thereof, and chemical substances. Graph chemical entity chemical entity http://purl.obolibrary.org/obo/CHEBI_24431 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24432 biolink:ChemicalEntity biological role A role played by the molecular entity or part thereof within a biological context. Graph biological function biological function http://purl.obolibrary.org/obo/CHEBI_24432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24433 biolink:ChemicalEntity group A defined linked collection of atoms or a single atom within a molecular entity. Graph Gruppe|Rest|group|groupe|grupo|grupos group Gruppe|Rest|group|groupe|grupo|grupos http://purl.obolibrary.org/obo/CHEBI_24433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24436 biolink:ChemicalEntity guanidines Any organonitrogen compound containing a carbamimidamido (guanidino) group. Guanidines have the general structure (R1R2N)(R3R4N)C=N-R5 and are related structurally to amidines and ureas. Graph http://purl.obolibrary.org/obo/CHEBI_24436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24439 biolink:ChemicalEntity guanidinoacetic acids Graph guanidinoacetates guanidinoacetates http://purl.obolibrary.org/obo/CHEBI_24439 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:244418 biolink:ChemicalEntity dehydrocostus lactone An organic heterotricyclic compound and guaianolide sesquiterpene lactone that is acrylic acid which is substituted at position 2 by a 4-hydroxy-3,8-bis(methylene)decahydoazulen-5-yl group and in which the hydroxy group and the carboxy group have undergone formal condensation to afford the corresponding γ-lactone. cas:477-43-0|kegg.compound:C09387|knapsack:C00003245|patent:CN102058579|pubmed:10193198|pubmed:12419922|pubmed:14192430|pubmed:15209353|pubmed:15881118|pubmed:17391667|pubmed:19148545|pubmed:19188481|pubmed:19457452|pubmed:19700217|pubmed:21353686|pubmed:21472220|pubmed:21596031|pubmed:22359572|pubmed:23047249|pubmed:6476889|pubmed:8541643|pubmed:9784148|pubmed:9917276|reaxys:4733740 Graph (-)-dehydrocostus lactone|(-)-dehydrocostuslactone|(3aR,6aS,9aS,9bR)-3,6,9-tris(methylene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione|(3aR,6aS,9aS,9bR)-3,6,9-tris(methylidene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione|(3aS,6aR,9aR,9bS)-decahydro-3,6,9-tris(methylene)azuleno[4,5-b]furan-2(3H)-one|dehydrocostuslactone (3aR,6aS,9aS,9bR)-3,6,9-tris(methylene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione|(3aR,6aS,9aS,9bR)-3,6,9-tris(methylidene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione (-)-dehydrocostus lactone|(-)-dehydrocostuslactone|(3aR,6aS,9aS,9bR)-3,6,9-tris(methylene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione|(3aR,6aS,9aS,9bR)-3,6,9-tris(methylidene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione|(3aS,6aR,9aR,9bS)-decahydro-3,6,9-tris(methylene)azuleno[4,5-b]furan-2(3H)-one|dehydrocostuslactone http://purl.obolibrary.org/obo/CHEBI_244418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24442 biolink:ChemicalEntity guanidinoethyl methyl phosphates Graph http://purl.obolibrary.org/obo/CHEBI_24442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24455 biolink:ChemicalEntity guanosine phosphate Graph guanosine phosphates guanosine phosphates http://purl.obolibrary.org/obo/CHEBI_24455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24458 biolink:ChemicalEntity guanosines Any purine ribonucleoside that is a derivative of guanosine. Graph http://purl.obolibrary.org/obo/CHEBI_24458 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24461 biolink:ChemicalEntity gulonate Graph http://purl.obolibrary.org/obo/CHEBI_24461 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24462 biolink:ChemicalEntity gulonic acid A hexonic acid formed by oxidising the aldehyde group of gulose to a carboxylic acid group. pubmed:19768707 Graph http://purl.obolibrary.org/obo/CHEBI_24462 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24469 biolink:ChemicalEntity haloalkane A halohydrocarbon that is an alkane in which at least one hydrogen atom has been replaced by with a halogen atom. Graph alkyl halide|alkyl halides|haloalkanes alkyl halide|alkyl halides|haloalkanes http://purl.obolibrary.org/obo/CHEBI_24469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24470 biolink:ChemicalEntity haloamino acid Any non-proteinogenic amino acid carrying at least one halo group. Graph haloamino acids haloamino acids http://purl.obolibrary.org/obo/CHEBI_24470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24471 biolink:ChemicalEntity halogen molecular entity Graph halogen compounds|halogen molecular entities|halogen molecular entity halogen compounds|halogen molecular entities|halogen molecular entity http://purl.obolibrary.org/obo/CHEBI_24471 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24472 biolink:ChemicalEntity halohydrocarbon A compound derived from a hydrocarbon by replacing a hydrogen atom with a halogen atom. Graph halogenated hydrocarbons|halohydrocarbons halogenated hydrocarbons|halohydrocarbons http://purl.obolibrary.org/obo/CHEBI_24472 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24473 biolink:ChemicalEntity halogen Graph Halogene|group 17 elements|group VII elements|halogen|halogene|halogenes|halogeno|halogenos|halogens halogen|halogens Halogene|group 17 elements|group VII elements|halogen|halogene|halogenes|halogeno|halogenos|halogens http://purl.obolibrary.org/obo/CHEBI_24473 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24479 biolink:ChemicalEntity heme a cas:18535-39-2|pdb-ccd:HEA Graph (cytoporphyrinato)iron|HEME-A|heme a heme a (cytoporphyrinato)iron|HEME-A|heme a http://purl.obolibrary.org/obo/CHEBI_24479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2448 biolink:ChemicalEntity actinorhodin A member of the class of benzoisochromanequinone that is produced by Streptomyces coelicolor A3(2) and exhibits antibiotic activity. beilstein:76401|cas:1397-77-9|kegg.compound:C06691|metacyc.compound:CPD1A0-6123|pdb-ccd:ZCT|pubmed:15054568|pubmed:17579485|pubmed:18207163|pubmed:24240146|pubmed:24963940|pubmed:521794|reaxys:22788170|wikipedia.en:Actinorhodin Graph 2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-[8,8'-bibenzo[g]isochromene]-3,3'-diyl]diacetic acid|2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-[8,8'-binaphtho[2,3-c]pyran]-3,3'-diyl]diacetic acid|Actinorhodin|Actinorhodine 2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-[8,8'-bibenzo[g]isochromene]-3,3'-diyl]diacetic acid 2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-[8,8'-bibenzo[g]isochromene]-3,3'-diyl]diacetic acid|2,2'-[(1R,1'R,3S,3'S)-6,6',9,9'-tetrahydroxy-1,1'-dimethyl-5,5',10,10'-tetraoxo-3,3',4,4',5,5',10,10'-octahydro-1H,1'H-[8,8'-binaphtho[2,3-c]pyran]-3,3'-diyl]diacetic acid|Actinorhodin|Actinorhodine http://purl.obolibrary.org/obo/CHEBI_2448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24480 biolink:ChemicalEntity heme o cas:137397-56-9|kegg.compound:C15672 Graph heme O|heme o heme O|heme o http://purl.obolibrary.org/obo/CHEBI_24480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24495 biolink:ChemicalEntity heparan alpha-D-glucosaminide Graph heparan alpha-D-glucosaminide|heparan alpha-D-glucosaminides heparan alpha-D-glucosaminide|heparan alpha-D-glucosaminides http://purl.obolibrary.org/obo/CHEBI_24495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24499 biolink:ChemicalEntity heparan sulfate proteoglycan A proteoglycan whose glycosaminoglycan units are heparan sulfate. pmc:PMC11710292|pubmed:21690215|pubmed:29434536|pubmed:30027065|pubmed:30500378|pubmed:31883440|pubmed:36068128|pubmed:36551220|pubmed:36900315|pubmed:37590610|pubmed:37977559|pubmed:38270052|pubmed:38618194|pubmed:38639475|pubmed:39668564|pubmed:39805508|pubmed:39845083|pubmed:39891300|pubmed:39969206|pubmed:8781318|pubmed:8842489 Graph HSPG|HSPGs|heparan sulfate proteoglycan|heparan sulfate proteoglycans HSPG|HSPGs|heparan sulfate proteoglycan|heparan sulfate proteoglycans http://purl.obolibrary.org/obo/CHEBI_24499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2450 biolink:ChemicalEntity aculeacin A A lipopeptide that is isolated from Aspergillus aculeatus and exhibits antifungal activity. cas:58814-86-1|kegg.compound:C01776|knapsack:C00016077|metacyc.compound:CPD-13365|pubmed:324959|pubmed:324960|pubmed:3325782|pubmed:7042670|pubmed:7042671|pubmed:7425782|reaxys:26317172 Graph Aculeacin A|Aculeacins|aculeacin A Aculeacin A|Aculeacins|aculeacin A http://purl.obolibrary.org/obo/CHEBI_2450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24500 biolink:ChemicalEntity heparan Graph heparans heparans http://purl.obolibrary.org/obo/CHEBI_24500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24505 biolink:ChemicalEntity heparins Graph http://purl.obolibrary.org/obo/CHEBI_24505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24521 biolink:ChemicalEntity heptenedioate Graph heptenedioates heptenedioates http://purl.obolibrary.org/obo/CHEBI_24521 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24522 biolink:ChemicalEntity heptenedioic acid A dicarboxylic acid that is heptene carrying two carboxy groups. Graph heptenedioic acids heptenedioic acids http://purl.obolibrary.org/obo/CHEBI_24522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24523 biolink:ChemicalEntity heptenone Any ketone that ia heptane substituted by an oxo group at unspecified position. Graph http://purl.obolibrary.org/obo/CHEBI_24523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24527 biolink:ChemicalEntity herbicide A substance used to destroy plant pests. wikipedia.en:Herbicide Graph Herbizid|Unkrautbekaempfungsmittel|Unkrautvertilgungsmittel|Wildkrautbekaempfungsmittel|herbicides Herbizid|Unkrautbekaempfungsmittel|Unkrautvertilgungsmittel|Wildkrautbekaempfungsmittel|herbicides http://purl.obolibrary.org/obo/CHEBI_24527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2453 biolink:ChemicalEntity acyclovir An oxopurine that is guanine substituted by a (2-hydroxyethoxy)methyl substituent at position 9. Used in the treatment of viral infections. cas:59277-89-3|drugbank:DB00787|drugcentral:85|hmdb:HMDB0014925|kegg.compound:C06810|kegg.drug:D00222|lincs.smallmolecule:LSM-5459|patent:DE2539963|patent:US4199574|pdb-ccd:AC2|pubmed:11687127|pubmed:11994034|pubmed:24346595|pubmed:26024233|pubmed:28166217|pubmed:8308511|reaxys:1219402|wikipedia.en:Acyclovir Graph 2-amino-9-[(2-hydroxyethoxy)methyl]-1,9-dihydro-6H-purin-6-one|Zovir|aciclovir|aciclovirum|acycloguanosine|acyclovir 2-amino-9-[(2-hydroxyethoxy)methyl]-1,9-dihydro-6H-purin-6-one 2-amino-9-[(2-hydroxyethoxy)methyl]-1,9-dihydro-6H-purin-6-one|Zovir|aciclovir|aciclovirum|acycloguanosine|acyclovir http://purl.obolibrary.org/obo/CHEBI_2453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24531 biolink:ChemicalEntity heterocyclic antibiotic Graph heterocyclic antibiotics heterocyclic antibiotics http://purl.obolibrary.org/obo/CHEBI_24531 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24532 biolink:ChemicalEntity organic heterocyclic compound A cyclic compound having as ring members atoms of carbon and at least of one other element. Graph organic heterocycle|organic heterocyclic compounds organic heterocycle|organic heterocyclic compounds http://purl.obolibrary.org/obo/CHEBI_24532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24533 biolink:ChemicalEntity heterodetic cyclic peptide A heterodetic cyclic peptide is a peptide consisting only of amino-acid residues, but in which the linkages forming the ring are not solely peptide bonds; one or more is an isopeptide, disulfide, ester, or other bond. Graph heterodetic cyclic peptide|heterodetic cyclic peptides|peptide cyclique heterodetique|peptido ciclico heterodetico heterodetic cyclic peptide heterodetic cyclic peptide|heterodetic cyclic peptides|peptide cyclique heterodetique|peptido ciclico heterodetico http://purl.obolibrary.org/obo/CHEBI_24533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24536 biolink:ChemicalEntity hexachlorocyclohexane beilstein:1907331|cas:608-73-1|gmelin:261134|kegg.compound:C18738|pubmed:31394347|pubmed:32827819 Graph 1,2,3,4,5,6-Hexachlorocyclohexane|1,2,3,4,5,6-hexachlorocyclohexane|BHC|HCH|Hexachlorcyclohexan|Hexachlorzyklohexan|benzene hexachloride|hexachlorocyclohexane|hexachlorocyclohexanes 1,2,3,4,5,6-hexachlorocyclohexane 1,2,3,4,5,6-Hexachlorocyclohexane|1,2,3,4,5,6-hexachlorocyclohexane|BHC|HCH|Hexachlorcyclohexan|Hexachlorzyklohexan|benzene hexachloride|hexachlorocyclohexane|hexachlorocyclohexanes http://purl.obolibrary.org/obo/CHEBI_24536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24545 biolink:ChemicalEntity hexadecatrienoic acid Any trienoic fatty acid having sixteen carbons. Graph 16:3|C16:3|hexadecatrienoic acids 16:3|C16:3|hexadecatrienoic acids http://purl.obolibrary.org/obo/CHEBI_24545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24547 biolink:ChemicalEntity hexadecenal A monounsaturated fatty acid aldehyde that is hexadecanal which has undergone formal dehydrogenation to introduce a double bond at unspecified position. Graph hexadecenals hexadecenals http://purl.obolibrary.org/obo/CHEBI_24547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24548 biolink:ChemicalEntity hexadecenoic acid A C16 straight-chain monounsaturated fatty acid having one C=C double bond. pubmed:17439666 Graph 16:1|C16:1|FA 16:1|Hexadecensaeure|Hexadecensaeuren|acide hexadecenoique|acides hexadecenoiques|acido hexadecenoico|acidos hexadecenoicos|hexadecenoic acid|hexadecenoic acid 16:1 hexadecenoic acid 16:1|C16:1|FA 16:1|Hexadecensaeure|Hexadecensaeuren|acide hexadecenoique|acides hexadecenoiques|acido hexadecenoico|acidos hexadecenoicos|hexadecenoic acid|hexadecenoic acid 16:1 http://purl.obolibrary.org/obo/CHEBI_24548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24549 biolink:ChemicalEntity hexadecenoyl-CoA A monounsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any hexadecenoic acid. pubmed:1278159 Graph 16:1-CoA|C16:1-CoA|hexadecenoyl-CoAs|hexadecenoyl-coenzyme A|hexadecenoyl-coenzyme As 16:1-CoA|C16:1-CoA|hexadecenoyl-CoAs|hexadecenoyl-coenzyme A|hexadecenoyl-coenzyme As http://purl.obolibrary.org/obo/CHEBI_24549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24551 biolink:ChemicalEntity hexadienal An enal that is hexadiene carrying an oxo group at position 1. Graph hexadienals hexadienals http://purl.obolibrary.org/obo/CHEBI_24551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24552 biolink:ChemicalEntity hexadienedioate Graph hexadienedioates hexadienedioates http://purl.obolibrary.org/obo/CHEBI_24552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24553 biolink:ChemicalEntity hexadienedioic acid Graph hexadienedioic acids hexadienedioic acids http://purl.obolibrary.org/obo/CHEBI_24553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24554 biolink:ChemicalEntity hexadienoate Graph hexadienoates hexadienoates http://purl.obolibrary.org/obo/CHEBI_24554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24555 biolink:ChemicalEntity hexadienoic acid Graph hexadienoic acid hexadienoic acid hexadienoic acid http://purl.obolibrary.org/obo/CHEBI_24555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24561 biolink:ChemicalEntity hexahydroxyflavone Members of the class of hydroxyflavone that is flavone substituted by 6 hydroxy groups. Graph hexahydroxyflavones hexahydroxyflavones http://purl.obolibrary.org/obo/CHEBI_24561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24564 biolink:ChemicalEntity hexamethylmelamine beilstein:195058|cas:645-05-6|drugcentral:141|gmelin:603940|lincs.smallmolecule:LSM-3492|patent:DE1240870|patent:US3424752|wikipedia.en:Altretamine Graph 2,4,6-tris(dimethylamino)-1,3,5-triazine|2,4,6-tris(dimethylamino)-s-triazine|HMM|Hexalen|Hexastat|N,N,N',N',N'',N''-hexamethyl-1,3,5-triazine-2,4,6-triamine|altretamina|altretamine|altretaminum N,N,N',N',N'',N''-hexamethyl-1,3,5-triazine-2,4,6-triamine 2,4,6-tris(dimethylamino)-1,3,5-triazine|2,4,6-tris(dimethylamino)-s-triazine|HMM|Hexalen|Hexastat|N,N,N',N',N'',N''-hexamethyl-1,3,5-triazine-2,4,6-triamine|altretamina|altretamine|altretaminum http://purl.obolibrary.org/obo/CHEBI_24564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24567 biolink:ChemicalEntity cyclohexane-1,2-diol A diol that consists of a cyclohexane skeleton carrying two hydroxy substituents. cas:931-17-9|reaxys:2036627|wikipedia.en:Cyclohexane-1,2-diol Graph 1,2-Cyclohexanediol|2-Hydroxycyclohexanol 1,2-Cyclohexanediol|2-Hydroxycyclohexanol http://purl.obolibrary.org/obo/CHEBI_24567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24573 biolink:ChemicalEntity hexanone A ketone that is a hexane carrying an oxo substituent at unspecified position. Graph hexanones hexanones http://purl.obolibrary.org/obo/CHEBI_24573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24576 biolink:ChemicalEntity hexaric acid anion Graph hexarate|hexarates|hexaric acid anions hexarate|hexarates|hexaric acid anions http://purl.obolibrary.org/obo/CHEBI_24576 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24577 biolink:ChemicalEntity hexaric acid Graph hexaric acid|hexaric acids hexaric acid|hexaric acids http://purl.obolibrary.org/obo/CHEBI_24577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24578 biolink:ChemicalEntity hexenal A monounsaturated fatty acid aldehyde that is hexene having an oxo group at position 1. Graph http://purl.obolibrary.org/obo/CHEBI_24578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24580 biolink:ChemicalEntity hexenoic acid A C6, medium-chain fatty acid carrying a double bond at any position along the main chain. Graph hexenoic acid|hexenoic acids hexenoic acid hexenoic acid|hexenoic acids http://purl.obolibrary.org/obo/CHEBI_24580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24582 biolink:ChemicalEntity hexitol phosphate Graph hexitol phosphate|hexitol phosphates hexitol phosphate|hexitol phosphates http://purl.obolibrary.org/obo/CHEBI_24582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24583 biolink:ChemicalEntity hexitol Graph hexitol|hexitols hexitol|hexitols http://purl.obolibrary.org/obo/CHEBI_24583 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24584 biolink:ChemicalEntity hexosamine phosphate Graph hexosamine phosphate|hexosamine phosphates hexosamine phosphate|hexosamine phosphates http://purl.obolibrary.org/obo/CHEBI_24584 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24585 biolink:ChemicalEntity hexosamine sulfate Graph hexosamine sulfates hexosamine sulfates http://purl.obolibrary.org/obo/CHEBI_24585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24586 biolink:ChemicalEntity hexosamine Any 6-carbon amino monosaccharide with at least one alcoholic hydroxy group replaced by an amino group. Graph hexosamine|hexosamines hexosamine|hexosamines http://purl.obolibrary.org/obo/CHEBI_24586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24587 biolink:ChemicalEntity hexosaminide Graph hexosaminide|hexosaminides hexosaminide|hexosaminides http://purl.obolibrary.org/obo/CHEBI_24587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24588 biolink:ChemicalEntity hexose 1-phosphate Graph hexose 1-phosphates hexose 1-phosphates http://purl.obolibrary.org/obo/CHEBI_24588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24589 biolink:ChemicalEntity monosaccharide sulfate Any carbohydrate sulfate that is a monosaccharide carrying at least one O-sulfo substituent. Graph monosaccharide sulfates monosaccharide sulfates http://purl.obolibrary.org/obo/CHEBI_24589 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24591 biolink:ChemicalEntity hexuronate A uronate obtained via deprotonation of the carboxy group of any hexuronic acid. Graph hexuronate|hexuronates|hexuronide|hexuronides hexuronate|hexuronates|hexuronide|hexuronides http://purl.obolibrary.org/obo/CHEBI_24591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24592 biolink:ChemicalEntity hexuronic acid Graph hexuronic acid|hexuronic acids hexuronic acid|hexuronic acids http://purl.obolibrary.org/obo/CHEBI_24592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24599 biolink:ChemicalEntity histidine derivative An amino acid derivative resulting from reaction of histidine at the amino group or the carboxy group, or from the replacement of any hydrogen of histidine by a heteroatom. The definition normally excludes peptides containing alanine residues. Graph histidine derivatives histidine derivatives http://purl.obolibrary.org/obo/CHEBI_24599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24606 biolink:ChemicalEntity homoarginine Graph homoarginines homoarginines http://purl.obolibrary.org/obo/CHEBI_24606 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24610 biolink:ChemicalEntity homocysteines kegg.compound:C05330 Graph homocysteines homocysteines http://purl.obolibrary.org/obo/CHEBI_24610 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24612 biolink:ChemicalEntity homocystines A non-proteinogenic α-amino acid obtained by oxidative dimerisation of homocysteine and its derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_24612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24613 biolink:ChemicalEntity homodetic cyclic peptide A homodetic cyclic peptide is a cyclic peptide in which the ring consists solely of amino-acid residues in peptide linkages. Graph homodetic cyclic peptide|homodetic cyclic peptides|peptide cyclique homodetique|peptido ciclico homodetico homodetic cyclic peptide homodetic cyclic peptide|homodetic cyclic peptides|peptide cyclique homodetique|peptido ciclico homodetico http://purl.obolibrary.org/obo/CHEBI_24613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24619 biolink:ChemicalEntity homoserine derivative Graph homoserine derivatives|homoserines homoserine derivatives|homoserines http://purl.obolibrary.org/obo/CHEBI_24619 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24621 biolink:ChemicalEntity hormone Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds. Graph endocrine|hormones endocrine|hormones http://purl.obolibrary.org/obo/CHEBI_24621 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24628 biolink:ChemicalEntity imidazolidine-2,4-dione An imidazolidinone with oxo groups at position 2 and 4. Graph http://purl.obolibrary.org/obo/CHEBI_24628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24631 biolink:ChemicalEntity hydrazines Hydrazine (diazane) and its substituted derivatives. Graph hydrazines hydrazines hydrazines http://purl.obolibrary.org/obo/CHEBI_24631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24632 biolink:ChemicalEntity hydrocarbon A compound consisting of carbon and hydrogen only. Graph Kohlenwasserstoff|Kohlenwasserstoffe|hidrocarburo|hidrocarburos|hydrocarbon|hydrocarbons|hydrocarbure hydrocarbon|hydrocarbons Kohlenwasserstoff|Kohlenwasserstoffe|hidrocarburo|hidrocarburos|hydrocarbon|hydrocarbons|hydrocarbure http://purl.obolibrary.org/obo/CHEBI_24632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24636 biolink:ChemicalEntity proton Nuclear particle of charge number +1, spin ½ and rest mass of 1.007276470(12) u. cas:12408-02-5|kegg.compound:C00080 Graph (1)1H(+)|(1)H(+)|p|p(+)|protium(1+)|proton protium(1+)|proton (1)1H(+)|(1)H(+)|p|p(+)|protium(1+)|proton http://purl.obolibrary.org/obo/CHEBI_24636 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:246422 biolink:ChemicalEntity dUMP(2-) A 2'-deoxyribonucleoside 5'-monophosphate(2−) obtained by deprotonation of the phosphate OH groups of 2'-deoxyuridine 5'-monophosphate (dUMP); major species at pH 7.3. beilstein:4011255|gmelin:338416 Graph 2'-deoxy-5'-O-phosphonatouridine|dUMP|dUMP dianion|deoxyuridine 5'-phosphate dianion|deoxyuridine 5'-phosphate(2-)|deoxyuridylate 2'-deoxy-5'-O-phosphonatouridine 2'-deoxy-5'-O-phosphonatouridine|dUMP|dUMP dianion|deoxyuridine 5'-phosphate dianion|deoxyuridine 5'-phosphate(2-)|deoxyuridylate http://purl.obolibrary.org/obo/CHEBI_246422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24644 biolink:ChemicalEntity HPETE Mono-hydroperoxy (e)icosatetraenoic acids (HPETEs) are the primary products of lipoxygenase-catalysed oxygenation of arachidonic acid. Graph HPETEs|Mono-hydroperoxy icosatetraenoic acids HPETEs|Mono-hydroperoxy icosatetraenoic acids http://purl.obolibrary.org/obo/CHEBI_24644 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24646 biolink:ChemicalEntity hydroquinones Benzenediols that have the hydroxy substituents in the 1- and 4-positions. Graph 1,4-benzoquinols|a 1,4-benzoquinol|a quinol|benzene-1,4-diols 1,4-benzoquinols|a 1,4-benzoquinol|a quinol|benzene-1,4-diols http://purl.obolibrary.org/obo/CHEBI_24646 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24648 biolink:ChemicalEntity hydroxamic acid anion An oxoanion resulting from the removal of a proton from the hydroxy group of any hydroxamic acid. Graph hydroxamate|hydroxamates|hydroxamic acid anions|hydroxamic anion|hydroxamic anions hydroxamate|hydroxamates|hydroxamic acid anions|hydroxamic anion|hydroxamic anions http://purl.obolibrary.org/obo/CHEBI_24648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24650 biolink:ChemicalEntity hydroxamic acid A compound, RkE(=O)lNHOH, derived from an oxoacid RkE(=O)l(OH) (l ≠ 0) by replacing ‒OH with ‒NHOH, and derivatives thereof. Specific examples of hydroxamic acids are preferably named as N-hydroxy amides. Graph N-hydroxy amide|N-hydroxy amides|N-hydroxy-amide|N-hydroxy-amides|N-hydroxyamide|N-hydroxyamides|hydroxamic acids hydroxamic acids N-hydroxy amide|N-hydroxy amides|N-hydroxy-amide|N-hydroxy-amides|N-hydroxyamide|N-hydroxyamides|hydroxamic acids http://purl.obolibrary.org/obo/CHEBI_24650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24651 biolink:ChemicalEntity hydroxides Hydroxides are chemical compounds containing a hydroxy group or salts containing hydroxide (OH−). Graph http://purl.obolibrary.org/obo/CHEBI_24651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24654 biolink:ChemicalEntity hydroxy fatty acid Any fatty acid carrying one or more hydroxy substituents. lipidmaps_class:LMFA0105|pubmed:18296335|pubmed:6419288|pubmed:8274032 Graph hydroxy fatty acids hydroxy fatty acids http://purl.obolibrary.org/obo/CHEBI_24654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24658 biolink:ChemicalEntity hydroxy-L-arginine A hydroxy-amino acid that is L-arginine substituted by at least one hydroxy group. Graph http://purl.obolibrary.org/obo/CHEBI_24658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24659 biolink:ChemicalEntity hydroxy-L-glutamic acid A hydroxy-amino acid that is L-glutamic acid substituted by at least one hydroxy group. Graph http://purl.obolibrary.org/obo/CHEBI_24659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24661 biolink:ChemicalEntity hydroxy-L-lysine A hydroxy-amino acid that is L-lysine substituted by hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_24661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24662 biolink:ChemicalEntity hydroxy-amino acid A non-proteinogenic α-amino acid bearing one or more hydroxy groups at unspecified positions. Graph http://purl.obolibrary.org/obo/CHEBI_24662 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24663 biolink:ChemicalEntity hydroxy-5beta-cholanic acid Any member of the class of 5β-cholanic acids carrying at least one hydroxy group at unspecified position. Graph hydroxy-5beta-cholanic acids hydroxy-5beta-cholanic acids http://purl.obolibrary.org/obo/CHEBI_24663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24668 biolink:ChemicalEntity hydroxyacetophenone Any member of the class of acetophenones carrying at least one hydroxy substituent. Graph hydroxyacetophenones hydroxyacetophenones http://purl.obolibrary.org/obo/CHEBI_24668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24669 biolink:ChemicalEntity hydroxy carboxylic acid Any carboxylic acid with at least one hydroxy group. Graph hydroxy carboxylic acids|hydroxycarboxylic acid|hydroxycarboxylic acids hydroxy carboxylic acids|hydroxycarboxylic acid|hydroxycarboxylic acids http://purl.obolibrary.org/obo/CHEBI_24669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24673 biolink:ChemicalEntity hydroxybenzaldehyde cas:28777-87-9 Graph formylphenol|hydroxybenzaldehyde hydroxybenzaldehyde formylphenol|hydroxybenzaldehyde http://purl.obolibrary.org/obo/CHEBI_24673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24675 biolink:ChemicalEntity hydroxybenzoate Any benzoate derivative carrying a single carboxylate group and at least one hydroxy substituent. Graph hydroxybenzoates hydroxybenzoates http://purl.obolibrary.org/obo/CHEBI_24675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24676 biolink:ChemicalEntity hydroxybenzoic acid Any benzoic acid carrying one or more phenolic hydroxy groups on the benzene ring. Graph hydroxybenzoic acids hydroxybenzoic acids http://purl.obolibrary.org/obo/CHEBI_24676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24677 biolink:ChemicalEntity hydroxybenzophenone Any benzophenone into which is substituted one or more hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_24677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24678 biolink:ChemicalEntity hydroxybenzoyl-CoA Any member of the class of benzoyl-CoAs having hydroxybenzoyl as the aroyl substituent. Graph hydroxybenzoyl-CoAs hydroxybenzoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_24678 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24679 biolink:ChemicalEntity hydroxybenzyl alcohol Any member of the class of benzyl alcohols that is a benzyl alcohol substituted by at least one hydroxy group on the benzene ring. Graph hydroxybenzyl alcohols hydroxybenzyl alcohols http://purl.obolibrary.org/obo/CHEBI_24679 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2468 biolink:ChemicalEntity secondary alpha-hydroxy ketone An α-hydroxy ketone in which the carbonyl group and the hydroxy group are linked by a carbon bearing one hydrogen and one organyl group. Secondary α-hydroxy ketones are also known as acyloins, and are formally derived from reductive coupling of two carboxylic acid groups. wikipedia.en:Acyloin Graph acyloin|acyloins|secondary alpha-hydroxy ketones|secondary alpha-hydroxy-ketone|secondary alpha-hydroxy-ketones|secondary alpha-hydroxyketone|secondary alpha-hydroxyketones acyloin|acyloins|secondary alpha-hydroxy ketones|secondary alpha-hydroxy-ketone|secondary alpha-hydroxy-ketones|secondary alpha-hydroxyketone|secondary alpha-hydroxyketones http://purl.obolibrary.org/obo/CHEBI_2468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24681 biolink:ChemicalEntity hydroxybiphenyls Any member of the class of biphenyls that has one or more hydroxy groups attached to the benzenoid ring system. Graph hydroxybiphenyls hydroxybiphenyls http://purl.obolibrary.org/obo/CHEBI_24681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24684 biolink:ChemicalEntity hydroxybutyric acid Any compound comprising a butyric acid core carrying at least one hydroxy substituent. Graph hydroxybutanoic acid|hydroxybutanoic acids|hydroxybutyric acids hydroxybutanoic acid hydroxybutanoic acid|hydroxybutanoic acids|hydroxybutyric acids http://purl.obolibrary.org/obo/CHEBI_24684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24685 biolink:ChemicalEntity hydroxybutanoyl-CoA Any member of the class of butanoyl-CoAs having hydroxybutanoyl as the acyl substituent. Graph hydroxybutanoyl-CoAs hydroxybutanoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_24685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24688 biolink:ChemicalEntity monohydroxycinnamic acid Graph monohydroxycinnamic acids monohydroxycinnamic acids http://purl.obolibrary.org/obo/CHEBI_24688 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24689 biolink:ChemicalEntity hydroxycinnamic acid Any member of the class of cinnamic acids carrying one or more hydroxy substituents. Graph hydroxycinnamic acids hydroxycinnamic acids http://purl.obolibrary.org/obo/CHEBI_24689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2469 biolink:ChemicalEntity adefovir A member of the class of phosphonic acids that is methylphosphonic acid in which one of the methyl hydrogens has been replaced by a 2-(6-amino-9H-purin-9-yl)ethoxy group. An inhibitor of HIV-1 reverse transcriptase, the bis(t-butoxycarbonyloxymethyl) ester (dipivoxil ester) prodrug is used to treat chronic hepatitis B viral infection. cas:106941-25-7|drugbank:DB00718|kegg.compound:C11277|kegg.drug:D02768|pdb-ccd:5HG|pubmed:10676990|pubmed:11796353|pubmed:14647052|pubmed:14978283|pubmed:15866657|pubmed:22976988|pubmed:24338503|pubmed:27079793|pubmed:27381944|pubmed:27649318|pubmed:27664568|pubmed:27698751|pubmed:27729626|pubmed:27746441|pubmed:27806120|pubmed:27858892|pubmed:27880997|pubmed:27977591|pubmed:28011962|pubmed:28079295|pubmed:28081595|pubmed:28123560|pubmed:28322924|pubmed:28397817|pubmed:28436380|reaxys:3561094|wikipedia.en:Adefovir Graph 9-(2-(Phosphonomethoxy)ethyl)adenine|9-(2-Phosphonylmethoxyethyl)adenine|Adefovir|DRG-0156|GS 0393|GS 393|GS-0393|HSDB 8079|N-(2-Phosphonylmethoxyethyl)adenine|PMEA|{[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonic acid {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonic acid 9-(2-(Phosphonomethoxy)ethyl)adenine|9-(2-Phosphonylmethoxyethyl)adenine|Adefovir|DRG-0156|GS 0393|GS 393|GS-0393|HSDB 8079|N-(2-Phosphonylmethoxyethyl)adenine|PMEA|{[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonic acid http://purl.obolibrary.org/obo/CHEBI_2469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24693 biolink:ChemicalEntity hydroxycyclohexanone Any member of the class of cyclohexanones carrying one or more hydroxy substituents. Graph http://purl.obolibrary.org/obo/CHEBI_24693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24697 biolink:ChemicalEntity hydroxyflavanone A member of the class of flavanones that consists of flavanone with one or more hydroxy substituents. Graph hydroxyflavanone|hydroxyflavanones hydroxyflavanone|hydroxyflavanones http://purl.obolibrary.org/obo/CHEBI_24697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24698 biolink:ChemicalEntity hydroxyflavone Any flavone in which one or more ring hydrogens are replaced by hydroxy groups. Graph hydroxyflavones hydroxyflavones http://purl.obolibrary.org/obo/CHEBI_24698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24709 biolink:ChemicalEntity hydroxylamines Hydroxylamine, H2N‒OH, and its hydrocarbyl derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_24709 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24711 biolink:ChemicalEntity hydroxymalonate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of hydroxymalonic acid. Graph hydroxymalonate anion|hydroxymalonic acid anion|tartronate hydroxymalonate anion|hydroxymalonic acid anion|tartronate http://purl.obolibrary.org/obo/CHEBI_24711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24712 biolink:ChemicalEntity hydroxymethyl group Graph -CH2-OH|hydroxymethyl|serine side-chain hydroxymethyl -CH2-OH|hydroxymethyl|serine side-chain http://purl.obolibrary.org/obo/CHEBI_24712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24727 biolink:ChemicalEntity hydroxynaphthalene Any member of the class of naphthalenes that is naphthalene carrying one or more hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_24727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24729 biolink:ChemicalEntity 6-hydroxynicotine beilstein:880718 Graph 5-(1-methylpyrrolidin-2-yl)pyridin-2-ol 5-(1-methylpyrrolidin-2-yl)pyridin-2-ol 5-(1-methylpyrrolidin-2-yl)pyridin-2-ol http://purl.obolibrary.org/obo/CHEBI_24729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24730 biolink:ChemicalEntity hydroxynitrile Any nitrile compound which also contains a hydroxy group. Graph http://purl.obolibrary.org/obo/CHEBI_24730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24731 biolink:ChemicalEntity hydroxyphenylacetaldehyde oxime An aldoxime that is acetaldehyde oxime in which one of the methyl hydrogens has been replaced by a hydroxyphenyl group. Graph hydroxyphenylacetaldehyde oximes hydroxyphenylacetaldehyde oximes http://purl.obolibrary.org/obo/CHEBI_24731 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24734 biolink:ChemicalEntity hydroxyphenylalanine Graph hydroxyphenylalanines hydroxyphenylalanines http://purl.obolibrary.org/obo/CHEBI_24734 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24741 biolink:ChemicalEntity hydroxyproline A proline derivative that is proline substituted by at least one hydroxy group. Graph hydroxyprolines hydroxyprolines http://purl.obolibrary.org/obo/CHEBI_24741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24744 biolink:ChemicalEntity 2-hydroxypropyl-CoM Graph 2-[(2-hydroxypropyl)sulfanyl]ethanesulfonic acid 2-[(2-hydroxypropyl)sulfanyl]ethanesulfonic acid 2-[(2-hydroxypropyl)sulfanyl]ethanesulfonic acid http://purl.obolibrary.org/obo/CHEBI_24744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24745 biolink:ChemicalEntity hydroxypyridine Any member of the class of pyridines with at least one hydroxy substituent. Graph hydroxypyridines hydroxypyridines http://purl.obolibrary.org/obo/CHEBI_24745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24747 biolink:ChemicalEntity hydroxyoctadecanoic acid A hydroxy fatty acid that is ocatadecanoic acid (stearic acid) in which the aliphatic chain has been substituted by one or more hydroxy groups. Graph hydroxyoctadecanoic acids|hydroxystearic acid|hydroxystearic acids hydroxyoctadecanoic acids|hydroxystearic acid|hydroxystearic acids http://purl.obolibrary.org/obo/CHEBI_24747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24751 biolink:ChemicalEntity hydroxytoluene Any member of the class of toluenes carrying one or more hydroxy substituents. Graph hydroxytoluene|hydroxytoluenes hydroxytoluene|hydroxytoluenes http://purl.obolibrary.org/obo/CHEBI_24751 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24753 biolink:ChemicalEntity hygromycin Graph hygromycins hygromycins http://purl.obolibrary.org/obo/CHEBI_24753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24757 biolink:ChemicalEntity hypochlorous acid A chlorine oxoacid with formula HOCl; a weak, unstable acid, it is the active form of chlorine in water. cas:7790-92-3|gmelin:688|pubmed:11640916|pubmed:12079432|pubmed:12215218|pubmed:15589368|pubmed:7487057|pubmed:8072005 Graph Chlor(I)-saeure|HClO|HOCl|[ClOH]|chloranol|hydroxidochlorine|hypochloric acid|hypochlorige Saeure|hypochlorous acid chloranol|hydroxidochlorine|hypochlorous acid Chlor(I)-saeure|HClO|HOCl|[ClOH]|chloranol|hydroxidochlorine|hypochloric acid|hypochlorige Saeure|hypochlorous acid http://purl.obolibrary.org/obo/CHEBI_24757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24766 biolink:ChemicalEntity iditol beilstein:1721910 Graph Idit|iditol|rel-(2R,3S,4S,5R)-hexane-1,2,3,4,5,6-hexol iditol Idit|iditol|rel-(2R,3S,4S,5R)-hexane-1,2,3,4,5,6-hexol http://purl.obolibrary.org/obo/CHEBI_24766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24768 biolink:ChemicalEntity iduronates Graph http://purl.obolibrary.org/obo/CHEBI_24768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24769 biolink:ChemicalEntity iduronic acid A member of the class of iduronic acids that is the major uronic acid component of the dermatan sulfate and heparin. hmdb:HMDB0002704|pubmed:23441919|pubmed:23843960|pubmed:24770491|wikipedia.en:Iduronic_acid Graph http://purl.obolibrary.org/obo/CHEBI_24769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24779 biolink:ChemicalEntity imidazolylacetaldehyde Graph imidazolylacetaldehydes imidazolylacetaldehydes http://purl.obolibrary.org/obo/CHEBI_24779 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24780 biolink:ChemicalEntity imidazoles A five-membered organic heterocycle containing two nitrogen atoms at positions 1 and 3, or any of its derivatives; compounds containing an imidazole skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_24780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24781 biolink:ChemicalEntity imidazolinone Graph imidazolinones imidazolinones http://purl.obolibrary.org/obo/CHEBI_24781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24782 biolink:ChemicalEntity imide Graph imide|imides imide|imides http://purl.obolibrary.org/obo/CHEBI_24782 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24783 biolink:ChemicalEntity imine Compounds having the structure RN=CR2 (R = H, hydrocarbyl). Thus analogues of aldehydes or ketones, having NR doubly bonded to carbon; aldimines have the structure RCH=NR, ketimines have the structure R'2C=NR (where R' is not H). Imines include azomethines and Schiff bases. Imine is used as a suffix in systematic nomenclature to denote the C=NH group excluding the carbon atom. Graph imine|imines imine|imines http://purl.obolibrary.org/obo/CHEBI_24783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24785 biolink:ChemicalEntity iminodiacetate A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxy groups of iminodiacetic acid. metacyc.compound:CPD-10189|pubmed:1735711|pubmed:8892809|pubmed:9023192|reaxys:3663982|umbbd.compound:c0558 Graph 2,2'-iminodiacetate|iminodiacetic acid dianion 2,2'-iminodiacetate 2,2'-iminodiacetate|iminodiacetic acid dianion http://purl.obolibrary.org/obo/CHEBI_24785 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24786 biolink:ChemicalEntity iminodiacetic acid An amino dicarboxylic acid that is glycine in which one of the hydrogens attached to the nitrogen is substituted by a carboxymethyl group. cas:142-73-4|foodb.food:FDB028424|hmdb:HMDB0011753|metacyc.compound:CPD-10189|pubmed:1735711|pubmed:21212492|pubmed:21488608|pubmed:21567989|pubmed:8892809|pubmed:9023192|reaxys:878499|umbbd.compound:c0558|wikipedia.en:Iminodiacetic_acid Graph 2,2'-azanediyldiacetic acid|2,2'-iminodiacetic acid|2-[(carboxymethyl)amino]acetic acid|IDA|N-(carboxymethyl)glycine|aminodiacetic acid|bis(carboxymethyl)amine|diglycine|diglycocoll|iminobis(acetic acid)|iminodiacetic acid|iminodiethanoic acid 2,2'-iminodiacetic acid 2,2'-azanediyldiacetic acid|2,2'-iminodiacetic acid|2-[(carboxymethyl)amino]acetic acid|IDA|N-(carboxymethyl)glycine|aminodiacetic acid|bis(carboxymethyl)amine|diglycine|diglycocoll|iminobis(acetic acid)|iminodiacetic acid|iminodiethanoic acid http://purl.obolibrary.org/obo/CHEBI_24786 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24789 biolink:ChemicalEntity indanones Graph indanones indanones http://purl.obolibrary.org/obo/CHEBI_24789 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2479 biolink:ChemicalEntity adenosylcobinamide guanosyl diphosphate A cobalt corrinoid consisting of cobinamide guanosyl diphosphate having a 5'-adenosyl group attached to the central cobalt atom. kegg.compound:C06510|metacyc.compound:ADENOSYLCOBINAMIDE-GDP|pubmed:10518530|pubmed:14645280|pubmed:17209023 Graph Adenosine-GDP-cobinamide|Adenosylcobinamide-GDP Adenosine-GDP-cobinamide|Adenosylcobinamide-GDP http://purl.obolibrary.org/obo/CHEBI_2479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24793 biolink:ChemicalEntity indoledione Graph http://purl.obolibrary.org/obo/CHEBI_24793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24796 biolink:ChemicalEntity indolylmethylglucosinolate A glucosinolate that is the conjugate base of indolylmethylglucosinolic acid. Graph indole glucosinolates|indolyl glucosinolate|indolylglucosinolate|indolylmethyl glucosinolate|indolylmethylglucosinolate|indolylmethylglucosinolates indole glucosinolates|indolyl glucosinolate|indolylglucosinolate|indolylmethyl glucosinolate|indolylmethylglucosinolate|indolylmethylglucosinolates http://purl.obolibrary.org/obo/CHEBI_24796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24797 biolink:ChemicalEntity indole phytoalexin Graph indole phytoalexins indole phytoalexins http://purl.obolibrary.org/obo/CHEBI_24797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2480 biolink:ChemicalEntity adenosylcobinamide A cobalt-corrinoid hexaamide comprising cobinamide having an adenosyl group attached to cobalt. beilstein:9471192|kegg.compound:C06508 Graph 5'-deoxy-5'-adenosylcobinamide|Adenosyl cobinamide|adenosylcob(III)inamide 5'-deoxy-5'-adenosylcobinamide|Adenosyl cobinamide|adenosylcob(III)inamide http://purl.obolibrary.org/obo/CHEBI_2480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24803 biolink:ChemicalEntity indole-3-acetic acids An indol-3-yl carboxylic acid in which the carboxylic acid specified is acetic acid. Graph http://purl.obolibrary.org/obo/CHEBI_24803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24809 biolink:ChemicalEntity indole-3-carboxylic acid An indole-3-carboxylic acid carrying a carboxy group at position 3. cas:771-50-6|gmelin:1875411|hmdb:HMDB0003320|pdb-ccd:ICO|pubmed:1262308|pubmed:13905029|pubmed:16664264|pubmed:23116603|pubmed:4844607|reaxys:129435 Graph 1H-indole-3-carboxylic acid|indole-3-carboxylic acid 1H-indole-3-carboxylic acid 1H-indole-3-carboxylic acid|indole-3-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_24809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2481 biolink:ChemicalEntity adenosylcobinamide phosphate An O-phosphocorrinoid that is cobinamide phosphate having a 5'-adenosyl group attached to the central cobalt atom. kegg.compound:C06509 Graph Adenosyl cobinamide phosphate Adenosyl cobinamide phosphate http://purl.obolibrary.org/obo/CHEBI_2481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24810 biolink:ChemicalEntity indol-3-yl carboxylic acid Any indolyl carboxylic acid carrying an indol-3-yl or substituted indol-3-yl group. Graph indol-3-yl carboxylic acids indol-3-yl carboxylic acids http://purl.obolibrary.org/obo/CHEBI_24810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24813 biolink:ChemicalEntity 3-(indol-3-yl)lactic acid A hydroxy monocarboxylic acid that is lactic acid substituted by a 1H-indol-3-yl group at position 3. It is a metabolite of tryptophan. cas:1821-52-9|hmdb:HMDB0000671|kegg.compound:C02043|metacyc.compound:INDOLE_LACTATE|pubmed:16347781|pubmed:20540569|pubmed:21749142|pubmed:22372405|pubmed:23111785|pubmed:2361979|pubmed:23924721|pubmed:533277|reaxys:86202 Graph 2-hydroxy-3-(1H-indol-3-yl)propanoic acid|3-(Indol-3-yl)lactic acid|alpha-Hydroxy-1H-indole-3-propanoic acid|indole-3-lactic acid 2-hydroxy-3-(1H-indol-3-yl)propanoic acid 2-hydroxy-3-(1H-indol-3-yl)propanoic acid|3-(Indol-3-yl)lactic acid|alpha-Hydroxy-1H-indole-3-propanoic acid|indole-3-lactic acid http://purl.obolibrary.org/obo/CHEBI_24813 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24814 biolink:ChemicalEntity indole-3-methanol An indolyl alcohol carrying a hydroxymethyl group at position 3. It is a constituent of the cruciferous vegetables and had anticancer activity. cas:700-06-1|gmelin:1603301|hmdb:HMDB0005785|lincs.smallmolecule:LSM-2011|pubmed:11755234|pubmed:16634522|pubmed:19064917|pubmed:23800833|pubmed:24200994|pubmed:24357105|pubmed:24488207|reaxys:121323|wikipedia.en:Indole-3-carbinol Graph 1H-indol-3-ylmethanol|3-hydroxymethylindole|3-indolylcarbinol|indole-3-carbinol|indole-3-methanol 1H-indol-3-ylmethanol 1H-indol-3-ylmethanol|3-hydroxymethylindole|3-indolylcarbinol|indole-3-carbinol|indole-3-methanol http://purl.obolibrary.org/obo/CHEBI_24814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2482 biolink:ChemicalEntity adenosylcob(III)yrinic acid a,c-diamide A cobalt corrinoid that is cob(III)yrinic acid a,c-diamide having a 5'-adenosyl group attached to the central cobalt atom. kegg.compound:C06506 Graph Adenosyl cobyrinate a,c diamide|Adenosyl cobyrinate diamide|Adenosylcob(III)yrinic acid a,c-diamide|Adenosylcobyrinic acid a,c-diamide Adenosyl cobyrinate a,c diamide|Adenosyl cobyrinate diamide|Adenosylcob(III)yrinic acid a,c-diamide|Adenosylcobyrinic acid a,c-diamide http://purl.obolibrary.org/obo/CHEBI_2482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24821 biolink:ChemicalEntity indolyl carbohydrate Graph indolyl carbohydrates indolyl carbohydrates http://purl.obolibrary.org/obo/CHEBI_24821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24823 biolink:ChemicalEntity indoleacetaldehyde An aldehyde that is acetaldehyde substituted by an indolyl group. Graph indoleacetaldehydes indoleacetaldehydes http://purl.obolibrary.org/obo/CHEBI_24823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24828 biolink:ChemicalEntity indoles Any compound containing an indole skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_24828 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24829 biolink:ChemicalEntity indolones Graph http://purl.obolibrary.org/obo/CHEBI_24829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2483 biolink:ChemicalEntity adenosylcobyric acid A cobalt corrinoid that is cobyric acid having a 5'-adenosyl group attached to the central cobalt atom. kegg.compound:C06507 Graph 5'-deoxy-5'-adenosylcobyric acid|Adenosyl cobyrinate hexaamide|Adenosylcobyric acid 5'-deoxy-5'-adenosylcobyric acid|Adenosyl cobyrinate hexaamide|Adenosylcobyric acid http://purl.obolibrary.org/obo/CHEBI_2483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24833 biolink:ChemicalEntity oxoacid A compound which contains oxygen, at least one other element, and at least one hydrogen bound to oxygen, and which produces a conjugate base by loss of positive hydrogen ion(s) (hydrons). Graph oxacids|oxiacids|oxo acid|oxoacid|oxoacids|oxy-acids|oxyacids oxoacid|oxoacids oxacids|oxiacids|oxo acid|oxoacid|oxoacids|oxy-acids|oxyacids http://purl.obolibrary.org/obo/CHEBI_24833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24834 biolink:ChemicalEntity inorganic anion Graph inorganic anions inorganic anions http://purl.obolibrary.org/obo/CHEBI_24834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24835 biolink:ChemicalEntity inorganic molecular entity A molecular entity that contains no carbon. Graph anorganische Verbindungen|inorganic compounds|inorganic entity|inorganic molecular entities|inorganics anorganische Verbindungen|inorganic compounds|inorganic entity|inorganic molecular entities|inorganics http://purl.obolibrary.org/obo/CHEBI_24835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24836 biolink:ChemicalEntity inorganic oxide Graph inorganic oxides inorganic oxides http://purl.obolibrary.org/obo/CHEBI_24836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24837 biolink:ChemicalEntity inorganic peroxide Compounds of structure ROOR' in which R and R' are inorganic groups. Graph inorganic peroxide|inorganic peroxides inorganic peroxide|inorganic peroxides http://purl.obolibrary.org/obo/CHEBI_24837 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24838 biolink:ChemicalEntity inorganic phosphate Any phosphate that contains no carbon atom. Graph inorganic phosphates inorganic phosphates http://purl.obolibrary.org/obo/CHEBI_24838 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24839 biolink:ChemicalEntity inorganic salt Graph anorganisches Salz|inorganic salts anorganisches Salz|inorganic salts http://purl.obolibrary.org/obo/CHEBI_24839 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24840 biolink:ChemicalEntity inorganic sulfate salt Graph inorganic sulfate salts|inorganic sulfates inorganic sulfate salts|inorganic sulfates http://purl.obolibrary.org/obo/CHEBI_24840 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24843 biolink:ChemicalEntity inosine phosphate Graph inosine phosphates inosine phosphates http://purl.obolibrary.org/obo/CHEBI_24843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24844 biolink:ChemicalEntity inosines Any purine ribonucleoside that is a derivative of inosine. Graph http://purl.obolibrary.org/obo/CHEBI_24844 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24846 biolink:ChemicalEntity inositol phosphate Graph inositol phosphates inositol phosphates http://purl.obolibrary.org/obo/CHEBI_24846 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24848 biolink:ChemicalEntity inositol Any cyclohexane-1,2,3,4,5,6-hexol. Graph 1,2,3,4,5,6-cyclohexanehexol|inositol|inositols inositols 1,2,3,4,5,6-cyclohexanehexol|inositol|inositols http://purl.obolibrary.org/obo/CHEBI_24848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2485 biolink:ChemicalEntity adenylyl selenate The 5'-selenonooxyphosphate ester of adenosine. hmdb:HMDB0004112|pubmed:2545107 Graph 5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine|5'-adenylyl selenate|Adenosine-5'-phosphoselenate|Adenylylselenate 5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine|5'-adenylyl selenate 5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine|5'-adenylyl selenate|Adenosine-5'-phosphoselenate|Adenylylselenate http://purl.obolibrary.org/obo/CHEBI_2485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24850 biolink:ChemicalEntity insect attractant A chemical that attracts insects. pubmed:7044287 Graph insect attractants insect attractants http://purl.obolibrary.org/obo/CHEBI_24850 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24851 biolink:ChemicalEntity insect growth regulator A growth regulator that inhibits the life cycle of an insect. Graph insect growth regulators insect growth regulators http://purl.obolibrary.org/obo/CHEBI_24851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24852 biolink:ChemicalEntity insecticide Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. wikipedia.en:Insecticide Graph insecticides insecticides http://purl.obolibrary.org/obo/CHEBI_24852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24853 biolink:ChemicalEntity intercalator A role played by a chemical agent which exhibits the capability of occupying space between DNA base pairs due to particular properties in size, shape and charge. Intercalation of chemical compounds in DNA helix can result in replication errors (shift, mutation) or DNA damages. Graph agente intercalante|intercalating agent|intercalating agents|intercalating ligands|intercalators agente intercalante|intercalating agent|intercalating agents|intercalating ligands|intercalators http://purl.obolibrary.org/obo/CHEBI_24853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24858 biolink:ChemicalEntity iodide salt Graph iodide salts|iodides iodide salts|iodides http://purl.obolibrary.org/obo/CHEBI_24858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24859 biolink:ChemicalEntity iodine atom Chemical element with atomic number 53. webelements:I Graph 53I|I|Iod|J|Jod|iode|iodine|iodium|yodo iodine 53I|I|Iod|J|Jod|iode|iodine|iodium|yodo http://purl.obolibrary.org/obo/CHEBI_24859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24860 biolink:ChemicalEntity iodine molecular entity Graph iodine compounds|iodine molecular entities|iodine molecular entity iodine compounds|iodine molecular entities|iodine molecular entity http://purl.obolibrary.org/obo/CHEBI_24860 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24862 biolink:ChemicalEntity iodoamino acid An amino acid containing at least one iodo substituent. Graph http://purl.obolibrary.org/obo/CHEBI_24862 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24863 biolink:ChemicalEntity iodophenol Graph iodophenol iodophenol iodophenol http://purl.obolibrary.org/obo/CHEBI_24863 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24864 biolink:ChemicalEntity iodothyronine An iodoamino acid in which the amino acid specified is thyronine. Graph iodothyronines iodothyronines http://purl.obolibrary.org/obo/CHEBI_24864 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24865 biolink:ChemicalEntity iodotyrosine A tyrosine derivative which has at least one iodo-substituent on the benzyl moiety. Graph http://purl.obolibrary.org/obo/CHEBI_24865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24866 biolink:ChemicalEntity salt A salt is an assembly of cations and anions. Graph Salz|Salze|ionic compound|ionic compounds|sal|sales|salt|salts|sel|sels salt Salz|Salze|ionic compound|ionic compounds|sal|sales|salt|salts|sel|sels http://purl.obolibrary.org/obo/CHEBI_24866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24867 biolink:ChemicalEntity monoatomic ion Graph monoatomic ions monoatomic ions http://purl.obolibrary.org/obo/CHEBI_24867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24868 biolink:ChemicalEntity organic salt Graph organic salts|organisches Salz organic salts|organisches Salz http://purl.obolibrary.org/obo/CHEBI_24868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24869 biolink:ChemicalEntity ionophore A compound which can carry specific ions through membranes of cells or organelles. wikipedia.en:Ionophore Graph ionophore|ionophores ionophore ionophore|ionophores http://purl.obolibrary.org/obo/CHEBI_24869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24870 biolink:ChemicalEntity ion A molecular entity having a net electric charge. Graph Ion|Ionen|ion|iones|ions ion Ion|Ionen|ion|iones|ions http://purl.obolibrary.org/obo/CHEBI_24870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24873 biolink:ChemicalEntity iron molecular entity Graph iron compounds|iron molecular entities|iron molecular entity iron compounds|iron molecular entities|iron molecular entity http://purl.obolibrary.org/obo/CHEBI_24873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24874 biolink:ChemicalEntity iron ionophore Any ionophore capable of transportation of iron ions across membranes. Graph iron ionophores iron ionophores http://purl.obolibrary.org/obo/CHEBI_24874 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24875 biolink:ChemicalEntity iron cation Graph Fe cation|iron cation|iron cations iron cation Fe cation|iron cation|iron cations http://purl.obolibrary.org/obo/CHEBI_24875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24897 biolink:ChemicalEntity isoindoles Graph http://purl.obolibrary.org/obo/CHEBI_24897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24898 biolink:ChemicalEntity isoleucine A 2-amino-3-methylpentanoic acid having either (2R,3R)- or (2S,3S)-configuration. cas:443-79-8|pubmed:17190852|reaxys:1721790 Graph Hile|isoleucine|rel-(2R,3R)-2-amino-3-methylpentanoic acid isoleucine Hile|isoleucine|rel-(2R,3R)-2-amino-3-methylpentanoic acid http://purl.obolibrary.org/obo/CHEBI_24898 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24899 biolink:ChemicalEntity isoleucine derivative An amino acid derivative resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of isoleucine by a heteroatom. The definition normally excludes peptides containing isoleucine residues. Graph isoleucine derivatives isoleucine derivatives http://purl.obolibrary.org/obo/CHEBI_24899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2490 biolink:ChemicalEntity 6-oxohexanoic acid A medium-chain fatty acid comprising hexanoic acid carrying an oxo group at position 6. cas:928-81-4|kegg.compound:C06102|reaxys:1752422 Graph 1-hexanal-6-carboxylic acid|5-carbohydroxy-1-pentanal|5-formylvaleric acid|6-Oxohexanoic acid|6-hydroxy caproic acid|6-oxohexanoic acid|adipic acid monoaldehyde|adipic acid semialdehyde|adipic monoaldehyde|adipic semialdehyde 6-oxohexanoic acid 1-hexanal-6-carboxylic acid|5-carbohydroxy-1-pentanal|5-formylvaleric acid|6-Oxohexanoic acid|6-hydroxy caproic acid|6-oxohexanoic acid|adipic acid monoaldehyde|adipic acid semialdehyde|adipic monoaldehyde|adipic semialdehyde http://purl.obolibrary.org/obo/CHEBI_2490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24909 biolink:ChemicalEntity hydrocarbyladenosine Graph hydrocarbyladenosines hydrocarbyladenosines http://purl.obolibrary.org/obo/CHEBI_24909 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24911 biolink:ChemicalEntity isopiperitenol beilstein:2207765 Graph 3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|p-mentha-1,8-dien-3-ol 3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|p-mentha-1,8-dien-3-ol 3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-ol|p-mentha-1,8-dien-3-ol http://purl.obolibrary.org/obo/CHEBI_24911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24913 biolink:ChemicalEntity isoprenoid Any lipid formally derived from isoprene (2-methylbuta-1,3-diene), the skeleton of which can generally be discerned in repeated occurrence in the molecule. The skeleton of isoprenoids may differ from strict additivity of isoprene units by loss or shift of a fragment, commonly a methyl group. The class includes both hydrocarbons and oxygenated derivatives. lipidmaps_class:LMPR01|pubmed:12769708|pubmed:19219049 Graph isoprenoid|isoprenoids isoprenoids isoprenoid|isoprenoids http://purl.obolibrary.org/obo/CHEBI_24913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24921 biolink:ChemicalEntity isoquinoline alkaloid Any alkaloid that has a structure based on an isoquinoline nucleus. They are derived from the amino acids like tyrosine and phenylalanine. Graph isoquinoline alkaloids isoquinoline alkaloids http://purl.obolibrary.org/obo/CHEBI_24921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24922 biolink:ChemicalEntity isoquinolines A class of organic heteropolycyclic compound consisting of isoquinoline and its substitution derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_24922 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24923 biolink:ChemicalEntity isoquinolinol Graph isoquinolinols isoquinolinols http://purl.obolibrary.org/obo/CHEBI_24923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24928 biolink:ChemicalEntity isothiocyanic acid beilstein:1900391|cas:3129-90-6|gmelin:130289 Graph HNCS|Isothiocyansaeure|Isothiozyansaeure|[C(NH)S]|azanediidosulfidocarbon|imidosulfidocarbon|isothiocyanic acid azanediidosulfidocarbon|imidosulfidocarbon HNCS|Isothiocyansaeure|Isothiozyansaeure|[C(NH)S]|azanediidosulfidocarbon|imidosulfidocarbon|isothiocyanic acid http://purl.obolibrary.org/obo/CHEBI_24928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24937 biolink:ChemicalEntity jasmonates The jasmonates (JAs) are a group of plant hormones which help regulate plant growth and development. wikipedia.en:Jasmonate Graph http://purl.obolibrary.org/obo/CHEBI_24937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24942 biolink:ChemicalEntity juvenile hormone mimic Graph juvenile hormone mimics juvenile hormone mimics http://purl.obolibrary.org/obo/CHEBI_24942 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:24943 biolink:ChemicalEntity juvenile hormone A family of farnesane sesquiterpenoids that regulate many aspects of insect physiology. wikipedia.en:Juvenile_hormone Graph http://purl.obolibrary.org/obo/CHEBI_24943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2495 biolink:ChemicalEntity adrenosterone A 3-oxo Δ4-steroid that is androst-4-ene carrying three oxo-substituents at positions 3, 11 and 17. cas:382-45-6|hmdb:HMDB0006772|kegg.compound:C05285|metacyc.compound:CPD-18926|pubmed:10469997|pubmed:12434991|pubmed:12460593|pubmed:13061495|pubmed:13414169|pubmed:14288792|pubmed:14297229|pubmed:14308712|pubmed:16216911|pubmed:17360211|pubmed:17889091|pubmed:20355175|pubmed:2295425|pubmed:22987608|pubmed:23685396|pubmed:25435279|pubmed:25917864|pubmed:26478560|pubmed:26865584|pubmed:27154751|pubmed:27889993|pubmed:27901631|pubmed:28234803|pubmed:28472487|pubmed:4243440|pubmed:5215809|pubmed:5764541|pubmed:5870893|pubmed:6057562|pubmed:7927284|pubmed:955389|reaxys:3036825 Graph 11-Keto-androstenedione|11-OXO|11-Oxy-4-androstenedione|11-ketoandrostenedione|11-oxoandrost-4-ene-3,17-dione|11-oxoandrostenedione|4-Androsten-3,11,17-trione|Andrenosterone|NSC 12166|Reichstein's substance G|androst-4-ene-3,11,17-trione androst-4-ene-3,11,17-trione 11-Keto-androstenedione|11-OXO|11-Oxy-4-androstenedione|11-ketoandrostenedione|11-oxoandrost-4-ene-3,17-dione|11-oxoandrostenedione|4-Androsten-3,11,17-trione|Andrenosterone|NSC 12166|Reichstein's substance G|androst-4-ene-3,11,17-trione http://purl.obolibrary.org/obo/CHEBI_2495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24951 biolink:ChemicalEntity kanamycins Graph http://purl.obolibrary.org/obo/CHEBI_24951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24957 biolink:ChemicalEntity keto-disaccharide Any disaccharide that contains a keto group within its structure. pubmed:26786171 Graph keto-disaccharides keto-disaccharides http://purl.obolibrary.org/obo/CHEBI_24957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24960 biolink:ChemicalEntity ketoaldehyde Any compound that has an aldehydic and ketonic group in the same molecule. kegg.compound:C01928 Graph ketoaldehydes ketoaldehydes http://purl.obolibrary.org/obo/CHEBI_24960 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24961 biolink:ChemicalEntity ketoaldonate Graph ketoaldonate|ketoaldonates ketoaldonate|ketoaldonates http://purl.obolibrary.org/obo/CHEBI_24961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24962 biolink:ChemicalEntity ketoaldonic acid phosphate Graph ketoaldonic acid phosphates ketoaldonic acid phosphates http://purl.obolibrary.org/obo/CHEBI_24962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24963 biolink:ChemicalEntity ketoaldonic acid Oxo carboxylic acids formally derived from aldonic acids by replacement of a secondary CHOH group by a carbonyl group. Graph ketoaldonic acid|ketoaldonic acids ketoaldonic acid|ketoaldonic acids http://purl.obolibrary.org/obo/CHEBI_24963 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24964 biolink:ChemicalEntity deoxyketohexose phosphate Graph deoxyketohexose phosphates|ketodeoxyhexose phosphate deoxyketohexose phosphates|ketodeoxyhexose phosphate http://purl.obolibrary.org/obo/CHEBI_24964 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24965 biolink:ChemicalEntity deoxyketohexose Any ketohexose having at least one hydroxy group replaced by hydrogen. Graph deoxyketohexose|deoxyketohexoses|ketodeoxyhexose|ketodeoxyhexoses deoxyketohexose|deoxyketohexoses|ketodeoxyhexose|ketodeoxyhexoses http://purl.obolibrary.org/obo/CHEBI_24965 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24966 biolink:ChemicalEntity keto-D-gluconate A ketogluconate of D-configuration Graph dehydro-D-gluconate|dehydro-D-gluconates dehydro-D-gluconate|dehydro-D-gluconates http://purl.obolibrary.org/obo/CHEBI_24966 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24967 biolink:ChemicalEntity ketogluconic acid A gluconic acid that contains a ketonic carbonyl group. Graph ketogluconic acids ketogluconic acids http://purl.obolibrary.org/obo/CHEBI_24967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24970 biolink:ChemicalEntity ketohexose bisphosphate Graph ketohexose bisphosphate|ketohexose bisphosphates ketohexose bisphosphate|ketohexose bisphosphates http://purl.obolibrary.org/obo/CHEBI_24970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24971 biolink:ChemicalEntity ketohexose monophosphate Graph ketohexose monophosphate|ketohexose monophosphates ketohexose monophosphate|ketohexose monophosphates http://purl.obolibrary.org/obo/CHEBI_24971 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24972 biolink:ChemicalEntity ketohexose phosphate Graph ketohexose phosphate|ketohexose phosphates ketohexose phosphate|ketohexose phosphates http://purl.obolibrary.org/obo/CHEBI_24972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24973 biolink:ChemicalEntity ketohexose Any hexose containing a single ketone group. Graph ketohexose|ketohexoses ketohexose|ketohexoses http://purl.obolibrary.org/obo/CHEBI_24973 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24976 biolink:ChemicalEntity ketopentose phosphate Graph ketopentose phosphate|ketopentose phosphates ketopentose phosphate|ketopentose phosphates http://purl.obolibrary.org/obo/CHEBI_24976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24977 biolink:ChemicalEntity ketopentose A pentose having a single ketone group at the 2-position. Graph ketopentose|ketopentoses ketopentose|ketopentoses http://purl.obolibrary.org/obo/CHEBI_24977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24978 biolink:ChemicalEntity ketose Ketonic parent sugars (polyhydroxy ketones H[CH(OH)]nC(=O)[CH(OH)]mH) and their intramolecular hemiketals. Graph ketose|ketoses ketose|ketoses http://purl.obolibrary.org/obo/CHEBI_24978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24980 biolink:ChemicalEntity ketotetrose phosphate Graph ketotetrose phosphate|ketotetrose phosphates ketotetrose phosphate|ketotetrose phosphates http://purl.obolibrary.org/obo/CHEBI_24980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24981 biolink:ChemicalEntity ketotetrose A tetrose having a single ketone group at the 2-position. Graph ketotetrose|ketotetroses ketotetrose|ketotetroses http://purl.obolibrary.org/obo/CHEBI_24981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24982 biolink:ChemicalEntity ketotriose Any ketone-containing triose. Graph ketotriose|ketotrioses ketotriose|ketotrioses http://purl.obolibrary.org/obo/CHEBI_24982 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24983 biolink:ChemicalEntity ketoxime Oximes of ketones R2C=NOH (where R ≠ H). Graph ketoxime|ketoximes ketoximes ketoxime|ketoximes http://purl.obolibrary.org/obo/CHEBI_24983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24995 biolink:ChemicalEntity lactam Cyclic amides of amino carboxylic acids, having a 1-azacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. Graph Laktam|Laktame|lactam|lactams lactams Laktam|Laktame|lactam|lactams http://purl.obolibrary.org/obo/CHEBI_24995 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24996 biolink:ChemicalEntity lactate A hydroxy monocarboxylic acid anion that is the conjugate base of lactic acid, arising from deprotonation of the carboxy group. beilstein:3587719|cas:113-21-3|gmelin:240074|kegg.compound:C01432|metacyc.compound:Lactate Graph 2-hydroxypropanoate|2-hydroxypropanoic acid, ion(1-)|2-hydroxypropionate|MeCH(OH)CO2 anion|b-lactate|beta-lactate|lactate 2-hydroxypropanoate 2-hydroxypropanoate|2-hydroxypropanoic acid, ion(1-)|2-hydroxypropionate|MeCH(OH)CO2 anion|b-lactate|beta-lactate|lactate http://purl.obolibrary.org/obo/CHEBI_24996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:24997 biolink:ChemicalEntity lactate salt Any organic salt that has lactate as the cation. Graph 2-hydroxypropanoate salt|2-hydroxypropanoate salts|2-hydroxypropionate salt|2-hydroxypropionate salts|lactate salts|lactates 2-hydroxypropanoate salt|2-hydroxypropanoate salts|2-hydroxypropionate salt|2-hydroxypropionate salts|lactate salts|lactates http://purl.obolibrary.org/obo/CHEBI_24997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2500 biolink:ChemicalEntity Aescin cas:6805-41-0|kegg.compound:C08921|kegg.drug:D07912|knapsack:C00003497 Graph Aescin|Escin Aescin|Escin http://purl.obolibrary.org/obo/CHEBI_2500 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:25000 biolink:ChemicalEntity lactone Any cyclic carboxylic ester containing a 1-oxacycloalkan-2-one structure, or an analogue having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. Graph Lacton|Lakton|Laktone|lactona|lactonas|lactone|lactones lactone|lactones Lacton|Lakton|Laktone|lactona|lactonas|lactone|lactones http://purl.obolibrary.org/obo/CHEBI_25000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25002 biolink:ChemicalEntity lactosamines Graph lactosamines lactosamines http://purl.obolibrary.org/obo/CHEBI_25002 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25013 biolink:ChemicalEntity lanthionine An alanine derivative in which two alanine residues are linked on their β-carbons by a thioether linkage. pubmed:15716431|wikipedia.en:Lanthionine Graph http://purl.obolibrary.org/obo/CHEBI_25013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25016 biolink:ChemicalEntity lead atom kegg.compound:C06696|webelements:Pb Graph 82Pb|Blei|Pb|lead|plomb|plomo|plumbum lead 82Pb|Blei|Pb|lead|plomb|plomo|plumbum http://purl.obolibrary.org/obo/CHEBI_25016 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25017 biolink:ChemicalEntity leucine A branched-chain amino acid that consists of glycine in which one of the hydrogens attached to the α-carbon is substituted by an isobutyl group. cas:328-39-2|gmelin:50203|kegg.compound:C16439|lipidmaps:LMFA01100048|pubmed:17439666|reaxys:636005|wikipedia.en:Leucine Graph (+-)-Leucine|(RS)-Leucine|2-amino-4-methylpentanoic acid|DL-Leucine|Hleu|L|Leu|Leucin|Leuzin|leucine leucine (+-)-Leucine|(RS)-Leucine|2-amino-4-methylpentanoic acid|DL-Leucine|Hleu|L|Leu|Leucin|Leuzin|leucine http://purl.obolibrary.org/obo/CHEBI_25017 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25018 biolink:ChemicalEntity L-leucine derivative A proteinogenic amino acid derivative resulting from reaction of L-leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of L-leucine by a heteroatom. Graph http://purl.obolibrary.org/obo/CHEBI_25018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25022 biolink:ChemicalEntity leucomycin Graph leucomycins leucomycins http://purl.obolibrary.org/obo/CHEBI_25022 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25029 biolink:ChemicalEntity leukotriene Any icosanoid from that family of C20 polyunsaturated fatty acids and their derivatives generated by leukocytes from arachidonic acid, each member having four double bonds of which three are conjugated. lipidmaps_class:LMFA0302|pubmed:10922142|pubmed:15794321|pubmed:3001504|pubmed:6129158|pubmed:6293196|pubmed:6311078|pubmed:8842590|pubmed:9526099|pubmed:9561094 Graph Leukotrien|Leukotriene|leucotriene|leucotrienes|leukotriene|leukotrienes leukotrienes Leukotrien|Leukotriene|leucotriene|leucotrienes|leukotriene|leukotrienes http://purl.obolibrary.org/obo/CHEBI_25029 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25036 biolink:ChemicalEntity lignan "Any phenylpropanoid derived from phenylalanine via dimerization of substituted cinnamic alcohols, known as monolignols, to a dibenzylbutane skeleton. Note that while individual members of the class have names ending ...lignane, ...lignene, ...lignadiene, etc., the class names lignan, neolignan, etc., do not end with an ""e""." Graph lignan|lignans lignan|lignans http://purl.obolibrary.org/obo/CHEBI_25036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2504 biolink:ChemicalEntity aflatoxin B1 An aflatoxin having a tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene skeleton with oxygen functionality at positions 1, 4 and 11. cas:1162-65-8|kegg.compound:C06800|knapsack:C00000546 Graph (6aR,9aS)-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione|2,3,6aalpha,9aalpha-Tetrahydro-4-methoxycyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione|Aflatoxin B1|aflatoxin B(1) (6aR,9aS)-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione (6aR,9aS)-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione|2,3,6aalpha,9aalpha-Tetrahydro-4-methoxycyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione|Aflatoxin B1|aflatoxin B(1) http://purl.obolibrary.org/obo/CHEBI_2504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25040 biolink:ChemicalEntity limonene monoterpenoid Graph limonene monoterpenoids limonene monoterpenoids http://purl.obolibrary.org/obo/CHEBI_25040 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25046 biolink:ChemicalEntity linear tetrapyrrole Graph linear tetrapyrroles linear tetrapyrroles http://purl.obolibrary.org/obo/CHEBI_25046 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25048 biolink:ChemicalEntity linolenic acid A two-membered subclass of octadecatrienoic acid comprising the (9Z,12Z,15Z)- and (6Z,9Z,12Z)-isomers. Linolenic acids are nutrients essential to the formation of prostaglandins and are also used in making paints and synthetic resins. Graph C18:3|Linolensaeure|linolenic acids C18:3|Linolensaeure|linolenic acids http://purl.obolibrary.org/obo/CHEBI_25048 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2505 biolink:ChemicalEntity 8,9-dihydro-8-(S-glutathionyl)-9-hydroxyaflatoxin B1 A member of the class of aflatoxins that is 8,9-dihydro-9-hydroxyaflatoxin B1 having an S-glutathionyl moiety attached at position 8. cas:68385-50-2|hmdb:HMDB0060431|kegg.compound:C11278|lipidmaps:LMPK10000005|pubmed:3933841|pubmed:6411367 Graph 8,9-Dihydro-8-(S-glutathionyl)-9-hydroxyaflatoxin B1|Afb(1)-gsh|Afb1-gsh conjugate|Aflatoxin B1exo-8,9-epoxide-GSH|L-gamma-glutamyl-S-{(6aS,8S,9R,9aR)-9-hydroxy-4-methoxy-1,11-dioxo-1,2,3,6a,8,9,9a,11-octahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-8-yl}-L-cysteinylglycine|aflatoxin B1 exo-8,9-epoxide-GSH L-gamma-glutamyl-S-{(6aS,8S,9R,9aR)-9-hydroxy-4-methoxy-1,11-dioxo-1,2,3,6a,8,9,9a,11-octahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-8-yl}-L-cysteinylglycine 8,9-Dihydro-8-(S-glutathionyl)-9-hydroxyaflatoxin B1|Afb(1)-gsh|Afb1-gsh conjugate|Aflatoxin B1exo-8,9-epoxide-GSH|L-gamma-glutamyl-S-{(6aS,8S,9R,9aR)-9-hydroxy-4-methoxy-1,11-dioxo-1,2,3,6a,8,9,9a,11-octahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-8-yl}-L-cysteinylglycine|aflatoxin B1 exo-8,9-epoxide-GSH http://purl.obolibrary.org/obo/CHEBI_2505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25051 biolink:ChemicalEntity lipid As Glycophospholipids that are the components of endotoxins held responsible for the toxicity of Gram-negative bacteria. Lipid A is the innermost of the three regions of the lipopolysaccharide (LPS) molecule, and its hydrophobic nature allows it to anchor the LPS to the outer membrane. Four acyl chains attached directly to two (1→6)-linked glucosamine sugars are β-hydroxy acyl chains usually between 10 and 16 carbons in length. Two additional acyl chains are often attached to the β-hydroxy group. Graph lipid A lipid A http://purl.obolibrary.org/obo/CHEBI_25051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25061 biolink:ChemicalEntity lipopeptide antibiotic Graph lipopeptide antibiotics lipopeptide antibiotics http://purl.obolibrary.org/obo/CHEBI_25061 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25072 biolink:ChemicalEntity lombricine A serine derivative that is serine in which the hydrogen of the hydroxy group has been replaced by a (2-carbamimidamidoethoxy)(hydroxy)phosphoryl group. pubmed:13632801|pubmed:14439305|pubmed:1909513|pubmed:22705027|reaxys:1729503 Graph O-[(2-carbamimidamidoethoxy)(hydroxy)phosphoryl]serine O-[(2-carbamimidamidoethoxy)(hydroxy)phosphoryl]serine O-[(2-carbamimidamidoethoxy)(hydroxy)phosphoryl]serine http://purl.obolibrary.org/obo/CHEBI_25072 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25078 biolink:ChemicalEntity luciferin A low-molecular-mass compound present in bioluminescent organisms that emits light when oxidized in presence of enzyme luciferase. Graph http://purl.obolibrary.org/obo/CHEBI_25078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25091 biolink:ChemicalEntity luteolin O-glucuronoside A glycosyloxyflavone that is an O-glucuronidated derivative of luteolin. Graph luteolin glucosiduronic acid|luteolin glucosiduronic acids|luteolin glucuronoside|luteolin glucuronosides luteolin glucosiduronic acid|luteolin glucosiduronic acids|luteolin glucuronoside|luteolin glucuronosides http://purl.obolibrary.org/obo/CHEBI_25091 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25094 biolink:ChemicalEntity lysine A diamino acid that is caproic (hexanoic) acid bearing two amino substituents at positions 2 and 6. cas:70-54-2|gmelin:279284|kegg.compound:C16440|pubmed:17439666|pubmed:22264337|reaxys:1616991|wikipedia.en:Lysine Graph 2,6-diaminohexanoic acid|K|LYS|Lysin|alpha,epsilon-diaminocaproic acid|lysine 2,6-diaminohexanoic acid|lysine 2,6-diaminohexanoic acid|K|LYS|Lysin|alpha,epsilon-diaminocaproic acid|lysine http://purl.obolibrary.org/obo/CHEBI_25094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25095 biolink:ChemicalEntity L-lysine derivative A proteinogenic amino acid derivative resulting from reaction of L-lysine at the amino group or the carboxy group, or from the replacement of any hydrogen of L-lysine by a heteroatom. Graph L-lysine derivatives L-lysine derivatives http://purl.obolibrary.org/obo/CHEBI_25095 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25097 biolink:ChemicalEntity lyxose An aldopentose that occurs only rarely in nature. cas:65-42-9|pubmed:23353634 Graph (+-)-Lyxose|Lyx|dl-Lyxose|lyxo-pentose|lyxose lyxo-pentose|lyxose (+-)-Lyxose|Lyx|dl-Lyxose|lyxo-pentose|lyxose http://purl.obolibrary.org/obo/CHEBI_25097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25105 biolink:ChemicalEntity macrolide antibiotic A macrocyclic lactone with a ring of twelve or more members which exhibits antibiotic activity. Graph Makrolidantibiotika|macrolide antibiotics Makrolidantibiotika|macrolide antibiotics http://purl.obolibrary.org/obo/CHEBI_25105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25106 biolink:ChemicalEntity macrolide A macrocyclic lactone with a ring of twelve or more members derived from a polyketide. wikipedia.en:Macrolide Graph Makrolid|macrolide|macrolides macrolides Makrolid|macrolide|macrolides http://purl.obolibrary.org/obo/CHEBI_25106 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25107 biolink:ChemicalEntity magnesium atom cas:7439-95-4|drugbank:DB01378|gmelin:16207|kegg.compound:C00305|webelements:Mg Graph 12Mg|Magnesium|Mg|magnesio|magnesium magnesium 12Mg|Magnesium|Mg|magnesio|magnesium http://purl.obolibrary.org/obo/CHEBI_25107 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25108 biolink:ChemicalEntity magnesium molecular entity Graph magnesium compounds|magnesium molecular entities|magnesium molecular entity magnesium compounds|magnesium molecular entities|magnesium molecular entity http://purl.obolibrary.org/obo/CHEBI_25108 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25111 biolink:ChemicalEntity magnesium porphyrin Graph magnesium porphyrins magnesium porphyrins http://purl.obolibrary.org/obo/CHEBI_25111 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25115 biolink:ChemicalEntity malate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of malic acid. Graph malate anion|malates|malic acid anion malate anion|malates|malic acid anion http://purl.obolibrary.org/obo/CHEBI_25115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2512 biolink:ChemicalEntity agathisflavone A biflavonoid that is obtained by oxidative coupling of two molecules of apigenin resulting in a bond between positions C-6 and C-8 of the two chromene rings. cas:28441-98-7|kegg.compound:C10017|knapsack:C00001014|patent:US2002068757|patent:WO9700679|pubmed:1484886|pubmed:21106357|pubmed:21281018|pubmed:21594945|reaxys:1415839 Graph 5,5',7,7'-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)-(6,8'-bi-4H-1-benzopyran)-4,4'-dione|5,5',7,7'-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)-6,8'-bichromene-4,4'-dione|6,8''-Biapigenin|Agathisflavone 5,5',7,7'-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)-6,8'-bichromene-4,4'-dione 5,5',7,7'-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)-(6,8'-bi-4H-1-benzopyran)-4,4'-dione|5,5',7,7'-tetrahydroxy-2,2'-bis(4-hydroxyphenyl)-6,8'-bichromene-4,4'-dione|6,8''-Biapigenin|Agathisflavone http://purl.obolibrary.org/obo/CHEBI_2512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25136 biolink:ChemicalEntity malonyl-CoAs Any short-chain fatty acyl-CoA in which the the fatty acid specified is malonic acid or its derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_25136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25140 biolink:ChemicalEntity maltodextrin A dextrin in which the D-glucose units are linked by α-(1→4) glycosidic bonds. wikipedia.en:Maltodextrin Graph http://purl.obolibrary.org/obo/CHEBI_25140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:251408 biolink:ChemicalEntity edrophonium A quaternary ammonium ion that is N-ethyl-N,N-dimethylanilinium in which one of the meta positions is substituted by a hydroxy group. It is a reversible inhibitor of cholinesterase, with a rapid onset (30-60 seconds after injection) but a short duration of action (5-15 minutes). The chloride salt is used in myasthenia gravis both diagnostically and to distinguish between under- or over-treatment with other anticholinesterases. It has also been used for the reversal of neuromuscular blockade in anaesthesia, and for the management of poisoning due to tetrodotoxin, a neuromuscular blocking toxin found in puffer fish and other marine animals. beilstein:3905622|cas:312-48-1|drugbank:DB01010|drugcentral:988|kegg.compound:C06976|lincs.smallmolecule:LSM-5867|pdb-ccd:EDR|pubmed:7488499 Graph (3-hydroxyphenyl)dimethylethylammonium|3-hydroxy-N,N-dimethyl-N-ethylanilinium|EDROPHONIUM|EDROPHONIUM ION|Edrophonium|Ethyl-(3-hydroxy-phenyl)-dimethyl-ammonium|N-ethyl-3-hydroxy-N,N-dimethylanilinium|N-ethyl-3-hydroxy-N,N-dimethylbenzenaminium|edrophonium N-ethyl-3-hydroxy-N,N-dimethylanilinium (3-hydroxyphenyl)dimethylethylammonium|3-hydroxy-N,N-dimethyl-N-ethylanilinium|EDROPHONIUM|EDROPHONIUM ION|Edrophonium|Ethyl-(3-hydroxy-phenyl)-dimethyl-ammonium|N-ethyl-3-hydroxy-N,N-dimethylanilinium|N-ethyl-3-hydroxy-N,N-dimethylbenzenaminium|edrophonium http://purl.obolibrary.org/obo/CHEBI_251408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:251412 biolink:ChemicalEntity adinazolam A triazolo[4,3-a][1,4]benzodiazepine having a dimethylaminomethyl group at the 1-position, a phenyl group at the 6-position and a chloro substituent at the 8-position. beilstein:577108|cas:37115-32-5|drugbank:DB00546|drugcentral:93|kegg.drug:D02770|patent:DE2201210|patent:GB1393256|patent:US4250094 Graph 1-(8-chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl)-N,N-dimethylmethanamine|8-Chloro-1-((dimethylamino)methyl)-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine|adinazolam|adinazolamum 1-(8-chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl)-N,N-dimethylmethanamine 1-(8-chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl)-N,N-dimethylmethanamine|8-Chloro-1-((dimethylamino)methyl)-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine|adinazolam|adinazolamum http://purl.obolibrary.org/obo/CHEBI_251412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25143 biolink:ChemicalEntity maltose phosphate Graph maltose phosphates maltose phosphates http://purl.obolibrary.org/obo/CHEBI_25143 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25147 biolink:ChemicalEntity mandelate beilstein:3905858|beilstein:4135334|cas:769-61-9|gmelin:328159 Graph 2-hydroxy-2-(4-hydroxyphenyl)acetate|alpha-hydroxybenzeneacetate|alpha-hydroxybenzeneacetic acid, ion(1-)|hydroxy(phenyl)acetate|mandelate|mandelate ion hydroxy(phenyl)acetate 2-hydroxy-2-(4-hydroxyphenyl)acetate|alpha-hydroxybenzeneacetate|alpha-hydroxybenzeneacetic acid, ion(1-)|hydroxy(phenyl)acetate|mandelate|mandelate ion http://purl.obolibrary.org/obo/CHEBI_25147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25150 biolink:ChemicalEntity prunasin beilstein:9142960|cas:138-53-4|pubmed:30027801|pubmed:30445872|pubmed:32618500|pubmed:33328455 Graph (beta-D-glucopyranosyloxy)(phenyl)acetonitrile|D,L-mandelonitrile-beta-D-glucoside|alpha-(beta-D-glucopyranosyloxy)benzeneacetonitrile|mandelonitrile beta-D-glucopyranoside|mandelonitrile beta-D-glucoside|mandelonitrile glucoside|prulaurasin|prunasin (beta-D-glucopyranosyloxy)(phenyl)acetonitrile (beta-D-glucopyranosyloxy)(phenyl)acetonitrile|D,L-mandelonitrile-beta-D-glucoside|alpha-(beta-D-glucopyranosyloxy)benzeneacetonitrile|mandelonitrile beta-D-glucopyranoside|mandelonitrile beta-D-glucoside|mandelonitrile glucoside|prulaurasin|prunasin http://purl.obolibrary.org/obo/CHEBI_25150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25154 biolink:ChemicalEntity manganese molecular entity Graph manganese compounds|manganese molecular entities|manganese molecular entity manganese compounds|manganese molecular entities|manganese molecular entity http://purl.obolibrary.org/obo/CHEBI_25154 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25155 biolink:ChemicalEntity manganese cation Graph manganese cation|manganese cations manganese cation manganese cation|manganese cations http://purl.obolibrary.org/obo/CHEBI_25155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25165 biolink:ChemicalEntity mannosamine phosphate Graph mannosamine phosphate|mannosamine phosphates mannosamine phosphate|mannosamine phosphates http://purl.obolibrary.org/obo/CHEBI_25165 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25166 biolink:ChemicalEntity mannosamine Graph mannosamines mannosamines http://purl.obolibrary.org/obo/CHEBI_25166 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25167 biolink:ChemicalEntity mannosaminolactone Graph mannosaminolactones mannosaminolactones http://purl.obolibrary.org/obo/CHEBI_25167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25168 biolink:ChemicalEntity mannosylinositol phosphorylceramide A class of complex phosphoglycosphingolipids with a mannose-inositol-P head group. As with other ceramide derivatives, substituents R1 and R2 vary with different sphingoid bases and fatty acyl moieties. pubmed:7957179 Graph mannosylinositol phosphorylceramides mannosylinositol phosphorylceramides http://purl.obolibrary.org/obo/CHEBI_25168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25169 biolink:ChemicalEntity mannoside Graph mannoside|mannosides mannoside|mannosides http://purl.obolibrary.org/obo/CHEBI_25169 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25174 biolink:ChemicalEntity mannooligosaccharide An oligosaccharide comprised of mannose residues. Graph mannooligosaccharides mannooligosaccharides http://purl.obolibrary.org/obo/CHEBI_25174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25175 biolink:ChemicalEntity mannuronates Graph mannuronate mannuronate http://purl.obolibrary.org/obo/CHEBI_25175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25176 biolink:ChemicalEntity mannuronic acid Graph http://purl.obolibrary.org/obo/CHEBI_25176 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25179 biolink:ChemicalEntity melanins Melanin is a class of polyphenol compounds, which mainly serve as pigments in plants, animals and protists. The most common biological form is eumelanin. cas:8049-97-6|hmdb:HMDB0004068|kegg.compound:C05606|metacyc.compound:MELANIN|pubmed:10471651|pubmed:11180945|pubmed:11580175|pubmed:11580176|pubmed:11936269|pubmed:12859618|pubmed:14561553|pubmed:15037924|pubmed:15654979|pubmed:15710333|pubmed:16127932|pubmed:16388960|pubmed:16822060|pubmed:2474282|pubmed:2705868|pubmed:8833318|pubmed:8881670|pubmed:9417788|pubmed:9521433|pubmed:9649719|pubmed:9764853|wikipedia.en:Melanin Graph Melanin|melanins Melanin|melanins http://purl.obolibrary.org/obo/CHEBI_25179 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25185 biolink:ChemicalEntity menaquinones Any prenylnaphthoquinone having a prenyl or polyprenyl group at position 3 and a methyl group at position 2 on the naphthoquinone ring. Graph http://purl.obolibrary.org/obo/CHEBI_25185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25186 biolink:ChemicalEntity p-menthane monoterpenoid Graph p-menthane monoterpenoids p-menthane monoterpenoids http://purl.obolibrary.org/obo/CHEBI_25186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25187 biolink:ChemicalEntity p-menthan-3-ol Any secondary alcohol that is one of the eight possible diastereoisomers of 5-methyl-2-(propan-2-yl)cyclohexan-1-ol. Graph http://purl.obolibrary.org/obo/CHEBI_25187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25189 biolink:ChemicalEntity 1,4-dimercaptobutane-2,3-diol A glycol that is butane-2,3-diol in which a hydrogen from each of the methyl groups is replaced by a thiol group. beilstein:8141671|cas:7634-42-6 Graph 1,4-dimercapto-2,3-butanediol|1,4-dimercaptobutane-2,3-diol|1,4-disulfanylbutane-2,3-diol 1,4-disulfanylbutane-2,3-diol 1,4-dimercapto-2,3-butanediol|1,4-dimercaptobutane-2,3-diol|1,4-disulfanylbutane-2,3-diol http://purl.obolibrary.org/obo/CHEBI_25189 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25195 biolink:ChemicalEntity mercury atom cas:7439-97-6|webelements:Hg Graph 80Hg|Hg|Quecksilber|azogue|hydrargyrum|liquid silver|mercure|mercurio|mercury|quicksilver mercury 80Hg|Hg|Quecksilber|azogue|hydrargyrum|liquid silver|mercure|mercurio|mercury|quicksilver http://purl.obolibrary.org/obo/CHEBI_25195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25196 biolink:ChemicalEntity mercury molecular entity Graph mercury compounds|mercury molecular entities mercury compounds|mercury molecular entities http://purl.obolibrary.org/obo/CHEBI_25196 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25197 biolink:ChemicalEntity mercury cation Graph mercury cations mercury cations http://purl.obolibrary.org/obo/CHEBI_25197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25212 biolink:ChemicalEntity metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. Graph metabolite|metabolites|primary metabolites|secondary metabolites metabolite metabolite|metabolites|primary metabolites|secondary metabolites http://purl.obolibrary.org/obo/CHEBI_25212 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25213 biolink:ChemicalEntity metal cation Graph a metal cation|metal cations a metal cation|metal cations http://purl.obolibrary.org/obo/CHEBI_25213 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25214 biolink:ChemicalEntity metal-sulfur cluster A metal-sulfur cluster is a unit comprising two or more metal atoms and bridging sulfur ligand(s). Graph metal-sulfur clusters|metallo-sulfur cluster metal-sulfur clusters|metallo-sulfur cluster http://purl.obolibrary.org/obo/CHEBI_25214 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25216 biolink:ChemicalEntity metalloporphyrin Graph metalloporphyrins|metaloporphyrins metalloporphyrins|metaloporphyrins http://purl.obolibrary.org/obo/CHEBI_25216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25218 biolink:ChemicalEntity methacrylate A monocarboxylic acid anion that is obtained by removal of a proton from the carboxylic acid group of methacrylic acid. cas:18358-13-9|gmelin:324367|reaxys:3587577|umbbd.compound:c0520 Graph 2-methyl-2-propenoate|2-methyl-2-propenoic acid, ion(1-)|2-methylprop-2-enoate|methacrylate|methacrylate anion|methacrylate(1-) 2-methylprop-2-enoate 2-methyl-2-propenoate|2-methyl-2-propenoic acid, ion(1-)|2-methylprop-2-enoate|methacrylate|methacrylate anion|methacrylate(1-) http://purl.obolibrary.org/obo/CHEBI_25218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25219 biolink:ChemicalEntity methacrylic acid An α,β-unsaturated monocarboxylic acid that is acrylic acid in which the hydrogen at position 2 is substituted by a methyl group. cas:79-41-4|gmelin:49631|pubmed:24227222|pubmed:24398912|reaxys:1719937|wikipedia.en:Methacrylic_acid Graph 2-Methylpropensaeure|2-methyl-2-propenoic acid|2-methylacrylic acid|2-methylenepropionic acid|2-methylprop-2-enoic acid|2-methylpropenoic acid|Methacrylsaeure|Methakrylsaeure|alpha-methacrylic acid|alpha-methylacrylic acid|methacrylic acid|methylacrylic acid 2-methylprop-2-enoic acid 2-Methylpropensaeure|2-methyl-2-propenoic acid|2-methylacrylic acid|2-methylenepropionic acid|2-methylprop-2-enoic acid|2-methylpropenoic acid|Methacrylsaeure|Methakrylsaeure|alpha-methacrylic acid|alpha-methylacrylic acid|methacrylic acid|methylacrylic acid http://purl.obolibrary.org/obo/CHEBI_25219 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25223 biolink:ChemicalEntity methanesulfonate ester An organosulfonic ester resulting from the formal condensation of methanesulfonic acid with the hydroxy group of an alcohol, phenol, heteroarenol, or enol. Graph mesylate ester|mesylate esters|methanesulfonic acid esters mesylate ester|mesylate esters|methanesulfonic acid esters http://purl.obolibrary.org/obo/CHEBI_25223 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25224 biolink:ChemicalEntity methanesulfonate A 1,1-diunsubstituted alkanesulfonate that is the conjugate base of methanesulfonic acid. metacyc.compound:CPD-3746|umbbd.compound:c0347 Graph methanesulfonate|methylsulfonate methanesulfonate methanesulfonate|methylsulfonate http://purl.obolibrary.org/obo/CHEBI_25224 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25230 biolink:ChemicalEntity methionine derivative An amino acid derivative resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of methionine by a heteroatom. The definition normally excludes peptides containing methionine residues. Graph methionine derivatives methionine derivatives http://purl.obolibrary.org/obo/CHEBI_25230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25235 biolink:ChemicalEntity monomethoxybenzene Compounds containing a benzene skeleton substituted with one methoxy group. Graph monomethoxybenzenes monomethoxybenzenes http://purl.obolibrary.org/obo/CHEBI_25235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25236 biolink:ChemicalEntity methoxybenzoate Graph methoxybenzoates methoxybenzoates http://purl.obolibrary.org/obo/CHEBI_25236 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25238 biolink:ChemicalEntity methoxybenzoic acid Any benzoic acid carrying one or more methoxy substituents. Graph methoxybenzoic acids methoxybenzoic acids http://purl.obolibrary.org/obo/CHEBI_25238 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2524 biolink:ChemicalEntity ajmalicine A monoterpenoid indole alkaloid with formula C21H24N2O3, isolated from several Rauvolfia and Catharanthus species. It is a selective α1-adrenoceptor antagonist used for the treatment of high blood pressure. cas:483-04-5|kegg.compound:C09024|kegg.drug:D08470|knapsack:C00001678|lincs.smallmolecule:LSM-15373|pdb-ccd:AJN|pubmed:15930738|pubmed:19151732|pubmed:22331368|pubmed:22332772|pubmed:24237015|pubmed:25555909|pubmed:26983347|pubmed:27584856|pubmed:4387608|pubmed:6091834|pubmed:6128043|reaxys:97268|wikipedia.en:Ajmalicine Graph (19alpha)-16,17-didehydro-19-methyl-oxayohimban-16-carboxylic acid methyl ester|Circolene|Cristanyl|Duxil|Lamuran|Sarpan|ajmalicin|ajmalicine|delta-yohimbine|methyl (19alpha)-19-methyl-16,17-didehydro-18-oxayohimban-16-carboxylate|methyl (4S,4aR,13bS,14aS)-4-methyl-4a,5,7,8,13,13b,14,14a-octahydro-4H-indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylate|raubasine methyl (19alpha)-19-methyl-16,17-didehydro-18-oxayohimban-16-carboxylate (19alpha)-16,17-didehydro-19-methyl-oxayohimban-16-carboxylic acid methyl ester|Circolene|Cristanyl|Duxil|Lamuran|Sarpan|ajmalicin|ajmalicine|delta-yohimbine|methyl (19alpha)-19-methyl-16,17-didehydro-18-oxayohimban-16-carboxylate|methyl (4S,4aR,13bS,14aS)-4-methyl-4a,5,7,8,13,13b,14,14a-octahydro-4H-indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylate|raubasine http://purl.obolibrary.org/obo/CHEBI_2524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25240 biolink:ChemicalEntity methoxyflavanone A member of the class of flavanones that consists of flavanone with one or more methoxy substituents. Graph methoxyflavanones methoxyflavanones http://purl.obolibrary.org/obo/CHEBI_25240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25241 biolink:ChemicalEntity methoxyflavone Any member of the class of flavones with at least one methoxy substituent. Graph methoxyflavones methoxyflavones http://purl.obolibrary.org/obo/CHEBI_25241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25248 biolink:ChemicalEntity methyl ester Any carboxylic ester resulting from the formal condensation of a carboxy group with methanol. Graph carboxylic acid methyl ester|carboxylic acid methyl esters carboxylic acid methyl ester|carboxylic acid methyl esters http://purl.obolibrary.org/obo/CHEBI_25248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25253 biolink:ChemicalEntity methyl halides A haloalkane that is methane in which one of the hydrogens is substituted by a halide atom. pubmed:19378995 Graph http://purl.obolibrary.org/obo/CHEBI_25253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25255 biolink:ChemicalEntity methyl methanesulfonate A methanesulfonate ester resulting from the formal condensation of methanesulfonic acid with methanol. cas:66-27-3|kegg.compound:C19181|metacyc.compound:CPD-7038|pubmed:11016630|pubmed:14761437|pubmed:16764919|pubmed:21353429|pubmed:21860482|pubmed:22907509|pubmed:23117069|pubmed:23384783|pubmed:23483329|reaxys:1098586|wikipedia.en:Methyl_methanesulfonate Graph CB1540|MMS|Methanesulfonic acid methyl ester|Methyl mesylate|as-Dimethyl sulfite|methyl methanesulfonate methyl methanesulfonate CB1540|MMS|Methanesulfonic acid methyl ester|Methyl mesylate|as-Dimethyl sulfite|methyl methanesulfonate http://purl.obolibrary.org/obo/CHEBI_25255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25263 biolink:ChemicalEntity methyl D-galactoside Graph methyl D-galactoside|methyl D-galactosides methyl D-galactoside|methyl D-galactosides http://purl.obolibrary.org/obo/CHEBI_25263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25264 biolink:ChemicalEntity methyl-L-alanine Any alanine derivative that is L-alanine having one or more methyl groups attached to the amino group. Graph http://purl.obolibrary.org/obo/CHEBI_25264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25268 biolink:ChemicalEntity methyl-L-methionine A L-methionine derivative carrying methyl substituents at the N or S atom. Graph methyl-L-methionines methyl-L-methionines http://purl.obolibrary.org/obo/CHEBI_25268 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25270 biolink:ChemicalEntity methyl myo-inositols A cyclitol that is myo-inositol in which one of the alcoholic hydrogens is substituted by a methyl group. Graph methyl-myo-inositol methyl-myo-inositol http://purl.obolibrary.org/obo/CHEBI_25270 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25271 biolink:ChemicalEntity methyl-branched fatty acyl-CoA A branched-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of any methyl-branched fatty acid. Graph methyl-FA-CoA|methyl-FA-coenzyme A|methyl-branched fatty acyl-coenzyme A|methyl-fatty acyl-CoA|methyl-substituted fatty acyl-CoA|methyl-substituted fatty acyl-coenzyme A methyl-FA-CoA|methyl-FA-coenzyme A|methyl-branched fatty acyl-coenzyme A|methyl-fatty acyl-CoA|methyl-substituted fatty acyl-CoA|methyl-substituted fatty acyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_25271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25272 biolink:ChemicalEntity methyladenine Any member of the class of 6-aminopurines that is adenine bearing a single methyl substituent. Graph methyladenines methyladenines http://purl.obolibrary.org/obo/CHEBI_25272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25273 biolink:ChemicalEntity methyladenosine chemspider:8054502 Graph methyladenosines methyladenosines http://purl.obolibrary.org/obo/CHEBI_25273 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25274 biolink:ChemicalEntity methylamines Graph methylated amines methylated amines http://purl.obolibrary.org/obo/CHEBI_25274 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25275 biolink:ChemicalEntity methylaniline A substituted aniline carrying one or more methyl groups at unspecified positions. Graph methylanilines methylanilines http://purl.obolibrary.org/obo/CHEBI_25275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25280 biolink:ChemicalEntity methylbenzoic acid Graph methylbenzoic acids methylbenzoic acids http://purl.obolibrary.org/obo/CHEBI_25280 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25282 biolink:ChemicalEntity methylbutanal Any member of the class of butanals carrying a methyl substituent at an unspecified position. Graph methylbutanals methylbutanals http://purl.obolibrary.org/obo/CHEBI_25282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25286 biolink:ChemicalEntity methylbutanoyl-CoA Any member of the class of butanoyl-CoAs having methylbutanoyl as the acyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25286 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25289 biolink:ChemicalEntity methylcatechol Any member of the class of catechols carrying one or more methyl substituents. Graph methylcatechols methylcatechols http://purl.obolibrary.org/obo/CHEBI_25289 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25294 biolink:ChemicalEntity methylcytidine Any member of the class of cytidines that is cytidine substituted by at least one methyl group. Graph methylcytidines methylcytidines http://purl.obolibrary.org/obo/CHEBI_25294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25297 biolink:ChemicalEntity methylenetetrahydrofolic acid Graph methylenetetrahydrofolate|methylenetetrahydrofolates methylenetetrahydrofolate|methylenetetrahydrofolates http://purl.obolibrary.org/obo/CHEBI_25297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25302 biolink:ChemicalEntity methyl glycoside Graph methyl glycoside|methyl glycosides|methylglycosides methyl glycoside|methyl glycosides|methylglycosides http://purl.obolibrary.org/obo/CHEBI_25302 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25305 biolink:ChemicalEntity methylguanine A 2-aminopurine that is guanine bearing a single methyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25305 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25307 biolink:ChemicalEntity methylguanosine Any guanosine carrying one or more methyl substituents. Graph methylguanosines methylguanosines http://purl.obolibrary.org/obo/CHEBI_25307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25311 biolink:ChemicalEntity methylisocitric acid A tricarboxylic acid that is isocitric acid substituted by a methyl group α- to one of the carboxylic acid groups. Graph 3-hydroxybutane-1,2,3-tricarboxylic acid 3-hydroxybutane-1,2,3-tricarboxylic acid http://purl.obolibrary.org/obo/CHEBI_25311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25322 biolink:ChemicalEntity methylmercury compound An alkylmercury compound in which the alkyl group specified is methyl. Graph methylmercury compounds methylmercury compounds http://purl.obolibrary.org/obo/CHEBI_25322 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25324 biolink:ChemicalEntity methylnaphthalenes Any naphthalene carrying one or more methyl substituents. Graph http://purl.obolibrary.org/obo/CHEBI_25324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25336 biolink:ChemicalEntity methylpropanoyl-CoA A propanoyl-CoA substituted by a methyl group on the propanoyl side chain. Graph methylpropanoyl-CoAs methylpropanoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_25336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25340 biolink:ChemicalEntity methylpyridines Any member of the class of pyridines that carries at least one methyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25345 biolink:ChemicalEntity methyltetrahydrofolate A group of heterocyclic compounds based on the N-methylated 5,6,7,8-tetrahydropteroic acid skeleton conjugated with one or more L-glutamic acid or L-glutamate units. Graph methyltetrahydrofolates methyltetrahydrofolates http://purl.obolibrary.org/obo/CHEBI_25345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25347 biolink:ChemicalEntity methyluridine A uridine bearing one or more methyl substituents. Graph methyluridines methyluridines http://purl.obolibrary.org/obo/CHEBI_25347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25348 biolink:ChemicalEntity methylxanthine Graph methylxanthines methylxanthines http://purl.obolibrary.org/obo/CHEBI_25348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25350 biolink:ChemicalEntity mevalonate A racemate composed of equimolar amounts of (R)- and (S)-mevalonate. reaxys:4383181 Graph (+-)-mevalonate|(RS)-mevalonate|RS-mevalonate|mevalonic acid anion|rac-3,5-dihydroxy-3-methylpentanoate|rac-mevalonate|racemic mevalonate rac-3,5-dihydroxy-3-methylpentanoate (+-)-mevalonate|(RS)-mevalonate|RS-mevalonate|mevalonic acid anion|rac-3,5-dihydroxy-3-methylpentanoate|rac-mevalonate|racemic mevalonate http://purl.obolibrary.org/obo/CHEBI_25350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25351 biolink:ChemicalEntity mevalonic acid A racemate composed of equimolar amounts of (R)- and (S)-mevalonic acid. cas:150-97-0|hmdb:HMDB0000227|pubmed:10369261|pubmed:10647065|pubmed:10947201|pubmed:11521206|pubmed:12031835|pubmed:12872277|pubmed:1653652|pubmed:22770225|pubmed:2702744|pubmed:3012338|pubmed:32004772|pubmed:35840187|pubmed:36247639|pubmed:5683362|pubmed:6236250|pubmed:6263908|pubmed:6565710|pubmed:6610447|pubmed:6953445|pubmed:8747489|reaxys:1722595|wikipedia.en:Mevalonic_acid Graph (+-)-2,4-dideoxy-3-C-methylpentonic acid|(+-)-3,5-dihydroxy-3-methylvaleric acid|(+-)-MVA|(+-)-mevalonic acid|(3RS)-mevalonic acid|(RS)-mevalonic acid|DL-mevalonic acid|RS-mevalonic acid|rac-3,5-dihydroxy-3-methylpentanoic acid|rac-MVA|rac-mevalonic acid|racemic mevalonic acid rac-3,5-dihydroxy-3-methylpentanoic acid (+-)-2,4-dideoxy-3-C-methylpentonic acid|(+-)-3,5-dihydroxy-3-methylvaleric acid|(+-)-MVA|(+-)-mevalonic acid|(3RS)-mevalonic acid|(RS)-mevalonic acid|DL-mevalonic acid|RS-mevalonic acid|rac-3,5-dihydroxy-3-methylpentanoic acid|rac-MVA|rac-mevalonic acid|racemic mevalonic acid http://purl.obolibrary.org/obo/CHEBI_25351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25354 biolink:ChemicalEntity mineralocorticoid Mineralocorticoids are a class of steroid hormones that regulate water and electrolyte metabolism. Graph mineralocorticoids mineralocorticoids http://purl.obolibrary.org/obo/CHEBI_25354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25355 biolink:ChemicalEntity mitochondrial respiratory-chain inhibitor Graph mitochondrial electron transport chain inhibitors|mitochondrial electron-transport chain inhibitor|mitochondrial respiratory chain inhibitors mitochondrial electron transport chain inhibitors|mitochondrial electron-transport chain inhibitor|mitochondrial respiratory chain inhibitors http://purl.obolibrary.org/obo/CHEBI_25355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25357 biolink:ChemicalEntity mitomycin A family of aziridine-containing natural products isolated from Streptomyces caespitosus or Streptomyces lavendulae. pubmed:19777135|wikipedia.en:Mitomycin Graph mitomycins mitomycins http://purl.obolibrary.org/obo/CHEBI_25357 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25362 biolink:ChemicalEntity elemental molecule A molecule all atoms of which have the same atomic number. Graph homoatomic molecule|homoatomic molecules homoatomic molecule|homoatomic molecules http://purl.obolibrary.org/obo/CHEBI_25362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25367 biolink:ChemicalEntity molecule Any polyatomic entity that is an electrically neutral entity consisting of more than one atom. Graph Molekuel|molecula|molecule|molecules|neutral molecular compounds Molekuel|molecula|molecule|molecules|neutral molecular compounds http://purl.obolibrary.org/obo/CHEBI_25367 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25370 biolink:ChemicalEntity molybdenum molecular entity Graph molybdenum compounds|molybdenum molecular entities molybdenum compounds|molybdenum molecular entities http://purl.obolibrary.org/obo/CHEBI_25370 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25371 biolink:ChemicalEntity molybdic acid cas:7782-91-4|gmelin:26071 Graph H2MoO4|[MoO2(OH)2]|dihydroxidodioxidomolybdenum|molybdic acid|molybdic(VI) acid dihydroxidodioxidomolybdenum H2MoO4|[MoO2(OH)2]|dihydroxidodioxidomolybdenum|molybdic acid|molybdic(VI) acid http://purl.obolibrary.org/obo/CHEBI_25371 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25372 biolink:ChemicalEntity molybdopterin cofactor A molybdopterin to which a metal or metal oxide is coordinated, and that acts as a prosthetic group. Graph molybdopterin cofactors molybdopterin cofactors http://purl.obolibrary.org/obo/CHEBI_25372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25375 biolink:ChemicalEntity monoamine molecular messenger A group of neurotransmitters and neuromodulators that contain one amino group that is connected to an aromatic ring by ethylene group (‒CH2‒CH2‒). Monoamines are derived from the aromatic amino acids phenylalanine, tyrosine, histidine and tryptophan. Graph monamines|monoamines monamines|monoamines http://purl.obolibrary.org/obo/CHEBI_25375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25380 biolink:ChemicalEntity acetylenic fatty acid Any unsaturated fatty acid containing at least one triple bond in the carbon chain framework. Graph acetylenic FA|acetylenic FAs|acetylenic fatty acids|alkynic FA|alkynic FAs|alkynic fatty acid|alkynic fatty acids acetylenic FA|acetylenic FAs|acetylenic fatty acids|alkynic FA|alkynic FAs|alkynic fatty acid|alkynic fatty acids http://purl.obolibrary.org/obo/CHEBI_25380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25381 biolink:ChemicalEntity monoalkyl phosphate Graph monoalkyl phosphates monoalkyl phosphates http://purl.obolibrary.org/obo/CHEBI_25381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25384 biolink:ChemicalEntity monocarboxylic acid An oxoacid containing a single carboxy group. Graph monocarboxylic acids monocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_25384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25387 biolink:ChemicalEntity monohydroxyacetophenone A hydroxyacetophenone carrying a single hydroxy substituent. Graph monohydroxyacetophenones monohydroxyacetophenones http://purl.obolibrary.org/obo/CHEBI_25387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25388 biolink:ChemicalEntity monohydroxybenzoate A hydroxybenzoate carrying a single hydroxy substituent at unspecified position. Graph monohydroxybenzoates monohydroxybenzoates http://purl.obolibrary.org/obo/CHEBI_25388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25389 biolink:ChemicalEntity monohydroxybenzoic acid Any hydroxybenzoic acid having a single phenolic hydroxy substituent on the benzene ring. Graph monohydroxybenzoic acids monohydroxybenzoic acids http://purl.obolibrary.org/obo/CHEBI_25389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25392 biolink:ChemicalEntity naphthols Any hydroxynaphthalene derivative that has a single hydroxy substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25399 biolink:ChemicalEntity cresol A hydroxytoluene that consists of toluene carrying a single hydroxy substituent at any position. A 'closed class'. cas:1319-77-3|pesticides:cresol|wikipedia.en:Cresol Graph Hydroxytoluole|Kresol|Kresole|acide cresylique|cresol|cresols|cresylic acid|hydroxymethylbenzene|hydroxytoluene|methylphenol|mixed cresols methylphenol Hydroxytoluole|Kresol|Kresole|acide cresylique|cresol|cresols|cresylic acid|hydroxymethylbenzene|hydroxytoluene|methylphenol|mixed cresols http://purl.obolibrary.org/obo/CHEBI_25399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25400 biolink:ChemicalEntity monoiodotyrosine An iodotyrosine carrying a single iodo substituent. Graph monoiodotyrosines monoiodotyrosines http://purl.obolibrary.org/obo/CHEBI_25400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25401 biolink:ChemicalEntity monomethoxyflavone Any methoxyflavone with a single methoxy substituent. Graph monomethoxyflavone|monomethoxyflavones monomethoxyflavone|monomethoxyflavones http://purl.obolibrary.org/obo/CHEBI_25401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25405 biolink:ChemicalEntity monophosphoglyceric acid A glyceric acid phosphate in which only one of the hydroxy groups has been phosphorylated. Graph monophosphoglyceric acid|monophosphoglyceric acids monophosphoglyceric acid|monophosphoglyceric acids http://purl.obolibrary.org/obo/CHEBI_25405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25408 biolink:ChemicalEntity monoterpene ketone A terpene ketone derived from a monoterpene. Graph monoterpene ketones monoterpene ketones http://purl.obolibrary.org/obo/CHEBI_25408 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25409 biolink:ChemicalEntity monoterpenoid Any terpenoid derived from a monoterpene. The term includes compounds in which the C10 skeleton of the parent monoterpene has been rearranged or modified by the removal of one or more skeletal atoms (generally methyl groups). lipidmaps_class:LMPR0102 Graph monoterpenoids monoterpenoids http://purl.obolibrary.org/obo/CHEBI_25409 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25411 biolink:ChemicalEntity monoterpenols kegg.compound:C00863 Graph monoterpenols monoterpenols http://purl.obolibrary.org/obo/CHEBI_25411 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25412 biolink:ChemicalEntity monoterpenyl phosphate Graph monoterpenyl phosphates monoterpenyl phosphates http://purl.obolibrary.org/obo/CHEBI_25412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25413 biolink:ChemicalEntity monounsaturated fatty acid Any fatty acid with one double or triple bond in the fatty acid chain and singly bonded carbon atoms in the rest of the chain. MUFAs have positive effects on the cardiovascular system, and in diabetes treatment. pubmed:10584045|pubmed:12936956 Graph MUFA|MUFAs|monounsaturated fatty acids MUFA|MUFAs|monounsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_25413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25414 biolink:ChemicalEntity monoatomic monocation Graph monoatomic monocations|monovalent inorganic cations monoatomic monocations|monovalent inorganic cations http://purl.obolibrary.org/obo/CHEBI_25414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25418 biolink:ChemicalEntity morphinane alkaloid An isoquinoline alkaloid based on a morphinan skeleton and its substituted derivatives. Graph morphinane alkaloids morphinane alkaloids http://purl.obolibrary.org/obo/CHEBI_25418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25422 biolink:ChemicalEntity muconate semialdehyde Graph muconate semialdehydes muconate semialdehydes http://purl.obolibrary.org/obo/CHEBI_25422 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25426 biolink:ChemicalEntity mugineic acid An azetidinecarboxylic acid that is the parent of the class of mugineic acids. cas:69199-37-7|kegg.compound:C15500|patent:KR20090078824|pubmed:21350950|reaxys:5884020 Graph 4-[(2S)-2-carboxyazetidin-1-yl]-N-[(3S)-3-carboxy-3-hydroxypropyl]-L-allothreonine|N-(3-(3-Carboxypropylamino)-2-hydroxy-3-carboxypropyl)azetidine-2-carboxylic acid 4-[(2S)-2-carboxyazetidin-1-yl]-N-[(3S)-3-carboxy-3-hydroxypropyl]-L-allothreonine 4-[(2S)-2-carboxyazetidin-1-yl]-N-[(3S)-3-carboxy-3-hydroxypropyl]-L-allothreonine|N-(3-(3-Carboxypropylamino)-2-hydroxy-3-carboxypropyl)azetidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_25426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25427 biolink:ChemicalEntity mugineic acids Graph MAs MAs http://purl.obolibrary.org/obo/CHEBI_25427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25430 biolink:ChemicalEntity monoatomic polycation Graph monoatomic polycations|multivalent inorganic cations monoatomic polycations|multivalent inorganic cations http://purl.obolibrary.org/obo/CHEBI_25430 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25432 biolink:ChemicalEntity muramic acids Graph http://purl.obolibrary.org/obo/CHEBI_25432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25435 biolink:ChemicalEntity mutagen An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution. wikipedia.en:Mutagen Graph mutagene|mutagenes|mutagenic agent|mutageno|mutagenos|mutagens mutagene|mutagenes|mutagenic agent|mutageno|mutagenos|mutagens http://purl.obolibrary.org/obo/CHEBI_25435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25437 biolink:ChemicalEntity mycolates Graph mycolates mycolates http://purl.obolibrary.org/obo/CHEBI_25437 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25438 biolink:ChemicalEntity mycolic acid Mycolic acids are α-branched, β-hydroxy long-chain fatty acids found in the cell walls of the mycolata taxon, a group of bacteria that includes Mycobacterium tuberculosis, the causative agent of the disease tuberculosis. pubmed:10844652|pubmed:11491525|pubmed:16341241|pubmed:1748873|pubmed:18312856|pubmed:18770604|pubmed:1954242|pubmed:20519644|pubmed:20875402|pubmed:2306483|pubmed:2777756|pubmed:3226228|pubmed:3700601|pubmed:6427401|pubmed:8466947|pubmed:9044265|wikipedia.en:Mycolic_acid Graph mycolic acids mycolic acids http://purl.obolibrary.org/obo/CHEBI_25438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2544 biolink:ChemicalEntity albanol A cas:87085-00-5|kegg.compound:C08738|knapsack:C00002392 Graph Albanol A|Mulberrofuran G Albanol A|Mulberrofuran G http://purl.obolibrary.org/obo/CHEBI_2544 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:25441 biolink:ChemicalEntity mycothiols Graph http://purl.obolibrary.org/obo/CHEBI_25441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25442 biolink:ChemicalEntity mycotoxin Poisonous substance produced by fungi. Graph fungal toxins|mycotoxins fungal toxins|mycotoxins http://purl.obolibrary.org/obo/CHEBI_25442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25443 biolink:ChemicalEntity myo-inositol bisphosphate Graph myo-inositol bisphosphates myo-inositol bisphosphates http://purl.obolibrary.org/obo/CHEBI_25443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25444 biolink:ChemicalEntity myo-inositol cyclic phosphate Graph myo-inositol cyclic phosphates myo-inositol cyclic phosphates http://purl.obolibrary.org/obo/CHEBI_25444 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25445 biolink:ChemicalEntity myo-inositol hexakisphosphates Graph http://purl.obolibrary.org/obo/CHEBI_25445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25446 biolink:ChemicalEntity myo-inositol monophosphate A myo-inositol phosphate that is myo-inositol in which one of the hydroxy groups is replaced by a phosphate group. A 'closed class'. Graph myo-inositol monophosphates myo-inositol monophosphates http://purl.obolibrary.org/obo/CHEBI_25446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25447 biolink:ChemicalEntity myo-inositol pentakisphosphate Graph myo-inositol pentakisphosphates myo-inositol pentakisphosphates http://purl.obolibrary.org/obo/CHEBI_25447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25448 biolink:ChemicalEntity myo-inositol phosphate An inositol phosphate in which the inositol component has myo-configuration. pubmed:1694860 Graph myo inositol phosphates|myo-inositol phosphate|myo-inositol phosphates myo inositol phosphates|myo-inositol phosphate|myo-inositol phosphates http://purl.obolibrary.org/obo/CHEBI_25448 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25449 biolink:ChemicalEntity myo-inositol tetrakisphosphate Graph myo-inositol tetrakisphosphates myo-inositol tetrakisphosphates http://purl.obolibrary.org/obo/CHEBI_25449 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25450 biolink:ChemicalEntity myo-inositol trisphosphate Graph myo-inositol trisphosphates myo-inositol trisphosphates http://purl.obolibrary.org/obo/CHEBI_25450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25455 biolink:ChemicalEntity myristoyl amino acid Graph myristoyl amino acids myristoyl amino acids http://purl.obolibrary.org/obo/CHEBI_25455 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25458 biolink:ChemicalEntity myrtenal cas:23727-16-4|kegg.compound:C11939|umbbd.compound:c0632 Graph 7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enecarboxaldehyde|7,7-dimethylbicyclo[3.1.1]hept-3-ene-4-carbaldehyde|Myrtenal|myrtenal 7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enecarboxaldehyde|7,7-dimethylbicyclo[3.1.1]hept-3-ene-4-carbaldehyde|Myrtenal|myrtenal http://purl.obolibrary.org/obo/CHEBI_25458 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25460 biolink:ChemicalEntity myrtenol cas:515-00-4|kegg.compound:C11938|umbbd.compound:c0630 Graph (7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methanol|2-Pinen-10-ol|Myrtenol|myrtenol (7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methanol|2-Pinen-10-ol|Myrtenol|myrtenol http://purl.obolibrary.org/obo/CHEBI_25460 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25461 biolink:ChemicalEntity myxothiazol A 2,4'-bi-1,3-thiazole substituted at the 4-position with a (1E,3S,4R,5E)-7-amino-3,5-dimethoxy-4-methyl-7-oxohepta-1,5-dien-1-yl] group and at the 2'-position with a (2S,3E,5E)-7-methylocta-3,5-dien-2-yl group. It is an inhibitor of coenzyme Q - cytochrome c reductase. cas:76706-55-3|drugbank:DB04741|kegg.compound:C15674|knapsack:C00018319|metacyc.compound:CPD0-1244|pdb-ccd:MYX|pubmed:10853768|pubmed:11134965|pubmed:11237706|pubmed:12176058|pubmed:15312779|pubmed:16081299|pubmed:18221415|pubmed:24414973|pubmed:24661880|pubmed:2753821|pubmed:2846049|pubmed:29402945|pubmed:31079230|pubmed:6274398|pubmed:6752659|pubmed:7247372|pubmed:7271921|wikipedia.en:Myxothiazol Graph (+)-myxothiazol|(+)-myxothiazol A|(2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-{2'-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl][2,4'-bi-1,3-thiazol]-4-yl}hepta-2,6-dienamide|Myxothiazol A (2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-{2'-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl][2,4'-bi-1,3-thiazol]-4-yl}hepta-2,6-dienamide (+)-myxothiazol|(+)-myxothiazol A|(2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-{2'-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl][2,4'-bi-1,3-thiazol]-4-yl}hepta-2,6-dienamide|Myxothiazol A http://purl.obolibrary.org/obo/CHEBI_25461 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25471 biolink:ChemicalEntity naphthalenemonosulfonate Graph naphthalene monosulfonates|naphthalenemonosulfonates naphthalene monosulfonates|naphthalenemonosulfonates http://purl.obolibrary.org/obo/CHEBI_25471 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25477 biolink:ChemicalEntity naphthalenes Any benzenoid aromatic compound having a skeleton composed of two ortho-fused benzene rings. Graph http://purl.obolibrary.org/obo/CHEBI_25477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25478 biolink:ChemicalEntity naphthalenesulfonate Graph naphthalenesulfonates naphthalenesulfonates http://purl.obolibrary.org/obo/CHEBI_25478 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25479 biolink:ChemicalEntity naphthalenone Any naphthalene that is carrying at least one oxo substituent. Graph naphthalenones naphthalenones http://purl.obolibrary.org/obo/CHEBI_25479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25481 biolink:ChemicalEntity naphthoquinone A polycyclic aromatic ketone metabolite of naphthalene. Graph naphthoquinones naphthoquinones http://purl.obolibrary.org/obo/CHEBI_25481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25482 biolink:ChemicalEntity naphthoate Graph naphthalenecarboxylate naphthalenecarboxylate naphthalenecarboxylate http://purl.obolibrary.org/obo/CHEBI_25482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25483 biolink:ChemicalEntity naphthoic acid An aromatic carboxylic acid that consists of a naphthalene skeleton substituted by one or more carboxy groups. Graph naphthalenecarboxylic acid naphthalenecarboxylic acid naphthalenecarboxylic acid http://purl.obolibrary.org/obo/CHEBI_25483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2549 biolink:ChemicalEntity albuterol A member of the class of phenylethanolamines that is 4-(2-amino-1-hydroxyethyl)-2-(hydroxymethyl)phenol having a tert-butyl group attached to the nirogen atom. It acts as a β-adrenergic agonist used in the treatment of asthma and chronic obstructive pulmonary disease (COPD). cas:18559-94-9|drugbank:DB01001|drugcentral:105|hmdb:HMDB0001937|kegg.drug:D02147|lincs.smallmolecule:LSM-5178|pubmed:8267204|pubmed:9847435|reaxys:2213614|wikipedia.en:Albuterol Graph 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol|Albuterol|Proventil|Salbutamol 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol|Albuterol|Proventil|Salbutamol http://purl.obolibrary.org/obo/CHEBI_2549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25491 biolink:ChemicalEntity nematicide A substance used to destroy pests of the phylum Nematoda (roundworms). wikipedia.en:Nematicide Graph nematicides|nematocide|nematocides nematicides|nematocide|nematocides http://purl.obolibrary.org/obo/CHEBI_25491 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25495 biolink:ChemicalEntity neohesperidoside A glycoside containing α-L-rhamnopyranosyl-(1→2)-β-D-glucopyranosyl residue as the sugar unit. Graph neohesperidoside|neohesperidosides neohesperidoside|neohesperidosides http://purl.obolibrary.org/obo/CHEBI_25495 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25500 biolink:ChemicalEntity neopterins Graph http://purl.obolibrary.org/obo/CHEBI_25500 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25501 biolink:ChemicalEntity neoxanthin An epoxycarotenoid that is 6,7-didehydro-5,5',6,6'-tetrahydro-5',6'-epoxy-β,β-carotene which is substituted by hydroxy groups at the 3, 3', and 5 positions. cas:30743-41-0|kegg.compound:C08606|knapsack:C00003780 Graph all-trans-Neoxanthin all-trans-Neoxanthin http://purl.obolibrary.org/obo/CHEBI_25501 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25505 biolink:ChemicalEntity neuraminate A member of the class of neuraminates obtained by deprotonation of the carboxy group of keto-neuraminic acid. Graph 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate http://purl.obolibrary.org/obo/CHEBI_25505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25506 biolink:ChemicalEntity neuraminates Graph http://purl.obolibrary.org/obo/CHEBI_25506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25508 biolink:ChemicalEntity neuraminic acids Graph http://purl.obolibrary.org/obo/CHEBI_25508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25512 biolink:ChemicalEntity neurotransmitter An endogenous compound that is used to transmit information across the synapse between a neuron and another cell. wikipedia.en:Neurotransmitter Graph neurotransmitters neurotransmitters http://purl.obolibrary.org/obo/CHEBI_25512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25513 biolink:ChemicalEntity neutral glycosphingolipid Any glycosphingolipid containing unsubstituted glycosyl moieties. Graph neutral glycosphingolipids neutral glycosphingolipids http://purl.obolibrary.org/obo/CHEBI_25513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25516 biolink:ChemicalEntity nickel cation Graph Ni cation|nickel cation|nickel cations nickel cation Ni cation|nickel cation|nickel cations http://purl.obolibrary.org/obo/CHEBI_25516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25520 biolink:ChemicalEntity nicotianamine cas:34441-14-0 Graph 1-{3-[(3-amino-3-carboxypropyl)amino]-3-carboxypropyl}azetidine-2-carboxylic acid|N-(N-(3-amino-3-carboxypropyl)-3-amino-3-carboxypropyl)azetidine-2-carboxylic acid 1-{3-[(3-amino-3-carboxypropyl)amino]-3-carboxypropyl}azetidine-2-carboxylic acid 1-{3-[(3-amino-3-carboxypropyl)amino]-3-carboxypropyl}azetidine-2-carboxylic acid|N-(N-(3-amino-3-carboxypropyl)-3-amino-3-carboxypropyl)azetidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_25520 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25523 biolink:ChemicalEntity NADP Abbreviation for nicotinamide-adenine dinucleotide phosphate when its oxidation state is unknown or unspecified. Graph nicotinamide-adenine dinucleotide phosphate nicotinamide-adenine dinucleotide phosphate http://purl.obolibrary.org/obo/CHEBI_25523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25524 biolink:ChemicalEntity NAD(P) A coenzyme that may be NAD or NADP. Graph http://purl.obolibrary.org/obo/CHEBI_25524 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25526 biolink:ChemicalEntity N-glycosylnicotinamide Graph N-glycosylnicotinamides N-glycosylnicotinamides http://purl.obolibrary.org/obo/CHEBI_25526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25527 biolink:ChemicalEntity nicotinamide nucleotide Graph nicotinamide nucleotides nicotinamide nucleotides http://purl.obolibrary.org/obo/CHEBI_25527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25529 biolink:ChemicalEntity pyridinecarboxamide A member of the class of pyridines that is a substituted pyridine in which at least one of the substituents is a carboxamide or N-substituted caraboxamide group. Graph pyridinecarboxamides pyridinecarboxamides http://purl.obolibrary.org/obo/CHEBI_25529 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25533 biolink:ChemicalEntity N-glycosylnicotinate Graph N-glycosylnicotinates|nicotinate nucleosides N-glycosylnicotinates|nicotinate nucleosides http://purl.obolibrary.org/obo/CHEBI_25533 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25534 biolink:ChemicalEntity nicotinic acid nucleotide Graph nicotinic acid nucleotides nicotinic acid nucleotides http://purl.obolibrary.org/obo/CHEBI_25534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25540 biolink:ChemicalEntity neonicotinoid insectide A class of neuro-active insecticides that act at the nicotinic acetylcholine receptor. wikipedia.en:Neonicotinoid Graph neonicotinoid insectides|nicotinoid insectide|nicotinoid insectides neonicotinoid insectides|nicotinoid insectide|nicotinoid insectides http://purl.obolibrary.org/obo/CHEBI_25540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25548 biolink:ChemicalEntity nitrilotriacetate(3-) A tricarboxylic acid trianion resulting from the deprotonation of all three hydroxy groups of nitrilotriacetic acid. beilstein:3550639|cas:28528-44-1|gmelin:50722|umbbd.compound:c0557 Graph 2,2',2''-nitrilotriacetate|nitrilotriacetate|nitrilotriacetic acid ion(3-)|nta(3-) 2,2',2''-nitrilotriacetate 2,2',2''-nitrilotriacetate|nitrilotriacetate|nitrilotriacetic acid ion(3-)|nta(3-) http://purl.obolibrary.org/obo/CHEBI_25548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25549 biolink:ChemicalEntity nitrites Salts and esters of nitrous acid, HONO. Graph http://purl.obolibrary.org/obo/CHEBI_25549 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2555 biolink:ChemicalEntity aldicarb The oxime carbamate resulting from the addition of 2-methyl-2-(methylsulfanyl)propanaldoxime to methyl isocyanate. A member of the class of oxime carbamate insecticides, aldicarb is a mixture of E and Z isomers; it is not known which isomer is more active. beilstein:2046931|cas:116-06-3|kegg.compound:C11015|lincs.smallmolecule:LSM-20978|patent:US3217037|ppdb:19 Graph 2-Methyl-2-(methylthio)propanal, O-((methylamino)carbonyl)oxime|2-Methyl-2-(methylthio)propionaldehyde O-(methylcarbamoyl)oxime|2-Methyl-2-methylthio-propionaldehyd-O-(N-methyl-carbamoyl)-oxim|2-methyl-N-[(methylcarbamoyl)oxy]-2-(methylsulfanyl)propan-1-imine|Aldicarb|aldicarb|aldicarbe 2-methyl-N-[(methylcarbamoyl)oxy]-2-(methylsulfanyl)propan-1-imine 2-Methyl-2-(methylthio)propanal, O-((methylamino)carbonyl)oxime|2-Methyl-2-(methylthio)propionaldehyde O-(methylcarbamoyl)oxime|2-Methyl-2-methylthio-propionaldehyd-O-(N-methyl-carbamoyl)-oxim|2-methyl-N-[(methylcarbamoyl)oxy]-2-(methylsulfanyl)propan-1-imine|Aldicarb|aldicarb|aldicarbe http://purl.obolibrary.org/obo/CHEBI_2555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25550 biolink:ChemicalEntity nitroaniline A substituted aniline that carries one or more nitro groups. Graph nitroanilines nitroanilines http://purl.obolibrary.org/obo/CHEBI_25550 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25552 biolink:ChemicalEntity nitrobenzoate Graph nitrobenzoates nitrobenzoates http://purl.obolibrary.org/obo/CHEBI_25552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25553 biolink:ChemicalEntity nitrobenzoic acid Any member of the class of benzoic acids with at least one nitro substituent attached to the benzene ring. Graph nitrobenzoic acids nitrobenzoic acids http://purl.obolibrary.org/obo/CHEBI_25553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25555 biolink:ChemicalEntity nitrogen atom webelements:N Graph 7N|N|Stickstoff|azote|nitrogen|nitrogeno nitrogen 7N|N|Stickstoff|azote|nitrogen|nitrogeno http://purl.obolibrary.org/obo/CHEBI_25555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25558 biolink:ChemicalEntity organonitrogen heterocyclic antibiotic Graph organonitrogen heterocyclic antibiotics organonitrogen heterocyclic antibiotics http://purl.obolibrary.org/obo/CHEBI_25558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25560 biolink:ChemicalEntity nitroglycerol A nitrate ester that is glycerol in which nitro group(s) replace the hydrogen(s) attached to one or more of the hydroxy groups. Graph nitroglycerols nitroglycerols http://purl.obolibrary.org/obo/CHEBI_25560 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25562 biolink:ChemicalEntity nitrophenol Any member of the class of phenols or substituted phenols carrying at least 1 nitro group. Graph nitrophenols nitrophenols http://purl.obolibrary.org/obo/CHEBI_25562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25566 biolink:ChemicalEntity nitrotoluene Any member of the class of toluenes bearing one or more nitro substituents on the benzene ring. Graph http://purl.obolibrary.org/obo/CHEBI_25566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25567 biolink:ChemicalEntity nitrous acid cas:7782-77-6|gmelin:983|kegg.compound:C00088|pdb-ccd:NO2 Graph HNO2|[NO(OH)]|dioxonitric acid|hydrogen dioxonitrate(1-)|hydroxidooxidonitrogen|nitrosyl hydroxide|nitrous acid dioxonitric acid|hydrogen dioxonitrate(1-)|hydroxidooxidonitrogen|nitrous acid HNO2|[NO(OH)]|dioxonitric acid|hydrogen dioxonitrate(1-)|hydroxidooxidonitrogen|nitrosyl hydroxide|nitrous acid http://purl.obolibrary.org/obo/CHEBI_25567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25572 biolink:ChemicalEntity nocardicin Graph nocardicins nocardicins http://purl.obolibrary.org/obo/CHEBI_25572 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25575 biolink:ChemicalEntity nonadienedioate Graph nonadienedioates nonadienedioates http://purl.obolibrary.org/obo/CHEBI_25575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25576 biolink:ChemicalEntity nonadienedioic acid Graph nonadienedioic acids nonadienedioic acids http://purl.obolibrary.org/obo/CHEBI_25576 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25579 biolink:ChemicalEntity nonanone Any ketone that is nonane substituted by an oxo group at unspecified position. Graph nonanones nonanones http://purl.obolibrary.org/obo/CHEBI_25579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25582 biolink:ChemicalEntity nonaprenol Any polyprenol composed of at least nine isoprene units. Graph nonaprenols nonaprenols http://purl.obolibrary.org/obo/CHEBI_25582 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25585 biolink:ChemicalEntity nonmetal atom Graph Nichtmetall|Nichtmetalle|no metal|no metales|non-metal|non-metaux|nonmetal|nonmetals nonmetal Nichtmetall|Nichtmetalle|no metal|no metales|non-metal|non-metaux|nonmetal|nonmetals http://purl.obolibrary.org/obo/CHEBI_25585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2559 biolink:ChemicalEntity aldohexose 6-phosphate kegg.compound:C03251 Graph Aldohexose 6-phosphate Aldohexose 6-phosphate http://purl.obolibrary.org/obo/CHEBI_2559 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25591 biolink:ChemicalEntity norcoclaurine A benzylisoquinoline alkaloid based on a benzyltetrahydroisoquinoline skeleton. Graph norcoclaurines norcoclaurines http://purl.obolibrary.org/obo/CHEBI_25591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25604 biolink:ChemicalEntity nucleotide-(amino alcohol)s Graph http://purl.obolibrary.org/obo/CHEBI_25604 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25605 biolink:ChemicalEntity nucleoside antibiotic Graph nucleoside antibiotics nucleoside antibiotics http://purl.obolibrary.org/obo/CHEBI_25605 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25608 biolink:ChemicalEntity nucleoside phosphate A nucleobase-containing molecular entity that is a nucleoside in which one or more of the sugar hydroxy groups has been converted into a mono- or poly-phosphate. The term includes both nucleotides and non-nucleotide nucleoside phosphates. kegg.compound:C01329 Graph NMP|nucleoside phosphates NMP|nucleoside phosphates http://purl.obolibrary.org/obo/CHEBI_25608 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25609 biolink:ChemicalEntity nucleotide-sugar Graph nucleotide-sugar|nucleotide-sugars nucleotide-sugar|nucleotide-sugars http://purl.obolibrary.org/obo/CHEBI_25609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25614 biolink:ChemicalEntity nylons Graph nylons nylons http://purl.obolibrary.org/obo/CHEBI_25614 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25622 biolink:ChemicalEntity orthoquinones Any quinone in which the carbons of the two carbonyl groups in the quinone system are joined to each other by a single bond. Graph o-quinone|o-quinones|ortho-quinone|ortho-quinones|orthoquinone o-quinone|o-quinones|ortho-quinone|ortho-quinones|orthoquinone http://purl.obolibrary.org/obo/CHEBI_25622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25626 biolink:ChemicalEntity octadecadienoate A long-chain, unsaturated fatty acid anion formed by deprotonation of the carboxy group of any octadecadienoic acid; major species at pH 7.3. Graph octadecadienoate octadecadienoate octadecadienoate http://purl.obolibrary.org/obo/CHEBI_25626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25627 biolink:ChemicalEntity octadecadienoic acid Any straight-chain, C18 polyunsaturated fatty acid having two C=C double bonds. cas:26764-25-0|pubmed:6794350 Graph 18:2|C18:2|FA (18:2)|octadecadienoic acid octadecadienoic acid 18:2|C18:2|FA (18:2)|octadecadienoic acid http://purl.obolibrary.org/obo/CHEBI_25627 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25629 biolink:ChemicalEntity octadecanoate A fatty acid anion 18:0 that is the conjugate base of octadecanoic acid (stearic acid). Stearates have a variety of uses in the pharmaceutical industry. cas:646-29-7|gmelin:344065|kegg.compound:C01530|metacyc.compound:STEARIC_ACID|pubmed:16401590|pubmed:19184617|pubmed:3180776|pubmed:7452460|reaxys:3590530 Graph CH3-[CH2]16-COO(-)|Stearate|octadecanoate|octadecanoic acid, ion(1-)|stearate|stearic acid, ion(1-) octadecanoate CH3-[CH2]16-COO(-)|Stearate|octadecanoate|octadecanoic acid, ion(1-)|stearate|stearic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_25629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25633 biolink:ChemicalEntity octadecatrienoic acid Any trienoic fatty acid having eighteen carbons. Graph 18:3|C18:3|Octadecatriensaeure|octadecatrienoic acid octadecatrienoic acid 18:3|C18:3|Octadecatriensaeure|octadecatrienoic acid http://purl.obolibrary.org/obo/CHEBI_25633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25634 biolink:ChemicalEntity octadecenoic acid Any member of the group of C18 monounsaturated fatty acids with the double bond located at any position in the chain. pubmed:18832207|pubmed:19106329|pubmed:7276754 Graph octadecenoic acid octadecenoic acid octadecenoic acid http://purl.obolibrary.org/obo/CHEBI_25634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25635 biolink:ChemicalEntity octadecenynoic acid Any C18 polyunsaturated fatty acid containing one C=C and one C≡C bond. pubmed:4674505|pubmed:4676643 Graph octadecenynoic acid|octadecenynoic acids octadecenynoic acid octadecenynoic acid|octadecenynoic acids http://purl.obolibrary.org/obo/CHEBI_25635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25637 biolink:ChemicalEntity octadienoate Graph octadienoates octadienoates http://purl.obolibrary.org/obo/CHEBI_25637 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25639 biolink:ChemicalEntity octadienol A primary alcohol that is octanol consisting of two double bonds at unspecified positions. Graph octadienols octadienols http://purl.obolibrary.org/obo/CHEBI_25639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2564 biolink:ChemicalEntity aldrin An organochlorine compound resulting from the Diels-Alder reaction of hexachlorocyclopentadiene with norbornadiene. A proinsecticide (by epoxidation of the non-chlorinated double bond to give dieldrin), it was widely used as an insecticide before being banned in the 1970s as a persistent organic pollutant. cas:309-00-2|kegg.compound:C07552|patent:US2635977|patent:US2911447|pesticides:aldrin|ppdb:21|pubmed:18427830|pubmed:21724225|pubmed:26449612|pubmed:28101603|pubmed:28393264|reaxys:2336652|wikipedia.en:Aldrin Graph (1R,4S,4aS,5S,8R,8aR)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene|(1alpha,4alpha,4abeta,5alpha,8alpha,8abeta)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene|1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-endo-1,4-exo-5,8-dimethanonaphthalene|1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-exo-1,4-endo-5,8-dimethanonaphthalene|Compound 118|HHDN|aldrine (1R,4S,4aS,5S,8R,8aR)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene (1R,4S,4aS,5S,8R,8aR)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene|(1alpha,4alpha,4abeta,5alpha,8alpha,8abeta)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene|1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-endo-1,4-exo-5,8-dimethanonaphthalene|1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-exo-1,4-endo-5,8-dimethanonaphthalene|Compound 118|HHDN|aldrine http://purl.obolibrary.org/obo/CHEBI_2564 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25640 biolink:ChemicalEntity octamethylcyclotetrasiloxane A cyclosiloxane that is the octamethyl derivative of cyclotetrasiloxane. cas:556-67-2|gmelin:408865|pubmed:23200569|pubmed:24012894|pubmed:24279694|reaxys:1787074|umbbd.compound:c0578 Graph 2,2,4,4,6,6,8,8-octamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane|2,2,4,4,6,6,8,8-octamethyl-1,3,5,7,2,4,6,8-tetroxatetrasilocane|Octamethylcyclotetrasiloxane|Oktamethylzyklotetrasiloxan|cyclic dimethylsiloxane tetramer 2,2,4,4,6,6,8,8-octamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane 2,2,4,4,6,6,8,8-octamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane|2,2,4,4,6,6,8,8-octamethyl-1,3,5,7,2,4,6,8-tetroxatetrasilocane|Octamethylcyclotetrasiloxane|Oktamethylzyklotetrasiloxan|cyclic dimethylsiloxane tetramer http://purl.obolibrary.org/obo/CHEBI_25640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25646 biolink:ChemicalEntity octanoate A straight-chain saturated fatty acid anion that is the conjugate base of octanoic acid (caprylic acid); believed to block adipogenesis. cas:74-81-7|gmelin:329219|pubmed:11983812|reaxys:3588079|umbbd.compound:c0047 Graph 1-heptanecarboxylate|CH3-[CH2]6-COO(-)|caprilate|caprylate|n-caprylate|n-octanoate|n-octoate|n-octylate|octanoate|octanoic acid, ion(1-)|octylate octanoate 1-heptanecarboxylate|CH3-[CH2]6-COO(-)|caprilate|caprylate|n-caprylate|n-octanoate|n-octoate|n-octylate|octanoate|octanoic acid, ion(1-)|octylate http://purl.obolibrary.org/obo/CHEBI_25646 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25661 biolink:ChemicalEntity oleandomycins Graph oleandomycins oleandomycins http://purl.obolibrary.org/obo/CHEBI_25661 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25667 biolink:ChemicalEntity oleoyl group Graph (9Z)-octadec-9-enoyl|(9Z)-octadecenoyl group|(Z)-octadec-9-enoyl|Ole|cis-9-octadecenoyl|oleoyl (9Z)-octadec-9-enoyl (9Z)-octadec-9-enoyl|(9Z)-octadecenoyl group|(Z)-octadec-9-enoyl|Ole|cis-9-octadecenoyl|oleoyl http://purl.obolibrary.org/obo/CHEBI_25667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2567 biolink:ChemicalEntity alendronic acid A 1,1-bis(phosphonic acid) that is methanebis(phosphonic acid) in which the two methylene hydrogens are replaced by hydroxy and 3-aminopropyl groups. cas:66376-36-1|drugbank:DB00630|drugcentral:112|hmdb:HMDB0001915|kegg.compound:C07752|kegg.drug:D07119|lincs.smallmolecule:LSM-5831|metacyc.compound:ALENDRONATE|patent:BE903519|patent:US4705651|pdb-ccd:AHD|pubmed:12657258|pubmed:16626694|pubmed:19630066|pubmed:24676887|pubmed:25315260|pubmed:25442070|pubmed:25445446|pubmed:25461393|pubmed:25577217|pubmed:25592133|pubmed:25595570|pubmed:25603732|pubmed:25619515|pubmed:25636638|pubmed:25639838|reaxys:2275403|wikipedia.en:Alendronic_acid Graph (4-Amino-1-hydroxybutylidene)bisphosphonic acid|(4-amino-1-hydroxybutane-1,1-diyl)bis(phosphonic acid)|Alendronate|Alendronic acid|acide alendronique|acido alendronico|acidum alendronicum|alendronic acid (4-amino-1-hydroxybutane-1,1-diyl)bis(phosphonic acid) (4-Amino-1-hydroxybutylidene)bisphosphonic acid|(4-amino-1-hydroxybutane-1,1-diyl)bis(phosphonic acid)|Alendronate|Alendronic acid|acide alendronique|acido alendronico|acidum alendronicum|alendronic acid http://purl.obolibrary.org/obo/CHEBI_2567 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25675 biolink:ChemicalEntity oligomycin Any of the 26-membered ring macrolides produced by Streptomyces species that can be toxic to other organisms through their ability to inhibit mitochondrial membrane-bound ATP synthases. wikipedia.en:Oligomycin Graph oligomycins oligomycins http://purl.obolibrary.org/obo/CHEBI_25675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25676 biolink:ChemicalEntity oligopeptide A peptide containing a relatively small number of amino acids. wikipedia.en:Oligopeptide Graph Oligopeptid|oligopeptides|oligopeptido oligopeptides Oligopeptid|oligopeptides|oligopeptido http://purl.obolibrary.org/obo/CHEBI_25676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25681 biolink:ChemicalEntity omega-3 fatty acid A family of polyunsaturated fatty acids that have in common a final carbon-carbon double bond in the ω−3 position, i.e., the third bond from the methyl end of the fatty acid. pubmed:15129302|pubmed:15253883|pubmed:15555528|pubmed:16741195|pubmed:19154523|pubmed:19439966|pubmed:21975796|pubmed:23643471|pubmed:24012777|pubmed:24122252|pubmed:24128563|pubmed:24172034|pubmed:24211484|pubmed:24240437|pubmed:24246761|pubmed:24281905|pubmed:24397938|pubmed:24401220|pubmed:24418228|wikipedia.en:Omega-3_fatty_acid Graph n-3 fatty acid|n-3 fatty acids|omega-3 fatty acid|omega-3 fatty acids n-3 fatty acid|n-3 fatty acids|omega-3 fatty acid|omega-3 fatty acids http://purl.obolibrary.org/obo/CHEBI_25681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2569 biolink:ChemicalEntity alfentanil A member of the class of piperidines that is piperidine having a 2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl group at the 1-position as well as N-phenylpropanamido- and methoxymethyl groups at the 4-position. cas:71195-58-9|drugbank:DB00802|drugcentral:114|hmdb:HMDB0014940|kegg.compound:C08005|kegg.drug:D07122|patent:DE2819873|patent:US2014005223|patent:US4167574|pubmed:11240593|pubmed:11999595|pubmed:16621415|pubmed:23446076|reaxys:1188293|wikipedia.en:Alfentanil Graph Alfentanyl|N-(1-(2-(4-Ethyl-5-oxo-2-tetrazolin-1-yl)ethyl)-4-(methoxymethyl)-4-piperidyl)propionanilide|N-{1-[2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl}-N-phenylpropanamide|alfentanil|alfentanilum N-{1-[2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl}-N-phenylpropanamide Alfentanyl|N-(1-(2-(4-Ethyl-5-oxo-2-tetrazolin-1-yl)ethyl)-4-(methoxymethyl)-4-piperidyl)propionanilide|N-{1-[2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl}-N-phenylpropanamide|alfentanil|alfentanilum http://purl.obolibrary.org/obo/CHEBI_2569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25690 biolink:ChemicalEntity ommatin Graph ommatins ommatins http://purl.obolibrary.org/obo/CHEBI_25690 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25692 biolink:ChemicalEntity ommochrome Graph ommochromes ommochromes http://purl.obolibrary.org/obo/CHEBI_25692 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25693 biolink:ChemicalEntity organic heteromonocyclic compound Graph organic heteromonocyclic compounds organic heteromonocyclic compounds http://purl.obolibrary.org/obo/CHEBI_25693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25696 biolink:ChemicalEntity organic anion Any organic ion with a net negative charge. Graph organic anions organic anions http://purl.obolibrary.org/obo/CHEBI_25696 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25697 biolink:ChemicalEntity organic cation Any organic ion with a net positive charge. Graph organic cations organic cations http://purl.obolibrary.org/obo/CHEBI_25697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25698 biolink:ChemicalEntity ether An organooxygen compound with formula ROR, where R is not hydrogen. Graph ether|ethers ether|ethers ether|ethers http://purl.obolibrary.org/obo/CHEBI_25698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25699 biolink:ChemicalEntity organic ion Graph organic ions organic ions http://purl.obolibrary.org/obo/CHEBI_25699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25701 biolink:ChemicalEntity organic oxide An oxide in which the oxygen atom is bonded to a carbon atom. Graph organic oxides organic oxides http://purl.obolibrary.org/obo/CHEBI_25701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25702 biolink:ChemicalEntity organic peroxide Compounds of structure ROOR' in which R and R' are organic groups. Graph organic peroxides|peroxides organic peroxides|peroxides http://purl.obolibrary.org/obo/CHEBI_25702 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25703 biolink:ChemicalEntity organic phosphate wikipedia.en:Organophosphate Graph organic phosphate|organic phosphate ester|organic phosphate esters|organic phosphates|organophosphate ester|organophosphate esters organic phosphate|organic phosphate ester|organic phosphate esters|organic phosphates|organophosphate ester|organophosphate esters http://purl.obolibrary.org/obo/CHEBI_25703 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25704 biolink:ChemicalEntity organic sulfate Compounds of the general formula SO3HOR where R is an organyl group Graph organic sulfates organic sulfates http://purl.obolibrary.org/obo/CHEBI_25704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25705 biolink:ChemicalEntity organochlorine insecticide Any organochlorine pesticide that has been used as an insecticide. Graph Organochlorinsektizid|chlororganische Insektizide|organochloride insecticide|organochloride insecticides|organochlorine insecticides Organochlorinsektizid|chlororganische Insektizide|organochloride insecticide|organochloride insecticides|organochlorine insecticides http://purl.obolibrary.org/obo/CHEBI_25705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25706 biolink:ChemicalEntity organomercury compound A compound containing at least one carbon-mercury bond. Graph organomercury compounds organomercury compounds http://purl.obolibrary.org/obo/CHEBI_25706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25707 biolink:ChemicalEntity organometallic compound A compound having bonds between one or more metal atoms and one or more carbon atoms of an organyl group. Graph metalloorganic compounds|metalloorganics|metalorganic compounds|organometallic compounds|organometallics organometallic compounds metalloorganic compounds|metalloorganics|metalorganic compounds|organometallic compounds|organometallics http://purl.obolibrary.org/obo/CHEBI_25707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25708 biolink:ChemicalEntity organophosphate insecticide Graph organophosphate insecticides organophosphate insecticides http://purl.obolibrary.org/obo/CHEBI_25708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2571 biolink:ChemicalEntity aliphatic alcohol An alcohol derived from an aliphatic compound. kegg.compound:C02525 Graph Aliphatic alcohol|aliphatic alcohols|an aliphatic alcohol Aliphatic alcohol|aliphatic alcohols|an aliphatic alcohol http://purl.obolibrary.org/obo/CHEBI_2571 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25710 biolink:ChemicalEntity organophosphorus compound An organophosphorus compound is formally a compound containing at least one carbon-phosphorus bond, but the term is often extended to include esters and thioesters. wikipedia.en:Organophosphorus_compound Graph organophosphorus compound|organophosphorus compounds organophosphorus compound|organophosphorus compounds http://purl.obolibrary.org/obo/CHEBI_25710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25711 biolink:ChemicalEntity organophosphorus insecticide Graph organophosphorus insecticides organophosphorus insecticides http://purl.obolibrary.org/obo/CHEBI_25711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25712 biolink:ChemicalEntity organoselenium compound An organoselenium compound is a compound containing at least one carbon-selenium bond. Graph organoselenium compound|organoselenium compounds organoselenium compound|organoselenium compounds http://purl.obolibrary.org/obo/CHEBI_25712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25713 biolink:ChemicalEntity organosilicon compound An organosilicon compound is a compound containing at least one carbon-silicon bond. Graph organosilicon compound|organosilicon compounds|silicoorganic compounds organosilicon compound|organosilicon compounds|silicoorganic compounds http://purl.obolibrary.org/obo/CHEBI_25713 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25715 biolink:ChemicalEntity organothiophosphate insecticide Graph organophosphorothioate insecticide|organothiophosphate insecticides organophosphorothioate insecticide|organothiophosphate insecticides http://purl.obolibrary.org/obo/CHEBI_25715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25716 biolink:ChemicalEntity organothiophosphorus compound An organothiophosphorus compound is an organophosphorus compound which contains a phosphorus-sulfur bond. Graph organothiophosphorus compounds organothiophosphorus compounds http://purl.obolibrary.org/obo/CHEBI_25716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25717 biolink:ChemicalEntity organotin compound Graph organotin compounds|stannanes organotin compounds|stannanes http://purl.obolibrary.org/obo/CHEBI_25717 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25718 biolink:ChemicalEntity ornithine derivative A non-proteinogenic amino acid derivative resulting from reaction of ornithine at the amino group, the carboxy group, or the side-chain amino group, or from the replacement of any hydrogen of ornithine by a heteroatom. The definition normally excludes peptides containing ornithine residues. Graph ornithine derivatives ornithine derivatives http://purl.obolibrary.org/obo/CHEBI_25718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25722 biolink:ChemicalEntity orotidine A nucleoside formed by attaching orotic acid to a ribose ring via a β‒N(1)-glycosidic bond. cas:314-50-1|pubmed:14853953|pubmed:23555823|reaxys:47461 Graph 3-Ribofuranosylorotic acid|6-Carboxyuridine 3-Ribofuranosylorotic acid|6-Carboxyuridine http://purl.obolibrary.org/obo/CHEBI_25722 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25728 biolink:ChemicalEntity osmolyte A solute used by a cell under water stress to maintain cell volume. Graph osmolytes osmolytes http://purl.obolibrary.org/obo/CHEBI_25728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25741 biolink:ChemicalEntity oxide An oxide is a chemical compound of oxygen with other chemical elements. Graph oxide|oxides oxide|oxides http://purl.obolibrary.org/obo/CHEBI_25741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25747 biolink:ChemicalEntity oxidized luciferins Graph oxidized luciferins oxidized luciferins http://purl.obolibrary.org/obo/CHEBI_25747 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25750 biolink:ChemicalEntity oxime Compounds of structure R2C=NOH derived from condensation of aldehydes or ketones with hydroxylamine. Oximes from aldehydes may be called aldoximes; those from ketones may be called ketoximes. Graph oxime|oximes oximes oxime|oximes http://purl.obolibrary.org/obo/CHEBI_25750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25753 biolink:ChemicalEntity oxo-5beta-cholanic acid Graph oxo-5beta-cholanic acid|oxo-5beta-cholanic acids oxo-5beta-cholanic acid|oxo-5beta-cholanic acids http://purl.obolibrary.org/obo/CHEBI_25753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25754 biolink:ChemicalEntity oxo carboxylic acid Any compound that has an aldehydic or ketonic group as well as a carboxylic acid group in the same molecule. Graph oxo acids|oxo carboxylic acids oxo carboxylic acids oxo acids|oxo carboxylic acids http://purl.obolibrary.org/obo/CHEBI_25754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2578 biolink:ChemicalEntity Alkannin cas:517-88-4|kegg.compound:C10292|knapsack:C00002787 Graph Alkannin Alkannin http://purl.obolibrary.org/obo/CHEBI_2578 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:25781 biolink:ChemicalEntity hex-2-enedioate Graph oxohex-2-enedioates oxohex-2-enedioates http://purl.obolibrary.org/obo/CHEBI_25781 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25789 biolink:ChemicalEntity hexenedioic acid Graph hexenedioic acids hexenedioic acids http://purl.obolibrary.org/obo/CHEBI_25789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25798 biolink:ChemicalEntity oxopentanoates The conjugate base of any oxopentanoic acid. Graph oxopentanoate oxopentanoate oxopentanoate http://purl.obolibrary.org/obo/CHEBI_25798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25799 biolink:ChemicalEntity oxopentanoic acid A C5 fatty acid carrying an oxo group at any position. Graph oxopentanoic acid|oxovaleric acid oxopentanoic acid oxopentanoic acid|oxovaleric acid http://purl.obolibrary.org/obo/CHEBI_25799 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2580 biolink:ChemicalEntity unsaturated fatty acid anion Any fatty acid anion containing at least one C-C unsaturated bond; formed by deprotonation of the carboxylic acid moiety. Graph http://purl.obolibrary.org/obo/CHEBI_2580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25801 biolink:ChemicalEntity oxoproline A pyrrolidinemonocarboxylic acid consisting of proline bearing a single oxo substituent. Graph oxoproline oxoproline oxoproline http://purl.obolibrary.org/obo/CHEBI_25801 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25805 biolink:ChemicalEntity oxygen atom kegg.compound:C00007|webelements:O Graph 8O|O|Sauerstoff|oxigeno|oxygen|oxygene oxygen 8O|O|Sauerstoff|oxigeno|oxygen|oxygene http://purl.obolibrary.org/obo/CHEBI_25805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25806 biolink:ChemicalEntity oxygen molecular entity Graph oxygen molecular entities|oxygen molecular entity oxygen molecular entities|oxygen molecular entity http://purl.obolibrary.org/obo/CHEBI_25806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25807 biolink:ChemicalEntity organooxygen heterocyclic antibiotic Graph organooxygen heterocyclic antibiotics|oxygen containing heterocyclic antibiotics organooxygen heterocyclic antibiotics|oxygen containing heterocyclic antibiotics http://purl.obolibrary.org/obo/CHEBI_25807 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25810 biolink:ChemicalEntity oxopurine Graph oxopurines oxopurines http://purl.obolibrary.org/obo/CHEBI_25810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25812 biolink:ChemicalEntity ozone An elemental molecule with formula O3. An explosive, pale blue gas (b.p. −112°C) that has a characteristic, pungent odour, it is continuously produced in the upper atmosphere by the action of solar ultraviolet radiation on atmospheric oxygen. It is an antimicrobial agent used in the production of bottled water, as well as in the treatment of meat, poultry and other foodstuffs. cas:10028-15-6|gmelin:1101|hmdb:HMDB0035409|molbase:931|pubmed:10205911|pubmed:10226494|pubmed:10552743|pubmed:11029342|pubmed:11203434|pubmed:11568152|pubmed:12509241|pubmed:15598576|pubmed:15963550|pubmed:1717074|pubmed:17674823|pubmed:18250191|pubmed:18699586|pubmed:19519548|pubmed:19580672|pubmed:19723209|pubmed:19827485|pubmed:20477724|pubmed:23488636|pubmed:23501341|pubmed:23517299|pubmed:23556239|pubmed:24001808|pubmed:24176344|pubmed:24188305|pubmed:7763188|pubmed:8255146|pubmed:9202716|reaxys:4921393|wikipedia.en:Ozone Graph O3|Ozon|Trisauerstoff|[OO2]|ozone|ozono|trioxygen|trioxygene ozone|trioxygen O3|Ozon|Trisauerstoff|[OO2]|ozone|ozono|trioxygen|trioxygene http://purl.obolibrary.org/obo/CHEBI_25812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25822 biolink:ChemicalEntity p-cumate A cumate that is the conjugate base of p-cumic acid. kegg.compound:C06578|reaxys:3904935|umbbd.compound:c0378 Graph 4-(1-methylethyl)benzoate|4-(propan-2-yl)benzoate|4-isopropylbenzoate|p-Cumate|p-cumate 4-(propan-2-yl)benzoate 4-(1-methylethyl)benzoate|4-(propan-2-yl)benzoate|4-isopropylbenzoate|p-Cumate|p-cumate http://purl.obolibrary.org/obo/CHEBI_25822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25826 biolink:ChemicalEntity p-menthane beilstein:1900617|cas:99-82-1|lipidmaps:LMPR0102090000 Graph 1-isopropyl-4-methylcyclohexane|1-methyl-4-(1-methylethyl)-cyclohexane|1-methyl-4-(propan-2-yl)cyclohexane|p-Menthan|p-menthane|para-menthane 1-methyl-4-(propan-2-yl)cyclohexane|p-menthane 1-isopropyl-4-methylcyclohexane|1-methyl-4-(1-methylethyl)-cyclohexane|1-methyl-4-(propan-2-yl)cyclohexane|p-Menthan|p-menthane|para-menthane http://purl.obolibrary.org/obo/CHEBI_25826 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25830 biolink:ChemicalEntity p-quinones A quinone in which the two oxo groups of the quinone are located para to each other on the 6-membered quinonoid ring. Graph p-quinone|para-quinones p-quinone|para-quinones http://purl.obolibrary.org/obo/CHEBI_25830 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25835 biolink:ChemicalEntity hexadecanoate ester A fatty acid ester obtained by condensation of the carboxy group of palmitic acid with a hydroxy group of an alcohol or phenol. Graph hexadecanoate ester|hexadecanoate esters|palmitate ester|palmitate esters|palmitic acid ester|palmitic acid esters hexadecanoate ester|hexadecanoate esters|palmitate ester|palmitate esters|palmitic acid ester|palmitic acid esters http://purl.obolibrary.org/obo/CHEBI_25835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:258351 biolink:ChemicalEntity practolol N-(4-Hydroxyphenyl)acetamide in which the hydrogen of the phenolic hydroxy group is substituted by a 3-(isopropylaminoamino)-2-hydroxypropyl group. A selective beta blocker, it has been used in the emergency treatment of cardiac arrhythmias. cas:6673-35-4|drugbank:DB01297|drugcentral:3486|hmdb:HMDB0015411|kegg.compound:C11696|kegg.drug:D05587|lincs.smallmolecule:LSM-1531|patent:US3408387|pubmed:6827543|wikipedia.en:Practolol Graph (+-)-practolol|1-(4-acetamidophenoxy)-3-isopropylamino-2-propanol|4'-(2-hydroxy-3-(isopropylamino)propoxy)acetanilide|N-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)acetamide|N-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}acetamide|practolol|practololum N-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}acetamide (+-)-practolol|1-(4-acetamidophenoxy)-3-isopropylamino-2-propanol|4'-(2-hydroxy-3-(isopropylamino)propoxy)acetanilide|N-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)acetamide|N-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}acetamide|practolol|practololum http://purl.obolibrary.org/obo/CHEBI_258351 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25838 biolink:ChemicalEntity palmitoyl amino acid Graph palmitoyl amino acids palmitoyl amino acids http://purl.obolibrary.org/obo/CHEBI_25838 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25840 biolink:ChemicalEntity palmitoyl-L-cysteine A palmitoyl amino acid in which the amino acid specified is palmitoyl. Graph palmitoyl-L-cysteines palmitoyl-L-cysteines http://purl.obolibrary.org/obo/CHEBI_25840 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25845 biolink:ChemicalEntity pantetheines Graph pantetheines pantetheines http://purl.obolibrary.org/obo/CHEBI_25845 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25848 biolink:ChemicalEntity pantothenic acids A class of amides formed from pantoic acid and β-alanine and its derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_25848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25858 biolink:ChemicalEntity 1,7-dimethylxanthine A dimethylxanthine having the two methyl groups located at positions 1 and 7. It is a metabolite of caffeine and theobromine in animals. cas:611-59-6|hmdb:HMDB0001860|kegg.compound:C13747|lincs.smallmolecule:LSM-20962|metacyc.compound:1-7-DIMETHYLXANTHINE|pubmed:10416066|pubmed:10572151|pubmed:10593655|pubmed:10877011|pubmed:11090584|pubmed:1128545|pubmed:12110375|pubmed:16870158|pubmed:17655324|pubmed:18621927|pubmed:20004571|pubmed:20614853|pubmed:20853468|pubmed:21380987|pubmed:22770225|pubmed:2882985|pubmed:3371146|pubmed:3798364|pubmed:7920690|pubmed:7977734|pubmed:8529334|pubmed:9920286|reaxys:197907|wikipedia.en:Paraxanthine Graph 1,7-Dimethylxanthine|1,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione|1,7-dimethylxanthine|3,7-Dihydro-1,7-dimethyl-1H-purine-2,6-dione|Paraxanthine|p-Xanthine 1,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione 1,7-Dimethylxanthine|1,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione|1,7-dimethylxanthine|3,7-Dihydro-1,7-dimethyl-1H-purine-2,6-dione|Paraxanthine|p-Xanthine http://purl.obolibrary.org/obo/CHEBI_25858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25863 biolink:ChemicalEntity pelargonidin An anthocyanidin cation that is flavylium substituted by a hydroxy groups at positions 3, 5, 7 and 4'. cas:134-04-3|cas:7690-51-9|kegg.compound:C05904|knapsack:C00007232|lipidmaps:LMPK12010003|pubmed:15588587|pubmed:23419638|reaxys:1688614|wikipedia.en:Pelargonidin Graph 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium|3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium|pelargonidin 3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium|3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium|pelargonidin http://purl.obolibrary.org/obo/CHEBI_25863 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25865 biolink:ChemicalEntity penicillanic acids Graph http://purl.obolibrary.org/obo/CHEBI_25865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25872 biolink:ChemicalEntity pentacyclic triterpenoid Graph pentacyclic triterpenoids pentacyclic triterpenoids http://purl.obolibrary.org/obo/CHEBI_25872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25876 biolink:ChemicalEntity pentadienoic acid Any 5-carbon fatty acid containing two double bonds. Graph butadiene-1-carboxylic acid|butadiene-1-carboxylic acids|pentadienoic acid pentadienoic acid butadiene-1-carboxylic acid|butadiene-1-carboxylic acids|pentadienoic acid http://purl.obolibrary.org/obo/CHEBI_25876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25878 biolink:ChemicalEntity pentaerythritol nitrate Graph pentaerythritol nitrates pentaerythritol nitrates http://purl.obolibrary.org/obo/CHEBI_25878 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25879 biolink:ChemicalEntity pentaerythritol tetranitrate A pentaerythritol nitrate in which all four hydroxy groups of pentaerythritol have been converted to the corresponding nitrate ester. It is a vasodilator with properties similar to those of glyceryl trinitrate, but with a more prolonged duration of action, and is used for treatment of angina pectoris. It is also one of the most powerful high explosives known and is a component of the plastic explosive known as Semtex. cas:78-11-5|drugcentral:2087|kegg.drug:D01721|reaxys:1716886|wikipedia.en:Pentaerythritol_tetranitrate Graph 1,3-dinitrato-2,2-bis(nitratomethyl)propane|2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate|2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate ester|2,2-bis(hydroxymethyl)-1,3-propanediol tetranitrate|3-(nitrooxy)-2,2-bis[(nitrooxy)methyl]propyl nitrate|PENT|PETN|TEN|corpent|neopentanetetrayl nitrate|nitropenta|nitropentaerythrite|nitropentaerythritol|pentaerithrityl tetranitrate|pentaerithrityli tetranitras|pentaerythritol tetranitrate|pentaerythritylium tetranitricum|penthrite|tetranitrate de pentaerithrityle|tetranitrato de pentaeritritilo|tetranitropentaerythritol 1,3-dinitrato-2,2-bis(nitratomethyl)propane|2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate|2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate ester|2,2-bis(hydroxymethyl)-1,3-propanediol tetranitrate|3-(nitrooxy)-2,2-bis[(nitrooxy)methyl]propyl nitrate|PENT|PETN|TEN|corpent|neopentanetetrayl nitrate|nitropenta|nitropentaerythrite|nitropentaerythritol|pentaerithrityl tetranitrate|pentaerithrityli tetranitras|pentaerythritol tetranitrate|pentaerythritylium tetranitricum|penthrite|tetranitrate de pentaerithrityle|tetranitrato de pentaeritritilo|tetranitropentaerythritol http://purl.obolibrary.org/obo/CHEBI_25879 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2588 biolink:ChemicalEntity Alkylated DNA kegg.compound:C00871 Graph Alkylated DNA Alkylated DNA http://purl.obolibrary.org/obo/CHEBI_2588 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:25881 biolink:ChemicalEntity pentahydroxycyclohexanone A hydroxycyclohexanone bearing five hydroxy substituents. Graph http://purl.obolibrary.org/obo/CHEBI_25881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25883 biolink:ChemicalEntity pentahydroxyflavone A hydroxyflavone substituted by five hydroxy groups. Graph pentahydroxyflavones pentahydroxyflavones http://purl.obolibrary.org/obo/CHEBI_25883 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25892 biolink:ChemicalEntity pentanone Any ketone that is pentane substituted by an oxo group at unspecified position. Graph pentanones pentanones http://purl.obolibrary.org/obo/CHEBI_25892 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25897 biolink:ChemicalEntity pentenoic acid Any C5, straight-chain, monounsaturated fatty acid. Graph C5:1|pentenoic acid|pentenoic acids pentenoic acid C5:1|pentenoic acid|pentenoic acids http://purl.obolibrary.org/obo/CHEBI_25897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25898 biolink:ChemicalEntity pentitol phosphate Graph pentitol phosphate|pentitol phosphates pentitol phosphate|pentitol phosphates http://purl.obolibrary.org/obo/CHEBI_25898 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25899 biolink:ChemicalEntity pentitol An alditol obtained by reduction of any pentose. Graph pentitol|pentitols pentitol|pentitols http://purl.obolibrary.org/obo/CHEBI_25899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25900 biolink:ChemicalEntity aldopentose phosphate Graph aldopentose phosphate|aldopentose phosphates aldopentose phosphate|aldopentose phosphates http://purl.obolibrary.org/obo/CHEBI_25900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25901 biolink:ChemicalEntity pentose A five-carbon monosaccharide which in its linear form contains either an aldehyde group at position 1 (aldopentose) or a ketone group at position 2 (ketopentose). Graph pentose|pentoses pentose|pentoses http://purl.obolibrary.org/obo/CHEBI_25901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25903 biolink:ChemicalEntity peptide antibiotic A chemically diverse class of peptides that exhibit antimicrobial properties. metacyc.compound:Peptide-Antibiotics|pubmed:33398258 Graph peptide antibiotics peptide antibiotics http://purl.obolibrary.org/obo/CHEBI_25903 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25904 biolink:ChemicalEntity peptide ergot alkaloid Graph peptide ergot alkaloids peptide ergot alkaloids http://purl.obolibrary.org/obo/CHEBI_25904 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25905 biolink:ChemicalEntity peptide hormone Any peptide with hormonal activity in animals, whether endocrine, neuroendocrine, or paracrine. Graph peptide hormones|polypeptide hormone peptide hormones|polypeptide hormone http://purl.obolibrary.org/obo/CHEBI_25905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25909 biolink:ChemicalEntity peptidyl-1-thioglycine Graph peptidyl-1-thioglycine peptidyl-1-thioglycine http://purl.obolibrary.org/obo/CHEBI_25909 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25914 biolink:ChemicalEntity peptidyl-amino acid Graph peptidyl-amino acids peptidyl-amino acids http://purl.obolibrary.org/obo/CHEBI_25914 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25921 biolink:ChemicalEntity peptidyl-glycine kegg.compound:C02303 Graph peptidyl-glycines peptidyl-glycines http://purl.obolibrary.org/obo/CHEBI_25921 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25935 biolink:ChemicalEntity hydroperoxyl cas:3170-83-0|gmelin:506 Graph (HO2)(.)|HO2(.)|dioxidanyl|hydridodioxygen(.)|hydrogen dioxide|hydroperoxo|hydroperoxy radical|hydroperoxyl|perhydroxyl radical|peroxyl radical hydridodioxygen(.) (HO2)(.)|HO2(.)|dioxidanyl|hydridodioxygen(.)|hydrogen dioxide|hydroperoxo|hydroperoxy radical|hydroperoxyl|perhydroxyl radical|peroxyl radical http://purl.obolibrary.org/obo/CHEBI_25935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25940 biolink:ChemicalEntity peroxides Compounds of structure ROOR'. Graph a peroxide a peroxide http://purl.obolibrary.org/obo/CHEBI_25940 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25941 biolink:ChemicalEntity peroxynitrite The nitrogen oxoanion formed by loss of a proton from peroxynitrous acid. cas:19059-14-4|gmelin:674445|kegg.compound:C16845|pubmed:29051068|wikipedia.en:Peroxynitrite Graph [NO(OO)](-)|azoperoxoite|oxidoperoxidonitrate(1-)|peroxynitrite azoperoxoite|oxidoperoxidonitrate(1-) [NO(OO)](-)|azoperoxoite|oxidoperoxidonitrate(1-)|peroxynitrite http://purl.obolibrary.org/obo/CHEBI_25941 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25942 biolink:ChemicalEntity peroxynitrous acid cas:14691-52-2|gmelin:49207 Graph (dioxidanido)oxidonitrogen|HNO(O2)|[NO(OOH)]|azoperoxous acid|dioxidanidooxidonitrogen|peroxynitrous acid (dioxidanido)oxidonitrogen|azoperoxous acid|dioxidanidooxidonitrogen (dioxidanido)oxidonitrogen|HNO(O2)|[NO(OOH)]|azoperoxous acid|dioxidanidooxidonitrogen|peroxynitrous acid http://purl.obolibrary.org/obo/CHEBI_25942 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25943 biolink:ChemicalEntity pesticide synergist A substance that increases the efficacy of a pesticide. Graph pesticide synergists pesticide synergists http://purl.obolibrary.org/obo/CHEBI_25943 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25944 biolink:ChemicalEntity pesticide Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. wikipedia.en:Pesticide Graph Pestizid|Pestizide|pesticide|pesticides pesticide Pestizid|Pestizide|pesticide|pesticides http://purl.obolibrary.org/obo/CHEBI_25944 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25961 biolink:ChemicalEntity phenanthrenes Any benzenoid aromatic compound that consists of a phenanthrene skeleton and its substituted derivatives thereof. Graph http://purl.obolibrary.org/obo/CHEBI_25961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25962 biolink:ChemicalEntity phenanthrol cas:30774-95-9 Graph phenanthrenol|phenanthrols phenanthrenol|phenanthrols http://purl.obolibrary.org/obo/CHEBI_25962 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25970 biolink:ChemicalEntity phenoxazine Graph phenoxazines phenoxazines http://purl.obolibrary.org/obo/CHEBI_25970 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25973 biolink:ChemicalEntity phenylacetaldehydes Graph phenylacetaldehydes phenylacetaldehydes http://purl.obolibrary.org/obo/CHEBI_25973 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:25978 biolink:ChemicalEntity phenylacetic acids Any monocarboxylic acid that is phenylacetic acid or its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_25978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25979 biolink:ChemicalEntity phenylacetonitrile A nitrile that is acetonitrile where one of the methyl hydrogens is substituted by a phenyl group. cas:140-29-4|drugbank:DB04817|gmelin:68893|kegg.compound:C16074|knapsack:C00007674|pubmed:12770022|pubmed:19215138|pubmed:20411403|pubmed:20490899|pubmed:20882316|pubmed:21377400|pubmed:21452001|reaxys:385941|umbbd.compound:c0647 Graph (cyanomethyl)benzene|2-phenylacetonitrile|Benzyl cyanide|alpha-cyanotoluene|alpha-tolunitrile|benzeneacetonitrile|benzyl cyanide|benzyl nitrile|phenylacetonitrile phenylacetonitrile (cyanomethyl)benzene|2-phenylacetonitrile|Benzyl cyanide|alpha-cyanotoluene|alpha-tolunitrile|benzeneacetonitrile|benzyl cyanide|benzyl nitrile|phenylacetonitrile http://purl.obolibrary.org/obo/CHEBI_25979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25985 biolink:ChemicalEntity phenylalanine derivative An amino acid derivative resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of phenylalanine by a heteroatom. The definition normally excludes peptides containing phenylalanine residues. Graph http://purl.obolibrary.org/obo/CHEBI_25985 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25987 biolink:ChemicalEntity phenylalanyl group Graph 2-amino-3-phenylpropanoyl|phenylalanyl 2-amino-3-phenylpropanoyl 2-amino-3-phenylpropanoyl|phenylalanyl http://purl.obolibrary.org/obo/CHEBI_25987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25990 biolink:ChemicalEntity phenylethanolamines An ethanolamine compound having a phenyl (substituted or unsubstituted) group on the carbon bearing the hydroxy substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25990 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25996 biolink:ChemicalEntity phenylhydrazines Any member of the class of hydrazines carrying a phenyl substituent. Graph http://purl.obolibrary.org/obo/CHEBI_25996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:25998 biolink:ChemicalEntity 3-phenyllactic acid A 2-hydroxy monocarboxylic acid that is lactic acid in which one of the methyl hydrogens is substituted by a phenyl group. cas:828-01-3|hmdb:HMDB0000779|metacyc.compound:CPD-7999|pubmed:22770225|reaxys:2209791 Graph 2-hydroxy-3-phenylpropanoic acid|2-hydroxy-3-phenylpropionic acid|DL-3-phenyllactic acid|DL-beta-phenyllactic acid|beta-phenyllactic acid 2-hydroxy-3-phenylpropanoic acid 2-hydroxy-3-phenylpropanoic acid|2-hydroxy-3-phenylpropionic acid|DL-3-phenyllactic acid|DL-beta-phenyllactic acid|beta-phenyllactic acid http://purl.obolibrary.org/obo/CHEBI_25998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26004 biolink:ChemicalEntity phenylpropanoid Any organic aromatic compound with a structure based on a phenylpropane skeleton. The class includes naturally occurring phenylpropanoid esters, flavonoids, anthocyanins, coumarins and many small phenolic molecules as well as their semi-synthetic and synthetic analogues. Phenylpropanoids are also precursors of lignin. wikipedia.en:Phenylpropanoid Graph phenylpropanoids phenylpropanoids http://purl.obolibrary.org/obo/CHEBI_26004 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26008 biolink:ChemicalEntity phenylpyruvate A 2-oxo monocarboxylic acid anion resulting from deprotonation of the carboxy group of either keto- or enol-phenylpyruvic acid. Graph phenylpyruvates phenylpyruvates http://purl.obolibrary.org/obo/CHEBI_26008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26013 biolink:ChemicalEntity pheromone A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour. pubmed:23988175|wikipedia.en:Pheromone Graph ectohormone|feromone|pheromone|pheromones pheromone ectohormone|feromone|pheromone|pheromones http://purl.obolibrary.org/obo/CHEBI_26013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26020 biolink:ChemicalEntity phosphate Salts and esters of phosphoric and oligophosphoric acids and their chalcogen analogues. In inorganic chemistry, the term is also used to describe anionic coordination entities with phosphorus as central atom. Graph phosphates phosphates phosphates http://purl.obolibrary.org/obo/CHEBI_26020 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26034 biolink:ChemicalEntity phosphatidylinositol 3-phosphate A phosphatidylinositol monophosphate carrying the phosphate group at the 3-position. pubmed:18927492 Graph PI(3)P|PtdIns3P|phosphatidylinositol 3-phosphates PI(3)P|PtdIns3P|phosphatidylinositol 3-phosphates http://purl.obolibrary.org/obo/CHEBI_26034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26036 biolink:ChemicalEntity phosphatidylinositol monophosphate Graph phosphatidylinositol monophosphates phosphatidylinositol monophosphates http://purl.obolibrary.org/obo/CHEBI_26036 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26043 biolink:ChemicalEntity phosphinic ester kegg.compound:C03497 Graph phosphinate esters|phosphinic acid esters|phosphinic esters phosphinate esters|phosphinic acid esters|phosphinic esters http://purl.obolibrary.org/obo/CHEBI_26043 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26044 biolink:ChemicalEntity phosphinic acids H2P(=O)OH (phosphinic acid) and its P-hydrocarbyl derivatives. Graph phosphinic acids phosphinic acids phosphinic acids http://purl.obolibrary.org/obo/CHEBI_26044 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26045 biolink:ChemicalEntity phosphite ion Graph phosphite ions phosphite ions http://purl.obolibrary.org/obo/CHEBI_26045 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26051 biolink:ChemicalEntity phosphoamino acid Graph phosphoamino acids phosphoamino acids http://purl.obolibrary.org/obo/CHEBI_26051 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26057 biolink:ChemicalEntity phosphoglycosphingolipid Graph glycophosphosphingolipids|phosphoglycosphingolipids glycophosphosphingolipids|phosphoglycosphingolipids http://purl.obolibrary.org/obo/CHEBI_26057 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26066 biolink:ChemicalEntity phosphonate Graph phosphonates phosphonates http://purl.obolibrary.org/obo/CHEBI_26066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26069 biolink:ChemicalEntity phosphonic acids HP(=O)(OH)2 (phosphonic acid) and its P-substituted derivatives. Graph phosphonic acids phosphonic acids phosphonic acids http://purl.obolibrary.org/obo/CHEBI_26069 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2607 biolink:ChemicalEntity Aloe emodin A dihydroxyanthraquinone that is chrysazin carrying a hydroxymethyl group at position 3. It has been isolated from plant species of the genus Aloe. cas:481-72-1|hmdb:HMDB0030829|kegg.compound:C10294|knapsack:C00002789|lipidmaps:LMPK13040002|patent:US4670265|pubmed:22931417|pubmed:24685589|pubmed:24707862|reaxys:2059062|wikipedia.en:Aloe_emodin Graph 1,8-Dihydroxy-3-hydroxymethylanthraquinone|1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione|3-(Hydroxymethyl)chrysazin|Aloe-emodin|Aloeemodin|Rhabarberone 1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione 1,8-Dihydroxy-3-hydroxymethylanthraquinone|1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione|3-(Hydroxymethyl)chrysazin|Aloe-emodin|Aloeemodin|Rhabarberone http://purl.obolibrary.org/obo/CHEBI_2607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26073 biolink:ChemicalEntity phosphopantetheine Graph phosphopantetheines phosphopantetheines http://purl.obolibrary.org/obo/CHEBI_26073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26078 biolink:ChemicalEntity phosphoric acid A phosphorus oxoacid that consists of one oxo and three hydroxy groups joined covalently to a central phosphorus atom. cas:7664-38-2|drugcentral:4478|gmelin:2000|hmdb:HMDB0002142|kegg.compound:C00009|kegg.drug:D05467|knapsack:C00007408|pubmed:11455380|pubmed:15630224|pubmed:17439666|pubmed:17518491|pubmed:22282755|pubmed:22333268|pubmed:22381614|pubmed:22401268|reaxys:1921286|wikipedia.en:Phosphoric_Acid Graph H3PO4|Orthophosphoric acid|Phosphate|Phosphoric acid|Phosphorsaeure|Phosphorsaeureloesungen|[PO(OH)3]|acide phosphorique|acidum phosphoricum|orthophosphoric acid|phosphoric acid|tetraoxophosphoric acid|trihydrogen tetraoxophosphate(3-)|trihydroxidooxidophosphorus tetraoxophosphoric acid|trihydrogen tetraoxophosphate(3-)|trihydroxidooxidophosphorus H3PO4|Orthophosphoric acid|Phosphate|Phosphoric acid|Phosphorsaeure|Phosphorsaeureloesungen|[PO(OH)3]|acide phosphorique|acidum phosphoricum|orthophosphoric acid|phosphoric acid|tetraoxophosphoric acid|trihydrogen tetraoxophosphate(3-)|trihydroxidooxidophosphorus http://purl.obolibrary.org/obo/CHEBI_26078 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26079 biolink:ChemicalEntity phosphoric acid derivative Graph phosphoric acid derivatives|phosphoric acids phosphoric acid derivatives|phosphoric acids http://purl.obolibrary.org/obo/CHEBI_26079 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26082 biolink:ChemicalEntity phosphorus molecular entity Graph phosphorus molecular entities phosphorus molecular entities http://purl.obolibrary.org/obo/CHEBI_26082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26087 biolink:ChemicalEntity photosynthetic electron-transport chain inhibitor Graph photosynthetic electron transport chain inhibitors photosynthetic electron transport chain inhibitors http://purl.obolibrary.org/obo/CHEBI_26087 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26089 biolink:ChemicalEntity photosystem-II inhibitor Graph PSII inhibitor|photosystem II inhibitors PSII inhibitor|photosystem II inhibitors http://purl.obolibrary.org/obo/CHEBI_26089 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26092 biolink:ChemicalEntity phthalate Graph phthalates phthalates http://purl.obolibrary.org/obo/CHEBI_26092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26094 biolink:ChemicalEntity benzenedicarboxylic acid A member of the class of benzoic acids in that consists of benzene substituted by two carboxy groups (A closed class). Graph benzenedicarboxylic acid benzenedicarboxylic acid benzenedicarboxylic acid http://purl.obolibrary.org/obo/CHEBI_26094 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26106 biolink:ChemicalEntity phylloquinones Graph phylloquinones phylloquinones http://purl.obolibrary.org/obo/CHEBI_26106 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2611 biolink:ChemicalEntity alprazolam A member of the class of triazolobenzodiazepines that is 4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine carrying methyl, phenyl and chloro substituents at positions 1, 6 and 8 respectively. Alprazolam is only found in individuals that have taken this drug. cas:28981-97-7|drugbank:DB00404|drugcentral:136|hmdb:HMDB0014548|kegg.compound:C06817|kegg.drug:D00225|lincs.smallmolecule:LSM-5460|pubmed:10350361|pubmed:10443648|pubmed:10631626|pubmed:10963939|pubmed:10997633|pubmed:11304902|pubmed:11824768|pubmed:12035937|pubmed:15647704|pubmed:15725773|pubmed:15830221|pubmed:16103667|pubmed:16139113|pubmed:16572266|pubmed:17631455|pubmed:24361783|pubmed:24464531|pubmed:24629629|pubmed:24840273|pubmed:24977401|pubmed:25032127|pubmed:25139178|pubmed:25199955|pubmed:25300043|pubmed:25427652|pubmed:25581490|pubmed:25620535|pubmed:7907366|pubmed:9050091|reaxys:1223125|vsdb:2960|wikipedia.en:Alprazolam Graph 8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine|8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine|Alprazolam|Xanax 8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine 8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine|8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine|Alprazolam|Xanax http://purl.obolibrary.org/obo/CHEBI_2611 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26115 biolink:ChemicalEntity phytoalexin A toxin made by a plant that acts against an organism attacking it. Graph phytoalexins phytoalexins http://purl.obolibrary.org/obo/CHEBI_26115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26116 biolink:ChemicalEntity phytochromobilin A member of the class of bilins which functions as the chromophore of light-sensing phytochromes in plants. metacyc.compound:Phytochromobilins|pubmed:11263892|pubmed:1634523|pubmed:18658149|pubmed:21192668|pubmed:24261565|pubmed:7744741 Graph 3-{2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-[(Z)-{(3Z,4R)-3-[(1Z)-ethylidene]-4-methyl-5-oxopyrrolidin-2-ylidene}methyl]-4-methyl-1H-pyrrol-3-yl}propanoic acid|phytochromobilin 3-{2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-[(Z)-{(3Z,4R)-3-[(1Z)-ethylidene]-4-methyl-5-oxopyrrolidin-2-ylidene}methyl]-4-methyl-1H-pyrrol-3-yl}propanoic acid 3-{2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-[(Z)-{(3Z,4R)-3-[(1Z)-ethylidene]-4-methyl-5-oxopyrrolidin-2-ylidene}methyl]-4-methyl-1H-pyrrol-3-yl}propanoic acid|phytochromobilin http://purl.obolibrary.org/obo/CHEBI_26116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26118 biolink:ChemicalEntity phytoecdysteroid Graph phytoecdysteroids phytoecdysteroids http://purl.obolibrary.org/obo/CHEBI_26118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26119 biolink:ChemicalEntity phytoene Graph 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene http://purl.obolibrary.org/obo/CHEBI_26119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26124 biolink:ChemicalEntity phytosteroid Graph phytosteroids phytosteroids http://purl.obolibrary.org/obo/CHEBI_26124 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26125 biolink:ChemicalEntity phytosterols Sterols similar to cholesterol which occur in plants and vary only in carbon side chains and/or presence or absence of a double bond. wikipedia.en:Phytosterol Graph http://purl.obolibrary.org/obo/CHEBI_26125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26127 biolink:ChemicalEntity phytylnaphthoquinone Graph phytylnaphthoquinones phytylnaphthoquinones http://purl.obolibrary.org/obo/CHEBI_26127 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2613 biolink:ChemicalEntity Altanserin cas:76330-71-7|kegg.compound:C11734|lincs.smallmolecule:LSM-1987 Graph Altanserin Altanserin http://purl.obolibrary.org/obo/CHEBI_2613 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:26130 biolink:ChemicalEntity biological pigment An endogenous molecular entity that results in a colour of an organism as the consequence of the selective absorption of light. Graph pigments pigments http://purl.obolibrary.org/obo/CHEBI_26130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26133 biolink:ChemicalEntity pinane monoterpenoid A monoterpenoid based on a pinane skeleton (2,6,6-trimethylbicyclo[3.1.1]heptane) skeleton and its substituted derivatives. Graph pinane monoterpenoids pinane monoterpenoids http://purl.obolibrary.org/obo/CHEBI_26133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26144 biolink:ChemicalEntity piperazines Graph http://purl.obolibrary.org/obo/CHEBI_26144 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26145 biolink:ChemicalEntity piperideine Graph tetrahydropyridine tetrahydropyridine tetrahydropyridine http://purl.obolibrary.org/obo/CHEBI_26145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26147 biolink:ChemicalEntity piperidine alkaloid Graph piperidine alkaloids piperidine alkaloids http://purl.obolibrary.org/obo/CHEBI_26147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26148 biolink:ChemicalEntity piperidinemonocarboxylic acid Any member of the class of piperidines in which one of the carbons of the piperidine ring is substituted by a carboxy group. Graph piperidinemonocarboxylic acids piperidinemonocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_26148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26151 biolink:ChemicalEntity piperidines Graph http://purl.obolibrary.org/obo/CHEBI_26151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26153 biolink:ChemicalEntity p-menthadien-3-one Graph piperitenones piperitenones http://purl.obolibrary.org/obo/CHEBI_26153 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26155 biolink:ChemicalEntity plant growth regulator A chemical, natural or artificial, that can affect the rate of growth of a plant. Graph plant growth regulators plant growth regulators http://purl.obolibrary.org/obo/CHEBI_26155 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26157 biolink:ChemicalEntity plant growth stimulator Graph plant growth stimulators plant growth stimulators http://purl.obolibrary.org/obo/CHEBI_26157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:261649 biolink:ChemicalEntity bismuth subsalicylate A bismuth salt of salicylic acid. cas:14882-18-9|drugbank:DB01294|drugcentral:4257|gmelin:314795|kegg.compound:C07870|kegg.drug:D00728|pubmed:10425101 Graph 2-Hydroxy-benzo[1,3,2]dioxabismin-4-one|2-hydroxy-4H-1,3,2-benzodioxabismin-4-one|Bismuth subsalicylate|Wismutsubsalicylat|basic bismuth salicylate|bismuth oxide salicylate|bismuth oxysalicylate|pink bismuth 2-hydroxy-4H-1,3,2-benzodioxabismin-4-one 2-Hydroxy-benzo[1,3,2]dioxabismin-4-one|2-hydroxy-4H-1,3,2-benzodioxabismin-4-one|Bismuth subsalicylate|Wismutsubsalicylat|basic bismuth salicylate|bismuth oxide salicylate|bismuth oxysalicylate|pink bismuth http://purl.obolibrary.org/obo/CHEBI_261649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26167 biolink:ChemicalEntity polar amino acid Any amino acid whose side chain is capable of forming one or more hydrogen bonds. metacyc.compound:Polar-amino-acids|pubmed:12016058 Graph polar amino acid|polar amino acids|polar amino-acid|polar amino-acids polar amino acid|polar amino acids|polar amino-acid|polar amino-acids http://purl.obolibrary.org/obo/CHEBI_26167 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26172 biolink:ChemicalEntity poly(ribitol phosphate)s Graph http://purl.obolibrary.org/obo/CHEBI_26172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26174 biolink:ChemicalEntity poly(N-acetyllactosamine) An aminoglycan composed of a backbone of N-acetyllactosamine repeating units that are joined to each other via β-(1→3)-linkages. pubmed:10992504|pubmed:15459394 Graph (1->3)-[beta-D-Galp-(1->4)-beta-D-GlcpNAc]n|i-Antigen (1->3)-[beta-D-Galp-(1->4)-beta-D-GlcpNAc]n|i-Antigen http://purl.obolibrary.org/obo/CHEBI_26174 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26177 biolink:ChemicalEntity polyene antibiotic A family of antibiotics containing a conjugated polyene moiety, usuallly isolated from some species of Streptomyces. Graph polyene antibiotics polyene antibiotics http://purl.obolibrary.org/obo/CHEBI_26177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26178 biolink:ChemicalEntity polyester macromolecule A macromolecule composed of units connected by carboxylic ester (-O-CO-) linkages. beilstein:8192505 Graph polyester|polyesters polyester|polyesters http://purl.obolibrary.org/obo/CHEBI_26178 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26179 biolink:ChemicalEntity polyether antibiotic Graph polyether antibiotics polyether antibiotics http://purl.obolibrary.org/obo/CHEBI_26179 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2618 biolink:ChemicalEntity amantadine A member of the class of adamantanes that is used as an antiviral and antiparkinson drug. cas:768-94-5|drugbank:DB00915|drugcentral:144|gmelin:27066|kegg.compound:C06818|kegg.drug:D07441|pubmed:23011311|pubmed:24371305|pubmed:24427376|reaxys:2204333|vsdb:2961|wikipedia.en:Amantadine Graph 1-adamantanamine|1-adamantylamine|1-aminoadamantane|Amantadine|Amantidine|Aminoadamantane|Viregyt|Virosol|adamantan-1-ylamine|amantadina|amantadine|amantadinum|tricyclo[3.3.1.1(3,7)]decan-1-amine|tricyclo[3.3.1.1(3,7)]decan-1-ylamine|tricyclo[3.3.1.1(3,7)]decane-1-amine adamantan-1-ylamine 1-adamantanamine|1-adamantylamine|1-aminoadamantane|Amantadine|Amantidine|Aminoadamantane|Viregyt|Virosol|adamantan-1-ylamine|amantadina|amantadine|amantadinum|tricyclo[3.3.1.1(3,7)]decan-1-amine|tricyclo[3.3.1.1(3,7)]decan-1-ylamine|tricyclo[3.3.1.1(3,7)]decane-1-amine http://purl.obolibrary.org/obo/CHEBI_2618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26185 biolink:ChemicalEntity polyprenyl glycosyl phosphate Graph polyprenyl glycosyl phosphates polyprenyl glycosyl phosphates http://purl.obolibrary.org/obo/CHEBI_26185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26186 biolink:ChemicalEntity polyprenyl phospho oligosaccharide Graph polyprenyl phospho oligosaccharides polyprenyl phospho oligosaccharides http://purl.obolibrary.org/obo/CHEBI_26186 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26187 biolink:ChemicalEntity polyprenyl phospho carbohydrate Graph polyprenyl phospho carbohydrates polyprenyl phospho carbohydrates http://purl.obolibrary.org/obo/CHEBI_26187 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26188 biolink:ChemicalEntity polyketide Natural and synthetic compounds containing alternating carbonyl and methylene groups ('β-polyketones'), biogenetically derived from repeated condensation of acetyl coenzyme A (via malonyl coenzyme A), and usually the compounds derived from them by further condensations, etc. Considered by many to be synonymous with the less frequently used terms acetogenins and ketides. Graph polyketide|polyketides polyketide|polyketides http://purl.obolibrary.org/obo/CHEBI_26188 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26191 biolink:ChemicalEntity polyol A compound that contains two or more hydroxy groups. Graph polyols polyols http://purl.obolibrary.org/obo/CHEBI_26191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26195 biolink:ChemicalEntity polyphenol Members of the class of phenols that contain 2 or more benzene rings each of which is substituted by at least one hydroxy group. wikipedia.en:Polyphenol Graph polyphenols polyphenols http://purl.obolibrary.org/obo/CHEBI_26195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26196 biolink:ChemicalEntity polyphenylpropanoid Graph polyphenylpropanoids polyphenylpropanoids http://purl.obolibrary.org/obo/CHEBI_26196 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26199 biolink:ChemicalEntity polyprenol Any member of the class of prenols possessing the general formula H-[CH2C(Me)=CHCH2]nOH in which the carbon skeleton is composed of more than one isoprene units. kegg.compound:C06081 Graph polyprenols polyprenols http://purl.obolibrary.org/obo/CHEBI_26199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26201 biolink:ChemicalEntity polyprenyl group Graph polyprenyl groups polyprenyl groups http://purl.obolibrary.org/obo/CHEBI_26201 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26203 biolink:ChemicalEntity polyprenol triphosphate Graph polyprenol triphosphates polyprenol triphosphates http://purl.obolibrary.org/obo/CHEBI_26203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26207 biolink:ChemicalEntity polyterpenoid A polymeric terpenoid having a C5n skeleton, where n is greater than 8. Graph politerpenoides|polyterpenoids politerpenoides|polyterpenoids http://purl.obolibrary.org/obo/CHEBI_26207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26208 biolink:ChemicalEntity polyunsaturated fatty acid Any fatty acid containing more than one double bond. Acids in this group are reported to have cardioprotective effects; and levels are lowered in chronic fatigue syndrome. pubmed:14977874|pubmed:16380690|pubmed:17891522 Graph PUFA|PUFAs|polyunsaturated fatty acids PUFA|PUFAs|polyunsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_26208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26211 biolink:ChemicalEntity poriferastane Graph poriferastane poriferastane poriferastane http://purl.obolibrary.org/obo/CHEBI_26211 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26214 biolink:ChemicalEntity porphyrins Natural pigments containing a fundamental skeleton of four pyrrole nuclei united through the α-positions by four methine groups to form a macrocyclic structure. wikipedia.en:Porphyrin Graph porphyrins porphyrins porphyrins http://purl.obolibrary.org/obo/CHEBI_26214 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26216 biolink:ChemicalEntity potassium atom cas:7440-09-7|drugbank:DB01345|kegg.compound:C00238|webelements:K Graph 19K|K|Kalium|kalium|potasio|potassium potassium 19K|K|Kalium|kalium|potasio|potassium http://purl.obolibrary.org/obo/CHEBI_26216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26217 biolink:ChemicalEntity potassium molecular entity Graph potassium molecular entities|potassium molecular entity potassium molecular entities|potassium molecular entity http://purl.obolibrary.org/obo/CHEBI_26217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26218 biolink:ChemicalEntity potassium salt Any alkali metal salt having potassium(1+) as the cation. Graph Kaliumsalz|Kaliumsalze|potassium salts Kaliumsalz|Kaliumsalze|potassium salts http://purl.obolibrary.org/obo/CHEBI_26218 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2622 biolink:ChemicalEntity amarogentin A secoiridoid glycoside that consists of (4aS,5R,6R)-5-ethenyl-6-hydroxy-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one having a 2-O-[(3,3',5-trihydroxybiphenyl-2-yl)carbonyl]-β-D-glucopyranosyl group attached at position 6 via a glycosidic linkage. cas:21018-84-8|kegg.compound:C09767|knapsack:C00003070|pubmed:8720386|reaxys:74677|wikipedia.en:Amarogentin Graph (4aR)-5t-ethenyl-6c-[O(2)-(3,5,3'-trihydroxybiphenyl-2-ylcarbonyl)-beta-D-glucopyranosyloxy]-4,4ar,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one|(4aS,5R,6S)-5-ethenyl-1-oxo-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-6-yl- 2-O-[(3,3',5-trihydroxybiphenyl-2-yl)carbonyl]-beta-D-glucopyranoside|Amarogentin|sweroside-2'-(3'',5'',3'''-trihydroxydiphenyl)-2''-carboxylic acid ester (4aR)-5t-ethenyl-6c-[O(2)-(3,5,3'-trihydroxybiphenyl-2-ylcarbonyl)-beta-D-glucopyranosyloxy]-4,4ar,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one (4aR)-5t-ethenyl-6c-[O(2)-(3,5,3'-trihydroxybiphenyl-2-ylcarbonyl)-beta-D-glucopyranosyloxy]-4,4ar,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one|(4aS,5R,6S)-5-ethenyl-1-oxo-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-6-yl- 2-O-[(3,3',5-trihydroxybiphenyl-2-yl)carbonyl]-beta-D-glucopyranoside|Amarogentin|sweroside-2'-(3'',5'',3'''-trihydroxydiphenyl)-2''-carboxylic acid ester http://purl.obolibrary.org/obo/CHEBI_2622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26228 biolink:ChemicalEntity precorrin Any of the intermediates in the biosynthesis of vitamin B12 from uroporphyrinogen III that lie on the pathway before the formation of the first corrin macrocycle. The figure after 'precorrin' corresponds to the number of C-methyl groups introduced into the tetrapyrrole framework. Graph precorrins precorrins http://purl.obolibrary.org/obo/CHEBI_26228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2624 biolink:ChemicalEntity amastatin A tetrapeptide comprising (2S,3R)-3-amino-2-hydroxy-5-methylhexanoyl, L-valyl, L-valyl and L-aspartic acid units joined in sequence cas:67655-94-1|kegg.compound:C01552|knapsack:C00018188|pubmed:18440066|reaxys:24145991|reaxys:4727847 Graph Amastatin|Leu[1psi,CHOHCONH]ValValAsp|N-[(2S,3R)-3-amino-2-hydroxy-5-methylhexanoyl]-L-valyl-L-valyl-L-aspartic acid N-[(2S,3R)-3-amino-2-hydroxy-5-methylhexanoyl]-L-valyl-L-valyl-L-aspartic acid Amastatin|Leu[1psi,CHOHCONH]ValValAsp|N-[(2S,3R)-3-amino-2-hydroxy-5-methylhexanoyl]-L-valyl-L-valyl-L-aspartic acid http://purl.obolibrary.org/obo/CHEBI_2624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26244 biolink:ChemicalEntity prenols Any alcohol possessing the general formula H-[CH2C(Me)=CHCH2]nOH in which the carbon skeleton is composed of one or more isoprene units (biogenetic precursors of the isoprenoids). pubmed:3113948|pubmed:4207873 Graph prenols prenols prenols http://purl.obolibrary.org/obo/CHEBI_26244 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26248 biolink:ChemicalEntity prenyl group Graph 3-methyl-2-butenyl group|3-methylbut-2-en-1-yl|dimethylallyl|gamma,gamma-dimethylallyl 3-methylbut-2-en-1-yl 3-methyl-2-butenyl group|3-methylbut-2-en-1-yl|dimethylallyl|gamma,gamma-dimethylallyl http://purl.obolibrary.org/obo/CHEBI_26248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26249 biolink:ChemicalEntity prenyl groups Graph prenyl groups prenyl groups http://purl.obolibrary.org/obo/CHEBI_26249 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26250 biolink:ChemicalEntity prenol phosphate Graph prenol phosphates prenol phosphates http://purl.obolibrary.org/obo/CHEBI_26250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26253 biolink:ChemicalEntity polyprenylhydroquinone A hydroquinone compound having a polyprenyl substituent in an unspecified position. Graph http://purl.obolibrary.org/obo/CHEBI_26253 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26254 biolink:ChemicalEntity prenylnaphthoquinone Any napthoquinone that is substituted at position 2 by a prenyl or polyprenyl group. The term also includes compounds that are functionalised on the prenyl or polyprenyl chain (e.g. by a hydroxy group). Graph prenylnaphthoquinones prenylnaphthoquinones http://purl.obolibrary.org/obo/CHEBI_26254 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26255 biolink:ChemicalEntity prenylquinone A quinone substituted by a polyprenyl-derived side-chain. Prenylquinones occur in all living cells. Due to their amphiphilic character, they are mainly located in biological membranes where they function as electron and proton carriers in the photosynthetic and respiratory electron transport chains. Some prenylquinones also perform more specialised roles sucy as antioxidants and enzyme cofactors. Prenylquinones are classified according to ring structure: the main classes are menaquinones, phylloquinones, ubiquinones and plastoquinones. pubmed:19928587|pubmed:21777468|pubmed:21844348|pubmed:22371323|pubmed:3985624 Graph polyprenylquinone|polyprenylquinones|prenylquinones polyprenylquinone|polyprenylquinones|prenylquinones http://purl.obolibrary.org/obo/CHEBI_26255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26267 biolink:ChemicalEntity proanthocyanidin A flavonoid oligomer obtained by the the condensation of two or more units of hydroxyflavans. wikipedia.en:Proanthocyanidin Graph condensed tannins|polyflavonoid tannins|proanthocyanidins condensed tannins|polyflavonoid tannins|proanthocyanidins http://purl.obolibrary.org/obo/CHEBI_26267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26271 biolink:ChemicalEntity proline An α-amino acid that is pyrrolidine bearing a carboxy substituent at position 2. cas:609-36-9|gmelin:26927|kegg.compound:C16435|pubmed:16534801|pubmed:21400017|pubmed:21903295|pubmed:22264337|pubmed:22280966|pubmed:22770225|reaxys:80809|wikipedia.en:Proline Graph DL-Proline|Hpro|Prolin|prolina|proline|pyrrolidine-2-carboxylic acid proline DL-Proline|Hpro|Prolin|prolina|proline|pyrrolidine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_26271 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26273 biolink:ChemicalEntity proline derivative An amino acid derivative resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of proline by a heteroatom. The definition normally excludes peptides containing proline residues. Graph proline derivatives proline derivatives http://purl.obolibrary.org/obo/CHEBI_26273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26279 biolink:ChemicalEntity propan-1-ols A primary alcohol based on a propan-1-olskeleton and its substituted derivatives. Graph propan-1-ols propan-1-ols http://purl.obolibrary.org/obo/CHEBI_26279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2628 biolink:ChemicalEntity ambenonium chloride A symmetrical oxalamide-based bis-quaternary ammonium salt having ethyl and 2-chlorobenzyl groups attached to the nitrogens. beilstein:7563564|cas:115-79-7|drugbank:DB01122|kegg.drug:D01001|patent:DE1024517|pubmed:13584150|pubmed:13646199|pubmed:13800669|pubmed:13800670|pubmed:13919451|pubmed:14183638|pubmed:14234274|pubmed:1823874|pubmed:2613842|pubmed:2730696|pubmed:3429595|pubmed:3912090|pubmed:481753|pubmed:7252521 Graph (Oxalylbis(iminoethylene))bis((o-chlorobenzyl)diethylammonium) dichloride|2,2'-[(1,2-dioxoethane-1,2-diyl)diimino]bis[N-(2-chlorobenzyl)-N,N-diethylethanaminium] dichloride|Ambenonium dichloride|Ambestigmin chloride|Chlorure d'ambenonium|Cloruro de ambenonio|N,N'-Bis(2-diethylaminoethyl)oxamide bis(2-chlorobenzyl chloride)|ambenonii chloridum|ambenonium chloride 2,2'-[(1,2-dioxoethane-1,2-diyl)diimino]bis[N-(2-chlorobenzyl)-N,N-diethylethanaminium] dichloride (Oxalylbis(iminoethylene))bis((o-chlorobenzyl)diethylammonium) dichloride|2,2'-[(1,2-dioxoethane-1,2-diyl)diimino]bis[N-(2-chlorobenzyl)-N,N-diethylethanaminium] dichloride|Ambenonium dichloride|Ambestigmin chloride|Chlorure d'ambenonium|Cloruro de ambenonio|N,N'-Bis(2-diethylaminoethyl)oxamide bis(2-chlorobenzyl chloride)|ambenonii chloridum|ambenonium chloride http://purl.obolibrary.org/obo/CHEBI_2628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26282 biolink:ChemicalEntity propanals An aldehyde based on a propanal skeleton and its derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_26282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26284 biolink:ChemicalEntity propane-1,2-diols Graph propane-1,2-diols propane-1,2-diols http://purl.obolibrary.org/obo/CHEBI_26284 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26287 biolink:ChemicalEntity propane-1,3-diols Any propanediol bearing hydroxy groups at positions 1 and 3. Graph http://purl.obolibrary.org/obo/CHEBI_26287 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26288 biolink:ChemicalEntity propanediol Graph propanediols propanediols http://purl.obolibrary.org/obo/CHEBI_26288 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26292 biolink:ChemicalEntity propanones A ketone that is propane carrying at least one oxo substituent. Graph http://purl.obolibrary.org/obo/CHEBI_26292 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26294 biolink:ChemicalEntity propionyl group Graph CH3-CH2-CO-|Pp|propanoyl|propionyl propanoyl CH3-CH2-CO-|Pp|propanoyl|propionyl http://purl.obolibrary.org/obo/CHEBI_26294 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26296 biolink:ChemicalEntity propanoyl-CoAs Any short-chain fatty acyl-CoA in which the the fatty acid specified is propanoic acid or its derivatives. Graph propionoyl-CoAs propionoyl-CoAs http://purl.obolibrary.org/obo/CHEBI_26296 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26300 biolink:ChemicalEntity propenol Graph propenols propenols http://purl.obolibrary.org/obo/CHEBI_26300 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2631 biolink:ChemicalEntity amentoflavone A biflavonoid that is obtained by oxidative coupling of two molecules of apigenin resulting in a bond between positions C-3 of the hydroxyphenyl ring and C-8 of the chromene ring. A natural product found particularly in Ginkgo biloba and Hypericum perforatum. cas:1617-53-4|hmdb:HMDB0030832|kegg.compound:C10018|knapsack:C00001015|lipidmaps:LMPK12040009|pubmed:11256492|pubmed:12372862|pubmed:15130600|pubmed:16084098|pubmed:18298378|reaxys:380244|wikipedia.en:Amentoflavone Graph 3',8''-Biapigenin|8-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|Didemethyl-ginkgetin 8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 3',8''-Biapigenin|8-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|Didemethyl-ginkgetin http://purl.obolibrary.org/obo/CHEBI_2631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26333 biolink:ChemicalEntity prostaglandin Naturally occurring compounds derived from the parent C20 acid, prostanoic acid. cas:11000-26-3|lipidmaps_class:LMFA0301 Graph prostaglandin|prostaglandins prostaglandins prostaglandin|prostaglandins http://purl.obolibrary.org/obo/CHEBI_26333 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26334 biolink:ChemicalEntity prostaglandins A Graph PGA PGA http://purl.obolibrary.org/obo/CHEBI_26334 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26335 biolink:ChemicalEntity prostaglandins B Graph PGB PGB http://purl.obolibrary.org/obo/CHEBI_26335 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26336 biolink:ChemicalEntity prostaglandins C Graph PGC PGC http://purl.obolibrary.org/obo/CHEBI_26336 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26337 biolink:ChemicalEntity prostaglandins D Graph PGD PGD http://purl.obolibrary.org/obo/CHEBI_26337 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26338 biolink:ChemicalEntity prostaglandins E Graph PGE PGE http://purl.obolibrary.org/obo/CHEBI_26338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2634 biolink:ChemicalEntity amidine Derivatives of oxoacids RnE(=O)OH in which the hydroxy group is replaced by an amino group and the oxo group is replaced by =NR. In organic chemistry an unspecified amidine is commonly a carboxamidine. Graph Amidines|amidine|amidines amidines Amidines|amidine|amidines http://purl.obolibrary.org/obo/CHEBI_2634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26340 biolink:ChemicalEntity prostaglandins F Graph PGF PGF http://purl.obolibrary.org/obo/CHEBI_26340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26343 biolink:ChemicalEntity prostaglandins G Graph PGG PGG http://purl.obolibrary.org/obo/CHEBI_26343 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26344 biolink:ChemicalEntity prostaglandins H Graph PGH PGH http://purl.obolibrary.org/obo/CHEBI_26344 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26345 biolink:ChemicalEntity prostaglandins I Graph PGI PGI http://purl.obolibrary.org/obo/CHEBI_26345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26346 biolink:ChemicalEntity prostaglandins J Graph PGJ PGJ http://purl.obolibrary.org/obo/CHEBI_26346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26347 biolink:ChemicalEntity prostanoid The family of natural prostaglandins and prostaglandin-like compounds including prostacyclins and thromboxanes. Graph prostanoid|prostanoids prostanoids prostanoid|prostanoids http://purl.obolibrary.org/obo/CHEBI_26347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26348 biolink:ChemicalEntity prosthetic group A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity. Graph groupe prosthetique|prosthetic group|prosthetic groups prosthetic group groupe prosthetique|prosthetic group|prosthetic groups http://purl.obolibrary.org/obo/CHEBI_26348 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26349 biolink:ChemicalEntity chondroitin sulfate proteoglycan Proteoglycans found in cartilage that consist of several chondroitin sulfate molecules linked to protein(s) by neutral sugar linkage regions. pubmed:31939650|pubmed:32337544|pubmed:32936033|pubmed:33185866|pubmed:33433495|pubmed:33453083|pubmed:34449046|pubmed:35142672|pubmed:35285688|pubmed:35465334|pubmed:35614038|pubmed:36398653|pubmed:36517521|pubmed:36662459|pubmed:37307832|pubmed:37465214|pubmed:37488865|pubmed:38146224|pubmed:38621597|pubmed:38819695|pubmed:39104100|pubmed:39260032|pubmed:39303705|pubmed:39864280|wikipedia.en:Chondroitin_sulfate_proteoglycan Graph CSPG|CSPGs|chondroitin sulfate proteoglycans|proteochondroitin sulfate|proteochondroitin sulfates CSPG|CSPGs|chondroitin sulfate proteoglycans|proteochondroitin sulfate|proteochondroitin sulfates http://purl.obolibrary.org/obo/CHEBI_26349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26354 biolink:ChemicalEntity protochlorophyllides Graph protochlorophyllides protochlorophyllides http://purl.obolibrary.org/obo/CHEBI_26354 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26355 biolink:ChemicalEntity heme b A metalloprotoporphyrin in which the four pyrrole nitrogens of the protoporphyrin moiety are coordinated to iron. It is the most abundant of the heme compounds. cas:14875-96-8|ecmdb:ECMDB03178|kegg.compound:C00032|pdb-ccd:HEM|pdb:3KS0|pubmed:20546754|pubmed:29286160|wikipedia.en:Heme_B Graph (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)iron|(protoporphyrinato)iron|Haem|Heme B|PROTOPORPHYRIN IX CONTAINING FE|Protoheme|Protoheme IX|[3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron|heme|heme b|protoheme (protoporphyrinato)iron (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)iron|(protoporphyrinato)iron|Haem|Heme B|PROTOPORPHYRIN IX CONTAINING FE|Protoheme|Protoheme IX|[3,7,12,17-tetramethyl-8,13-divinylporphyrin-2,18-dipropanoato(2-)]iron|heme|heme b|protoheme http://purl.obolibrary.org/obo/CHEBI_26355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2636 biolink:ChemicalEntity amifostine An organic thiophosphate that is the S-phospho derivative of 2-[(3-aminopropyl)amino]ethanethiol. A prodrug for the free thiol, WR-1065, which is used as a cytoprotectant in cancer chemotherapy and radiotherapy. cas:20537-88-6|drugbank:DB01143|drugcentral:156|hmdb:HMDB0015274|kegg.compound:C06819|lincs.smallmolecule:LSM-4721|patent:US3892824|pubmed:10553165|pubmed:10942928|pubmed:11013273|pubmed:11201306|pubmed:11984063|pubmed:12005544|pubmed:12433814|pubmed:12499421|pubmed:12561384|pubmed:12751907|pubmed:14980067|pubmed:15380592|pubmed:15698860|pubmed:15875769|pubmed:16465691|pubmed:17602063|pubmed:18072151|pubmed:18549666|pubmed:19712749|pubmed:20334641|pubmed:21347716|pubmed:21646919|pubmed:22267539|pubmed:22402174|pubmed:22440042|pubmed:22456378|pubmed:22496587|pubmed:22643562|pubmed:22844290|pubmed:22878481|pubmed:22885239|pubmed:22989457|pubmed:23040218|pubmed:23052919|pubmed:23092832|pubmed:23401928|pubmed:8612469|pubmed:8683243|reaxys:2088122|wikipedia.en:Amifostine Graph Amifostine|Ethyol|S-{2-[(3-aminopropyl)amino]ethyl} dihydrogen thiophosphate|amifostina|amifostine|amifostinum S-{2-[(3-aminopropyl)amino]ethyl} dihydrogen thiophosphate Amifostine|Ethyol|S-{2-[(3-aminopropyl)amino]ethyl} dihydrogen thiophosphate|amifostina|amifostine|amifostinum http://purl.obolibrary.org/obo/CHEBI_2636 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26361 biolink:ChemicalEntity protoporphyrins wikipedia.en:Protoporphyrin Graph protoporphyrins protoporphyrins http://purl.obolibrary.org/obo/CHEBI_26361 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26366 biolink:ChemicalEntity pseudouridines Graph http://purl.obolibrary.org/obo/CHEBI_26366 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26369 biolink:ChemicalEntity psoralens A furanocoumarin with a 7H-furo[3,2-g]chromen-7-one skeleton and its substituted derivatives thereof. Graph psoralenes psoralenes http://purl.obolibrary.org/obo/CHEBI_26369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2637 biolink:ChemicalEntity amikacin An amino cyclitol glycoside that is kanamycin A acylated at the N-1 position by a 4-amino-2-hydroxybutyryl group. cas:37517-28-5|drugbank:DB00479|drugcentral:157|hmdb:HMDB0014622|kegg.compound:C06820|kegg.drug:D02543|lincs.smallmolecule:LSM-5935|metacyc.compound:CPD-14197|patent:DE2234315|patent:US3781268|pubmed:11744283|pubmed:15305513|pubmed:17365906|pubmed:19495517|pubmed:19752274|pubmed:20195673|pubmed:25296102|pubmed:25327505|pubmed:25339395|pubmed:25630642|pubmed:8622103|pubmed:8622117|pubmed:9327246|reaxys:5915117|wikipedia.en:Amikacin Graph (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-4-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-3-hydroxycyclohexyl]-2-hydroxybutanamide|1-N-(L(-)-gamma-amino-alpha-hydroxybutyryl)kanamycin A|Amikacin|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1->6))-N(3)-(4-amino-L-2-hydroxybutyryl)-2-deoxy-L-streptamine|amikacin|amikacina|amikacine|amikacinum (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-4-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-3-hydroxycyclohexyl]-2-hydroxybutanamide (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-4-(6-amino-6-deoxy-alpha-D-glucopyranosyloxy)-3-hydroxycyclohexyl]-2-hydroxybutanamide|1-N-(L(-)-gamma-amino-alpha-hydroxybutyryl)kanamycin A|Amikacin|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1->6))-N(3)-(4-amino-L-2-hydroxybutyryl)-2-deoxy-L-streptamine|amikacin|amikacina|amikacine|amikacinum http://purl.obolibrary.org/obo/CHEBI_2637 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26373 biolink:ChemicalEntity pteridines Graph http://purl.obolibrary.org/obo/CHEBI_26373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26374 biolink:ChemicalEntity pterin cas:2236-60-4|kegg.compound:C00715 Graph 4-oxopterin|pteridoxamine|pterin 4-oxopterin|pteridoxamine|pterin http://purl.obolibrary.org/obo/CHEBI_26374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26375 biolink:ChemicalEntity pterins Graph http://purl.obolibrary.org/obo/CHEBI_26375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26377 biolink:ChemicalEntity pterocarpans Members of the class of benzofurochromene with a 6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene skeleton and its substituted derivatives. They generally bear structural resemblance to isoflavanoids that possess antibiotic activity and are produced by plant tissues in response to infection. They are the 3,4-dihydroderivatives of coumestans. metacyc.compound:PTEROCARPANS|wikipedia.en:Pterocarpan Graph isoflavonoid phytoalexin|isoflavonoid phytoalexins isoflavonoid phytoalexin|isoflavonoid phytoalexins http://purl.obolibrary.org/obo/CHEBI_26377 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26381 biolink:ChemicalEntity p-menth-4(8)-en-3-one A p-menthane monoterpenoid that is cyclohexan-1-one substituted by a methyl group at position 5 and a propan-2-ylidene group at position 2. cas:15932-80-6|pubmed:24506214 Graph (+-)-Pulegone|1-Isopropylidene-4-methyl-2-cyclohexanone|1-Methyl-4-isopropylidene-3-cyclohexanone|4(8)-p-Menthen-3-one|5-Methyl-2-(1-methylethylidene)cyclohexanone|5-Methyl-2-isopropylidenecyclohexanone|5-methyl-2-(propan-2-ylidene)cyclohexan-1-one|Pulegone|p-menth-4(8)-en-3-one 5-methyl-2-(propan-2-ylidene)cyclohexan-1-one|p-menth-4(8)-en-3-one (+-)-Pulegone|1-Isopropylidene-4-methyl-2-cyclohexanone|1-Methyl-4-isopropylidene-3-cyclohexanone|4(8)-p-Menthen-3-one|5-Methyl-2-(1-methylethylidene)cyclohexanone|5-Methyl-2-isopropylidenecyclohexanone|5-methyl-2-(propan-2-ylidene)cyclohexan-1-one|Pulegone|p-menth-4(8)-en-3-one http://purl.obolibrary.org/obo/CHEBI_26381 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26384 biolink:ChemicalEntity pullulans Graph pullulans pullulans http://purl.obolibrary.org/obo/CHEBI_26384 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26385 biolink:ChemicalEntity purine alkaloid Graph purine alkaloids purine alkaloids http://purl.obolibrary.org/obo/CHEBI_26385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26386 biolink:ChemicalEntity purine nucleobase A nucleobase whose skeleton is derived from purine. kegg.compound:C15587 Graph a purine nucleobase|purine bases|purine nucleobase|purine nucleobases a purine nucleobase|purine bases|purine nucleobase|purine nucleobases http://purl.obolibrary.org/obo/CHEBI_26386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26387 biolink:ChemicalEntity purine 2'-deoxyribonucleoside diphosphate Graph purine 2'-deoxyribonucleoside diphosphates purine 2'-deoxyribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26388 biolink:ChemicalEntity purine 2'-deoxyribonucleoside monophosphate Graph purine 2'-deoxyribonucleoside monophosphates purine 2'-deoxyribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26388 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26389 biolink:ChemicalEntity purine deoxyribonucleoside triphosphate Graph purine deoxyribonucleoside triphosphates purine deoxyribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2639 biolink:ChemicalEntity amiloride A member of the class of pyrazines resulting from the formal monoacylation of guanidine with the carboxy group of 3,5-diamino-6-chloropyrazine-2-carboxylic acid. beilstein:616612|cas:2609-46-3|drugbank:DB00594|drugcentral:158|hmdb:HMDB0014732|kegg.compound:C06821|kegg.drug:D07447|lincs.smallmolecule:LSM-4194|metacyc.compound:CPD-10324|patent:BE639386|patent:US3313813|pdb-ccd:AMR|pubmed:16020936|pubmed:24410943|pubmed:24419567|pubmed:9124403|reaxys:657410|wikipedia.en:Amiloride Graph 3,5-diamino-N-[amino(imino)methyl]-6-chloropyrazine-2-carboxamide|3,5-diamino-N-carbamimidoyl-6-chloropyrazine-2-carboxamide|Amiloride|N-Amidino-3,5-diamino-6-chloropyrazinecarboxamide|amilorida|amiloride|amiloridum 3,5-diamino-N-[amino(imino)methyl]-6-chloropyrazine-2-carboxamide 3,5-diamino-N-[amino(imino)methyl]-6-chloropyrazine-2-carboxamide|3,5-diamino-N-carbamimidoyl-6-chloropyrazine-2-carboxamide|Amiloride|N-Amidino-3,5-diamino-6-chloropyrazinecarboxamide|amilorida|amiloride|amiloridum http://purl.obolibrary.org/obo/CHEBI_2639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26390 biolink:ChemicalEntity purine 2'-deoxyribonucleotide Graph purine 2'-deoxyribonucleotides purine 2'-deoxyribonucleotides http://purl.obolibrary.org/obo/CHEBI_26390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26391 biolink:ChemicalEntity purine nucleoside diphosphate Graph purine nucleoside diphosphates purine nucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26392 biolink:ChemicalEntity purine nucleoside monophosphate Graph purine nucleoside monophosphates purine nucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26392 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26393 biolink:ChemicalEntity purine nucleoside triphosphate Graph purine nucleoside triphosphates purine nucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26394 biolink:ChemicalEntity purine nucleoside Graph purine nucleoside|purine nucleosides purine nucleoside|purine nucleosides http://purl.obolibrary.org/obo/CHEBI_26394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26395 biolink:ChemicalEntity purine nucleotide Any nucleotide that has a purine nucleobase. Graph purine nucleotides purine nucleotides http://purl.obolibrary.org/obo/CHEBI_26395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26396 biolink:ChemicalEntity purine ribonucleoside diphosphate Graph purine ribonucleoside diphosphates purine ribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26397 biolink:ChemicalEntity purine ribonucleoside monophosphate Graph purine ribonucleoside monophosphates purine ribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26398 biolink:ChemicalEntity purine ribonucleoside triphosphate Graph purine ribonucleoside triphosphates purine ribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26399 biolink:ChemicalEntity purine ribonucleoside A ribonucleoside that has a purine moiety as the nucleobase (the R group in the illustration). Graph purine ribonucleosides purine ribonucleosides http://purl.obolibrary.org/obo/CHEBI_26399 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26400 biolink:ChemicalEntity purine ribonucleotide Any ribonucleotide that has a purine nucleobase. Graph purine ribonucleotides purine ribonucleotides http://purl.obolibrary.org/obo/CHEBI_26400 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26401 biolink:ChemicalEntity purines A class of imidazopyrimidines that consists of purine and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_26401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26404 biolink:ChemicalEntity puromycins Graph puromycins puromycins http://purl.obolibrary.org/obo/CHEBI_26404 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26406 biolink:ChemicalEntity N-substituted putrescine Graph N-substituted putrescines|putrescines N-substituted putrescines|putrescines http://purl.obolibrary.org/obo/CHEBI_26406 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26407 biolink:ChemicalEntity pyrans Graph http://purl.obolibrary.org/obo/CHEBI_26407 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26410 biolink:ChemicalEntity pyrazoles Graph http://purl.obolibrary.org/obo/CHEBI_26410 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26413 biolink:ChemicalEntity pyrethroid insecticide Graph pyrethroid insecticides pyrethroid insecticides http://purl.obolibrary.org/obo/CHEBI_26413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26414 biolink:ChemicalEntity pyridazinone Graph pyridazinones pyridazinones http://purl.obolibrary.org/obo/CHEBI_26414 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26416 biolink:ChemicalEntity pyridine alkaloid Graph pyridine alkaloids pyridine alkaloids http://purl.obolibrary.org/obo/CHEBI_26416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26420 biolink:ChemicalEntity pyridinemonocarboxylic acid A monocarboxylic acid in which the carboxy group is attached to a pyridine (or substituted pyridine) ring. Graph pyridinemonocarboxylic acids pyridinemonocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_26420 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26421 biolink:ChemicalEntity pyridines Any organonitrogen heterocyclic compound based on a pyridine skeleton and its substituted derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_26421 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26432 biolink:ChemicalEntity pyrimidine nucleobase A nucleobase whose skeleton is derived from pyrimidine. Graph a pyrimidine nucleobase|pyrimidine bases|pyrimidine nucleobase|pyrimidine nucleobases a pyrimidine nucleobase|pyrimidine bases|pyrimidine nucleobase|pyrimidine nucleobases http://purl.obolibrary.org/obo/CHEBI_26432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26433 biolink:ChemicalEntity pyrimidine 2'-deoxyribonucleoside diphosphate Graph pyrimidine 2'-deoxyribonucleoside diphosphates pyrimidine 2'-deoxyribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26434 biolink:ChemicalEntity pyrimidine 2'-deoxyribonucleoside monophosphate Graph pyrimidine 2'-deoxyribonucleoside monophosphates pyrimidine 2'-deoxyribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26434 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26435 biolink:ChemicalEntity pyrimidine deoxyribonucleoside triphosphate Graph pyrimidine deoxyribonucleoside triphosphates pyrimidine deoxyribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26435 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26436 biolink:ChemicalEntity pyrimidine 2'-deoxyribonucleotide Graph pyrimidine 2'-deoxyribonucleotides pyrimidine 2'-deoxyribonucleotides http://purl.obolibrary.org/obo/CHEBI_26436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26437 biolink:ChemicalEntity pyrimidine nucleoside diphosphate Graph pyrimidine nucleoside diphosphates pyrimidine nucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26437 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26438 biolink:ChemicalEntity pyrimidine nucleoside monophosphate Graph pyrimidine nucleoside monophosphates pyrimidine nucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26439 biolink:ChemicalEntity pyrimidine nucleoside triphosphate Graph pyrimidine nucleoside triphosphates pyrimidine nucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26439 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26440 biolink:ChemicalEntity pyrimidine nucleoside kegg.compound:C03169 Graph N-D-Ribosylpyrimidine|pyrimidine nucleosides N-D-Ribosylpyrimidine|pyrimidine nucleosides http://purl.obolibrary.org/obo/CHEBI_26440 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26441 biolink:ChemicalEntity pyrimidine nucleotide Graph pyrimidine nucleotides pyrimidine nucleotides http://purl.obolibrary.org/obo/CHEBI_26441 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26442 biolink:ChemicalEntity pyrimidine ribonucleoside diphosphate Graph pyrimidine ribonucleoside diphosphates pyrimidine ribonucleoside diphosphates http://purl.obolibrary.org/obo/CHEBI_26442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26443 biolink:ChemicalEntity pyrimidine ribonucleoside monophosphate Graph pyrimidine ribonucleoside monophosphates pyrimidine ribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26443 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26444 biolink:ChemicalEntity pyrimidine ribonucleoside triphosphate Graph pyrimidine ribonucleoside triphosphates pyrimidine ribonucleoside triphosphates http://purl.obolibrary.org/obo/CHEBI_26444 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26446 biolink:ChemicalEntity pyrimidine ribonucleotide Graph pyrimidine ribonucleotides pyrimidine ribonucleotides http://purl.obolibrary.org/obo/CHEBI_26446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26447 biolink:ChemicalEntity pyrimidinemonocarboxylic acid Graph pyrimidinemonocarboxylic acids pyrimidinemonocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_26447 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26452 biolink:ChemicalEntity pyrrolecarboxylate A monocarboxylic acid anion comprising any pyrrole carrying a single carboxylate substiuent. Graph pyrrolecarboxylates pyrrolecarboxylates http://purl.obolibrary.org/obo/CHEBI_26452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26454 biolink:ChemicalEntity pyrrolecarboxylic acid Any pyrrole carrying a single carboxylic acid group. Graph pyrrolecarboxylic acids pyrrolecarboxylic acids http://purl.obolibrary.org/obo/CHEBI_26454 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26455 biolink:ChemicalEntity pyrroles An azole that includes only one N atom and no other heteroatom as a part of the aromatic skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_26455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26456 biolink:ChemicalEntity pyrrolidine alkaloid Graph pyrrolidine alkaloids pyrrolidine alkaloids http://purl.obolibrary.org/obo/CHEBI_26456 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26457 biolink:ChemicalEntity 1-pyrrolinecarboxylate A monocarboxylic acid anion resulting from the removal of the proton from the carboxy group of any 1-pyrrolinecarboxylic acid. Graph 1-pyrrolinecarboxylates 1-pyrrolinecarboxylates http://purl.obolibrary.org/obo/CHEBI_26457 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26461 biolink:ChemicalEntity pyrroloquinoline cofactor Graph http://purl.obolibrary.org/obo/CHEBI_26461 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26463 biolink:ChemicalEntity pyruvate family amino acid An L-α-amino acid which is biosynthesised from pyruvate (i.e. alanine, valine, and leucine). A closed class. Graph pyruvate family amino acids pyruvate family amino acids http://purl.obolibrary.org/obo/CHEBI_26463 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26469 biolink:ChemicalEntity quaternary nitrogen compound A nitrogen molecular entity that is electronically neutral but which contains a quaternary nitrogen. Graph http://purl.obolibrary.org/obo/CHEBI_26469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26481 biolink:ChemicalEntity quercetin bissulfate Graph quercetin bissulfate|quercetin bissulfates quercetin bissulfate|quercetin bissulfates http://purl.obolibrary.org/obo/CHEBI_26481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26482 biolink:ChemicalEntity quercetin sulfate Graph quercetin sulfate|quercetin sulfates quercetin sulfate|quercetin sulfates http://purl.obolibrary.org/obo/CHEBI_26482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26483 biolink:ChemicalEntity quercetin trissulfate Graph quercetin trissulfate|quercetin trissulfates quercetin trissulfate|quercetin trissulfates http://purl.obolibrary.org/obo/CHEBI_26483 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26490 biolink:ChemicalEntity quinate A cyclitol carboxylic acid anion that is conjugate base of quinic acid. Graph http://purl.obolibrary.org/obo/CHEBI_26490 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26493 biolink:ChemicalEntity quinic acid A cyclitol carboxylic acid. pubmed:15589483|pubmed:19952409|pubmed:23590498 Graph http://purl.obolibrary.org/obo/CHEBI_26493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26507 biolink:ChemicalEntity dihydroxyquinoline Any hydroxyquinoline in which the number of hydroxy substituents is specified as two. Graph dihydroxyquinolines dihydroxyquinolines http://purl.obolibrary.org/obo/CHEBI_26507 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26508 biolink:ChemicalEntity quinoline N-oxide Graph quinoline N-oxides quinoline N-oxides http://purl.obolibrary.org/obo/CHEBI_26508 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26509 biolink:ChemicalEntity quinoline alkaloid Graph quinoline alkaloids quinoline alkaloids http://purl.obolibrary.org/obo/CHEBI_26509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2651 biolink:ChemicalEntity alpha-aminoacyl-tRNA Any ribonucleic acid that is transfer RNA in which one or more of the free OH groups carries an α-aminoacyl group. kegg.compound:C05156 Graph Aminoacyl-tRNA Aminoacyl-tRNA http://purl.obolibrary.org/obo/CHEBI_2651 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26512 biolink:ChemicalEntity quinolinemonocarboxylic acid Any aromatic carboxylic acid that contains a quinoline moiety that is substituted by one carboxy substituent. Graph quinolinemonocarboxylic acids quinolinemonocarboxylic acids http://purl.obolibrary.org/obo/CHEBI_26512 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26513 biolink:ChemicalEntity quinolines A class of aromatic heterocyclic compounds each of which contains a benzene ring ortho fused to carbons 2 and 3 of a pyridine ring. Graph http://purl.obolibrary.org/obo/CHEBI_26513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26515 biolink:ChemicalEntity quinolizidine alkaloid Graph quinolizidine alkaloids quinolizidine alkaloids http://purl.obolibrary.org/obo/CHEBI_26515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26516 biolink:ChemicalEntity quinolizidines Graph http://purl.obolibrary.org/obo/CHEBI_26516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26518 biolink:ChemicalEntity quinuclidines Graph http://purl.obolibrary.org/obo/CHEBI_26518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26519 biolink:ChemicalEntity radical A molecular entity possessing an unpaired electron. Graph Radikal|Radikale|free radical|freies Radikal|radical|radical libre|radicales libres|radicals radical Radikal|Radikale|free radical|freies Radikal|radical|radical libre|radicales libres|radicals http://purl.obolibrary.org/obo/CHEBI_26519 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26523 biolink:ChemicalEntity reactive oxygen species Molecules or ions formed by the incomplete one-electron reduction of oxygen. They contribute to the microbicidal activity of phagocytes, regulation of signal transduction and gene expression, and the oxidative damage to biopolymers. wikipedia.en:Reactive_oxygen_species Graph ROS ROS http://purl.obolibrary.org/obo/CHEBI_26523 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26533 biolink:ChemicalEntity reticuline beilstein:338033|beilstein:6004801|beilstein:95672|cas:485-19-8|kegg.compound:C12328|pubmed:25973480 Graph (R,S)-Reticuline|1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol 1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol (R,S)-Reticuline|1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol http://purl.obolibrary.org/obo/CHEBI_26533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26534 biolink:ChemicalEntity retinals Graph http://purl.obolibrary.org/obo/CHEBI_26534 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26536 biolink:ChemicalEntity retinoic acid A retinoid consisting of 3,7-dimethylnona-2,4,6,8-tetraenoic acid substituted at position 9 by a 2,6,6-trimethylcyclohex-1-en-1-yl group (geometry of the four exocyclic double bonds is not specified). lincs.smallmolecule:LSM-2135|pubmed:24506204 Graph 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid http://purl.obolibrary.org/obo/CHEBI_26536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26537 biolink:ChemicalEntity retinoid Oxygenated derivatives of 3,7-dimethyl-1-(2,6,6-trimethylcyclohex-1-enyl)nona-1,3,5,7-tetraene and derivatives thereof. Graph retinoid|retinoids retinoids retinoid|retinoids http://purl.obolibrary.org/obo/CHEBI_26537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2654 biolink:ChemicalEntity aminoglutethimide A dicarboximide that is a six-membered cyclic compound having ethyl and 4-aminophenyl substituents at the 3-position. cas:125-84-8|drugbank:DB00357|drugcentral:164|hmdb:HMDB0014501|kegg.compound:C07617|kegg.drug:D00574|lincs.smallmolecule:LSM-1409|patent:US2848455|pubmed:11916226|pubmed:17602675|pubmed:24350727|reaxys:210656|wikipedia.en:Aminoglutethimide Graph 2-(p-Aminophenyl)-2-ethylglutarimide|3-(4-aminophenyl)-3-ethylpiperidine-2,6-dione|3-Ethyl-3-(p-aminophenyl)-2,6-dioxopiperidine|DL-Aminoglutethimide|P-Aminoglutethimide|alpha-(p-Aminophenyl)-alpha-ethylglutarimide|aminoglutethimide|aminoglutethimidum|aminoglutetimida|p-Aminoglutethimide 3-(4-aminophenyl)-3-ethylpiperidine-2,6-dione 2-(p-Aminophenyl)-2-ethylglutarimide|3-(4-aminophenyl)-3-ethylpiperidine-2,6-dione|3-Ethyl-3-(p-aminophenyl)-2,6-dioxopiperidine|DL-Aminoglutethimide|P-Aminoglutethimide|alpha-(p-Aminophenyl)-alpha-ethylglutarimide|aminoglutethimide|aminoglutethimidum|aminoglutetimida|p-Aminoglutethimide http://purl.obolibrary.org/obo/CHEBI_2654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26543 biolink:ChemicalEntity rhamnogalacturonan Graph rhamnogalacturonans rhamnogalacturonans http://purl.obolibrary.org/obo/CHEBI_26543 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26544 biolink:ChemicalEntity rhamnonate Graph http://purl.obolibrary.org/obo/CHEBI_26544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26545 biolink:ChemicalEntity rhamnonolactone Graph rhamnonolactones rhamnonolactones http://purl.obolibrary.org/obo/CHEBI_26545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26546 biolink:ChemicalEntity rhamnose A deoxymannose sugar that is the 6-deoxy derivative of hexose. pubmed:24211429|pubmed:24831810 Graph ramnose ramnose http://purl.obolibrary.org/obo/CHEBI_26546 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26547 biolink:ChemicalEntity rhamnoside Graph rhamnoside|rhamnosides rhamnoside|rhamnosides http://purl.obolibrary.org/obo/CHEBI_26547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26548 biolink:ChemicalEntity rhamnosylglucoside Graph rhamnosylglucoside|rhamnosylglucosides rhamnosylglucoside|rhamnosylglucosides http://purl.obolibrary.org/obo/CHEBI_26548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26554 biolink:ChemicalEntity ribitol phosphate Graph ribitol phosphate|ribitol phosphates ribitol phosphate|ribitol phosphates http://purl.obolibrary.org/obo/CHEBI_26554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26556 biolink:ChemicalEntity 1-ribosylimidazolecarboxamide Graph 1-ribosylimidazolecarboxamides 1-ribosylimidazolecarboxamides http://purl.obolibrary.org/obo/CHEBI_26556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26558 biolink:ChemicalEntity ribonucleoside monophosphate Graph ribonucleoside monophosphates ribonucleoside monophosphates http://purl.obolibrary.org/obo/CHEBI_26558 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26561 biolink:ChemicalEntity ribonucleotide Graph ribonucleotides ribonucleotides http://purl.obolibrary.org/obo/CHEBI_26561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26562 biolink:ChemicalEntity ribose phosphate Graph ribose phosphate|ribose phosphates ribose phosphate|ribose phosphates http://purl.obolibrary.org/obo/CHEBI_26562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26563 biolink:ChemicalEntity ribose triphosphate Graph ribose triphosphate|ribose triphosphates ribose triphosphate|ribose triphosphates http://purl.obolibrary.org/obo/CHEBI_26563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26567 biolink:ChemicalEntity N-ribosyl-N(6)-isopentenyladenine Graph N-ribosyl-N(6)-isopentenyladenines|ribosyl-isopentenyladenines N-ribosyl-N(6)-isopentenyladenines|ribosyl-isopentenyladenines http://purl.obolibrary.org/obo/CHEBI_26567 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26568 biolink:ChemicalEntity ribosylamine Graph ribosylamines ribosylamines http://purl.obolibrary.org/obo/CHEBI_26568 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26573 biolink:ChemicalEntity ribulose phosphate Graph ribulose phosphate|ribulose phosphates ribulose phosphate|ribulose phosphates http://purl.obolibrary.org/obo/CHEBI_26573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26580 biolink:ChemicalEntity rifamycins wikipedia.en:Rifamycin Graph rifamycin rifamycin http://purl.obolibrary.org/obo/CHEBI_26580 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26587 biolink:ChemicalEntity rutinoside Graph rutinoside|rutinosides rutinoside|rutinosides http://purl.obolibrary.org/obo/CHEBI_26587 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26588 biolink:ChemicalEntity 1,3,5-triazines Any compound with a 1,3,5-triazine skeleton, in which nitrogen atoms replace carbon at positions 1, 3 and 5 of the core benzene ring structure. Graph s-triazines s-triazines http://purl.obolibrary.org/obo/CHEBI_26588 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2659 biolink:ChemicalEntity aminophylline A mixture comprising of theophylline and ethylenediamine in a 2:1 ratio. cas:317-34-0|drugbank:DB01223|kegg.drug:D00227|pubmed:10654755|pubmed:12615581|pubmed:14608279|pubmed:17391155|pubmed:18568240|pubmed:20206069|pubmed:21223510|pubmed:2636295|pubmed:30797981|pubmed:31122698|wikipedia.en:Aminophylline Graph 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione - ethane-1,2-diamine (2:1)|3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compd with 1,2-ethanediamine (2:1)|Aminocardol|Aminodur|Aminodur dura-tabs|Aminofillina|Aminophyllin|Aminophylline|BY 108|Cardiofilina|Cardiomin|Cardophylin|Cardophyllin|Carena|Cariomin|Diaphilline|Diaphylline|Diophllin|Diophyllin|Diuxanthine|Dobo|Ethophylline|Etilen-Xantisan|Eufilina|Euphyllin|Euphylline|Euphyllinum|Eurphyllin|Euufilin|Euufillin|Genophyllin|Grifomin|Inophylline|Lasodex|Linampheta|Lixaminol|Metaphyllin|Metaphylline|Methophylline|Minaphil|Miofilin|Neophyiline|Neophylline|Norofilina|Peterphyllin|Phylcardin|Phyllindon|Phyllocontin|Rectalad aminophylline|Somophyllin|Stenovasan|Syntophyllin|TAD|TH/100|Tefamin|Theodrox|Theolamine|Theolone|Theomin|Theophyldine|Theophyline ethylenediamine|Theophyllamine|Theophyllaminium|Theophyllaminum|Theophyllin aethylendiamin|Theophylline ethylenediamine|Thephyldine|Truphylline|Variaphylline|Vasofilina|aminofilina|aminophylline|aminophyllinum|ethylenediamine, compd. with theophylline (1:2)|theophyline ethylenediamine|theophylline, compd with ethylenediamine (2:1) 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione - ethane-1,2-diamine (2:1) 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione - ethane-1,2-diamine (2:1)|3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compd with 1,2-ethanediamine (2:1)|Aminocardol|Aminodur|Aminodur dura-tabs|Aminofillina|Aminophyllin|Aminophylline|BY 108|Cardiofilina|Cardiomin|Cardophylin|Cardophyllin|Carena|Cariomin|Diaphilline|Diaphylline|Diophllin|Diophyllin|Diuxanthine|Dobo|Ethophylline|Etilen-Xantisan|Eufilina|Euphyllin|Euphylline|Euphyllinum|Eurphyllin|Euufilin|Euufillin|Genophyllin|Grifomin|Inophylline|Lasodex|Linampheta|Lixaminol|Metaphyllin|Metaphylline|Methophylline|Minaphil|Miofilin|Neophyiline|Neophylline|Norofilina|Peterphyllin|Phylcardin|Phyllindon|Phyllocontin|Rectalad aminophylline|Somophyllin|Stenovasan|Syntophyllin|TAD|TH/100|Tefamin|Theodrox|Theolamine|Theolone|Theomin|Theophyldine|Theophyline ethylenediamine|Theophyllamine|Theophyllaminium|Theophyllaminum|Theophyllin aethylendiamin|Theophylline ethylenediamine|Thephyldine|Truphylline|Variaphylline|Vasofilina|aminofilina|aminophylline|aminophyllinum|ethylenediamine, compd. with theophylline (1:2)|theophyline ethylenediamine|theophylline, compd with ethylenediamine (2:1) http://purl.obolibrary.org/obo/CHEBI_2659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26590 biolink:ChemicalEntity sabinol Graph (3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol (3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol (3R)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-ol http://purl.obolibrary.org/obo/CHEBI_26590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26596 biolink:ChemicalEntity salicylates Any salt or ester arising from reaction of the carboxy group of salicylic acid, or any ester resulting from the condensation of the phenolic hydroxy group of salicylic acid with an organic acid. pubmed:22866967 Graph http://purl.obolibrary.org/obo/CHEBI_26596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26600 biolink:ChemicalEntity salutaridinol beilstein:1552911 Graph 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7-diol 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7-diol 3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7-diol http://purl.obolibrary.org/obo/CHEBI_26600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:266039 biolink:ChemicalEntity 4-methoxyphenylethylamine A primary amino compound consisting of ethylamine having a 4-methoxyphenyl substituent at the 2-position. cas:55-81-2|gmelin:2093996|pubmed:21394332|pubmed:3377143|reaxys:508967 Graph 2-(4-Methoxyphenyl)ethanamine|2-(4-Methoxyphenyl)ethylamine|2-(4-methoxyphenyl)ethanamine|2-(p-Methoxyphenyl)ethylamine|4-Methoxy-2-phenethylamine|4-Methoxy-beta-phenylethylamine|4-Methoxybenzeneethanamine|4-Methoxyphenethylamine|Homoanisylamine|O-Methyltyramine|p-Methoxyphenethylamine|p-Methoxyphenylethylamine 2-(4-methoxyphenyl)ethanamine 2-(4-Methoxyphenyl)ethanamine|2-(4-Methoxyphenyl)ethylamine|2-(4-methoxyphenyl)ethanamine|2-(p-Methoxyphenyl)ethylamine|4-Methoxy-2-phenethylamine|4-Methoxy-beta-phenylethylamine|4-Methoxybenzeneethanamine|4-Methoxyphenethylamine|Homoanisylamine|O-Methyltyramine|p-Methoxyphenethylamine|p-Methoxyphenylethylamine http://purl.obolibrary.org/obo/CHEBI_266039 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26605 biolink:ChemicalEntity saponin A glycoside that is a compound containing one or more hydrophilic glycoside moieties combined with a lipophilic triterpenoid or steroid derivative. Found in particular abundance in plant species. Graph sapogenin glycoside|sapogenin glycosides|saponins sapogenin glycoside|sapogenin glycosides|saponins http://purl.obolibrary.org/obo/CHEBI_26605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26606 biolink:ChemicalEntity sapogenin Any organic polycyclic compound that is the aglycon moiety of a saponin; sapogenins may be steroids or triterpenoids. Graph sapogenin|sapogenins sapogenin|sapogenins http://purl.obolibrary.org/obo/CHEBI_26606 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26607 biolink:ChemicalEntity saturated fatty acid Any fatty acid containing no carbon to carbon multiple bonds. Known to produce adverse biological effects when ingested to excess. pubmed:16492686|pubmed:19763019|pubmed:20237329 Graph SFA|SFAs|saturated fatty acid|saturated fatty acids SFA|SFAs|saturated fatty acid|saturated fatty acids http://purl.obolibrary.org/obo/CHEBI_26607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26613 biolink:ChemicalEntity scyllo-inositol phosphate Graph scyllo-inositol phosphates scyllo-inositol phosphates http://purl.obolibrary.org/obo/CHEBI_26613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26616 biolink:ChemicalEntity seco-androstane Graph seco-androstanes seco-androstanes http://purl.obolibrary.org/obo/CHEBI_26616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26626 biolink:ChemicalEntity selenites Salts and esters of selenous acid. Graph http://purl.obolibrary.org/obo/CHEBI_26626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26628 biolink:ChemicalEntity selenium molecular entity Graph selenium molecular entities|selenium molecular entity selenium molecular entities|selenium molecular entity http://purl.obolibrary.org/obo/CHEBI_26628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26629 biolink:ChemicalEntity selenoamino acid Graph selenoamino acids selenoamino acids http://purl.obolibrary.org/obo/CHEBI_26629 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2663 biolink:ChemicalEntity amiodarone A member of the class of 1-benzofurans that is 1-benzofuran substituted by a butyl group at position 2 and a 4-[2-(diethylamino)ethoxy]-3,5-diiodobenzoyl group at position 3. It is a cardiovascular drug used for the treatment of cardiac dysrhythmias. beilstein:1271711|cas:1951-25-3|drugbank:DB01118|drugcentral:176|hmdb:HMDB0015250|kegg.compound:C06823|kegg.drug:D02910|lincs.smallmolecule:LSM-2379|patent:CA2826272|patent:TW201400111|pubmed:10188629|pubmed:16479044|pubmed:18368867|wikipedia.en:Amiodarone Graph (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone|2-Butyl-3-(3,5-diiodo-4-(2-diethylaminoethoxy)benzoyl)benzofuran|2-Butyl-3-benzofuranyl 4-(2-(diethylamino)ethoxy)-3,5-diiodophenyl ketone|2-n-Butyl-3',5'-diiodo-4'-N-diethylaminoethoxy-3-benzoylbenzofuran|Amiodarone|amiodarona|amiodaronum (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone (2-butyl-1-benzofuran-3-yl){4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl}methanone|2-Butyl-3-(3,5-diiodo-4-(2-diethylaminoethoxy)benzoyl)benzofuran|2-Butyl-3-benzofuranyl 4-(2-(diethylamino)ethoxy)-3,5-diiodophenyl ketone|2-n-Butyl-3',5'-diiodo-4'-N-diethylaminoethoxy-3-benzoylbenzofuran|Amiodarone|amiodarona|amiodaronum http://purl.obolibrary.org/obo/CHEBI_2663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26630 biolink:ChemicalEntity selenocystathionine A member of the class of cystathionines derived from homoselenocysteine and serine residues joined by a selenide bond. cas:2196-58-9|reaxys:1792529 Graph 2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butanoic acid|2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butyric acid|selenocystathionines 2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butanoic acid 2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butanoic acid|2-amino-4-[(2-amino-2-carboxyethyl)selanyl]butyric acid|selenocystathionines http://purl.obolibrary.org/obo/CHEBI_26630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26632 biolink:ChemicalEntity selenocysteines kegg.compound:C05688 Graph selenocysteines selenocysteines http://purl.obolibrary.org/obo/CHEBI_26632 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26634 biolink:ChemicalEntity selenodiglutathione A thioselenide in which a selenium atom is attached to the sulfur atoms of two molecules of glutathione. It is an initial metabolite of selenite, SeO32−. cas:33944-90-0|kegg.compound:C18870|metacyc.compound:CPD-13908|pubmed:10365249|pubmed:1569062|pubmed:235962|pubmed:384997|pubmed:7476355|pubmed:7614692|pubmed:8033315|pubmed:9850565|reaxys:13876743|umbbd.compound:c0743 Graph GS-Se-SG|GSSeSG|N,N'-((selenodithio)bis(1-((carboxymethyl)carbamoyl)ethylene))di-L-glutamine|N,N'-[(selenodithio)bis{1-[(carboxymethyl)carbamoyl]ethylene}]di-L-glutamine GS-Se-SG|GSSeSG|N,N'-((selenodithio)bis(1-((carboxymethyl)carbamoyl)ethylene))di-L-glutamine|N,N'-[(selenodithio)bis{1-[(carboxymethyl)carbamoyl]ethylene}]di-L-glutamine http://purl.obolibrary.org/obo/CHEBI_26634 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26640 biolink:ChemicalEntity selenomethionines Graph selenomethionines selenomethionines http://purl.obolibrary.org/obo/CHEBI_26640 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26642 biolink:ChemicalEntity selenous acid cas:7783-00-8|gmelin:25856 Graph [SeO(OH)2]|dihydroxidooxidoselenium|selenige Saeure|selenious acid|selenous acid dihydroxidooxidoselenium|selenous acid [SeO(OH)2]|dihydroxidooxidoselenium|selenige Saeure|selenious acid|selenous acid http://purl.obolibrary.org/obo/CHEBI_26642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26643 biolink:ChemicalEntity aldehydic acid A monocarboxylic acid derived from any dicarboxylic acid that has a retained name by the formal reduction of one of the carboxy groups to a formyl group. The resulting structure, also known as a semialdehyde, may be named by replacing the ending '...ic acid' of the retained name of the dicarboxylic acid by the ending '...aldehydic acid'. Aldehydic acids therefore contain one carboxy group and one aldehyde group. Graph Semialdehyd|aldehydic acids|semi-aldehyde|semi-aldehydes|semialdehyde|semialdehydes Semialdehyd|aldehydic acids|semi-aldehyde|semi-aldehydes|semialdehyde|semialdehydes http://purl.obolibrary.org/obo/CHEBI_26643 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26645 biolink:ChemicalEntity semiochemical A molecular messenger released by an organism that affects the behaviour within or between species. wikipedia.en:Semiochemical Graph semiochemicals semiochemicals http://purl.obolibrary.org/obo/CHEBI_26645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26649 biolink:ChemicalEntity serine derivative An amino acid derivative resulting from reaction of serine at the amino group or the carboxy group, or from the replacement of any hydrogen of serine by a heteroatom. The definition normally excludes peptides containing serine residues. Graph serine derivatives serine derivatives http://purl.obolibrary.org/obo/CHEBI_26649 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2665 biolink:ChemicalEntity amitraz A tertiary amino compound that is 1,3,5-triazapenta-1,4-diene substituted by a methyl group at position 3 and 2,4-dimethylphenyl groups at positions 1 and 5. cas:33089-61-1|kegg.compound:C10995|kegg.drug:D02380|pesticides:amitraz|ppdb:30|pubmed:10885999|pubmed:15822764|pubmed:24288053|pubmed:25053051|reaxys:2946590|vsdb:30|wikipedia.en:Amitraz Graph 1,5-di(2,4-dimethylphenyl)-3-methyl-1,3,5-triazapenta-1,4-diene|Mitac|N'-(2,4-dimethylphenyl)-N-{[(2,4-dimethylphenyl)imino]methyl}-N-methylmethanimidamide|N,N'-(methyliminodimethylidyne)bis-2,4-xylidine|amitraz|amitrazum N'-(2,4-dimethylphenyl)-N-{[(2,4-dimethylphenyl)imino]methyl}-N-methylmethanimidamide 1,5-di(2,4-dimethylphenyl)-3-methyl-1,3,5-triazapenta-1,4-diene|Mitac|N'-(2,4-dimethylphenyl)-N-{[(2,4-dimethylphenyl)imino]methyl}-N-methylmethanimidamide|N,N'-(methyliminodimethylidyne)bis-2,4-xylidine|amitraz|amitrazum http://purl.obolibrary.org/obo/CHEBI_2665 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26650 biolink:ChemicalEntity serine family amino acid An α-amino acid which is biosynthesised from 3-phosphoglycerate (i.e. serine, glycine, cysteine and homocysteine). A closed class. pubmed:20709681 Graph 3-phosphoglycerate family amino acid|3-phosphoglycerate family amino acids|serine family amino acids 3-phosphoglycerate family amino acid|3-phosphoglycerate family amino acids|serine family amino acids http://purl.obolibrary.org/obo/CHEBI_26650 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26658 biolink:ChemicalEntity sesquiterpenoid Any terpenoid derived from a sesquiterpene. The term includes compounds in which the C15 skeleton of the parent sesquiterpene has been rearranged or modified by the removal of one or more skeletal atoms (generally methyl groups). lipidmaps_class:LMPR0103 Graph sesquiterpenoides|sesquiterpenoids sesquiterpenoides|sesquiterpenoids http://purl.obolibrary.org/obo/CHEBI_26658 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2666 biolink:ChemicalEntity amitriptyline An organic tricyclic compound that is 10,11-dihydro-5H-dibenzo[a,d][7]annulene substituted by a 3-(dimethylamino)propylidene group at position 5. cas:50-48-6|drugbank:DB00321|drugcentral:180|hmdb:HMDB0014466|kegg.compound:C06824|kegg.drug:D07448|lincs.smallmolecule:LSM-3190|patent:CN101780063|patent:WO2011089289|pubmed:15554244|pubmed:18359012|pubmed:24447704|reaxys:2217885|vsdb:2962|wikipedia.en:Amitriptyline Graph 10,11-dihydro-5-(gamma-dimethylaminopropylidene)-5H-dibenzo(a,d)cycloheptene|10,11-dihydro-N,N-dimethyl-5H-dibenzo(a,d)heptalene-Delta(5),gamma-propylamine|3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-N,N-dimethyl-1-propanamine|3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine|3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethylpropan-1-amine|5-(3-dimethylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptatriene|5-(3-dimethylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptene|5-(gamma-dimethylaminopropylidene)-5H-dibenzo[a,d][1,4]cycloheptadiene|Amitriptylin|Amitriptyline 3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine 10,11-dihydro-5-(gamma-dimethylaminopropylidene)-5H-dibenzo(a,d)cycloheptene|10,11-dihydro-N,N-dimethyl-5H-dibenzo(a,d)heptalene-Delta(5),gamma-propylamine|3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-N,N-dimethyl-1-propanamine|3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine|3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethylpropan-1-amine|5-(3-dimethylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptatriene|5-(3-dimethylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptene|5-(gamma-dimethylaminopropylidene)-5H-dibenzo[a,d][1,4]cycloheptadiene|Amitriptylin|Amitriptyline http://purl.obolibrary.org/obo/CHEBI_2666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26660 biolink:ChemicalEntity sesterterpenoid Any terpenoid derived from a sesterterpene. The term includes compounds in which the C25 skeleton of the parent sesterterpene has been rearranged or modified by the removal of one or more skeletal atoms (generally methyl groups). Sometimes sesterterpenoids are erroneously referred to as sesterpenoids. lipidmaps_class:LMPR0105 Graph C25 terpenoid|C25 terpenoids|sesterpenoids|sesterterpenoids C25 terpenoid|C25 terpenoids|sesterpenoids|sesterterpenoids http://purl.obolibrary.org/obo/CHEBI_26660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26666 biolink:ChemicalEntity short-chain fatty acid An aliphatic monocarboxylic acid with a chain length of less than C6. If any non-hydrocarbon substituent is present, the compound is not normally regarded as a short-chain fatty acid. pubmed:16633129|pubmed:16870803|pubmed:18203540|pubmed:20148677 Graph SCFA|SCFAs|short-chain fatty acids SCFA|SCFAs|short-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_26666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26667 biolink:ChemicalEntity sialic acid Any of the N-acylneuraminic acids and their esters and other derivatives of the alcoholic hydroxy groups. wikipedia.en:Sialic_acid Graph Sialsaeure|Sialsaeuren|acide sialique|acides sialique|sialic acids Sialsaeure|Sialsaeuren|acide sialique|acides sialique|sialic acids http://purl.obolibrary.org/obo/CHEBI_26667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26668 biolink:ChemicalEntity sialosyl group A glycosyl group derived by removal of the exomeric hydroxy group from any of the sialic acids. Graph http://purl.obolibrary.org/obo/CHEBI_26668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26672 biolink:ChemicalEntity siderophore Any of low-molecular-mass iron(III)-chelating compounds produced by microorganisms for the purpose of the transport and sequestration of iron. Graph ferrioxamine|ferrioxamines|ironophore|siderochrome|siderochromes|siderophore|siderophores siderophore ferrioxamine|ferrioxamines|ironophore|siderochrome|siderochromes|siderophore|siderophores http://purl.obolibrary.org/obo/CHEBI_26672 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26673 biolink:ChemicalEntity organosilanediol Graph organosilanediols|silanediols organosilanediols|silanediols http://purl.obolibrary.org/obo/CHEBI_26673 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26675 biolink:ChemicalEntity silicic acid cas:10193-36-9|gmelin:2009|umbbd.compound:c0577 Graph H4SiO4|Kieselsaeure|Orthokieselsaeure|[Si(OH)4]|monosilicic acid|orthosilicic acid|silanetetrol|silicic acid|silicon tetrahydroxide|tetrahydroxidosilicon|tetrahydroxysilane silanetetrol|silicic acid|tetrahydroxidosilicon H4SiO4|Kieselsaeure|Orthokieselsaeure|[Si(OH)4]|monosilicic acid|orthosilicic acid|silanetetrol|silicic acid|silicon tetrahydroxide|tetrahydroxidosilicon|tetrahydroxysilane http://purl.obolibrary.org/obo/CHEBI_26675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26677 biolink:ChemicalEntity silicon molecular entity Graph silicon compounds|silicon molecular entities|silicon molecular entity silicon compounds|silicon molecular entities|silicon molecular entity http://purl.obolibrary.org/obo/CHEBI_26677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2668 biolink:ChemicalEntity amlodipine A fully substituted dialkyl 1,4-dihydropyridine-3,5-dicarboxylate derivative, which is used for the treatment of hypertension, chronic stable angina and confirmed or suspected vasospastic angina. cas:88150-42-9|drugbank:DB00381|drugcentral:183|kegg.compound:C06825|kegg.drug:D07450|lincs.smallmolecule:LSM-1388|patent:EP89167|patent:US4572909|pubmed:1532771|pubmed:16422032|pubmed:1834846|pubmed:19450066|pubmed:21591999|pubmed:7522286|pubmed:8310972|pubmed:8310973|pubmed:9156957|reaxys:3570229|vsdb:2963|wikipedia.en:Amlodipine Graph 3-Ethyl-5-methyl (+-)-2-(2-aminoethoxymethyl)-4-(o-chlorophenyl)-1,4-dihydro-6-methyl-3,5-pyridinedicarboxylate|3-ethyl 5-methyl 2-[(2-aminoethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate|Amlodipine Free Base|amlodipine|amlodipino|amlodipinum 3-ethyl 5-methyl 2-[(2-aminoethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate 3-Ethyl-5-methyl (+-)-2-(2-aminoethoxymethyl)-4-(o-chlorophenyl)-1,4-dihydro-6-methyl-3,5-pyridinedicarboxylate|3-ethyl 5-methyl 2-[(2-aminoethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate|Amlodipine Free Base|amlodipine|amlodipino|amlodipinum http://purl.obolibrary.org/obo/CHEBI_2668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26689 biolink:ChemicalEntity singlet dioxygen A reactive oxygen species that is the lowest excited state of the dioxygen molecule. drugcentral:4235|gmelin:491|pubmed:18264592|pubmed:21735018|pubmed:21883246|reaxys:16514885|reaxys:3587218|wikipedia.en:Singlet_oxygen Graph (1)O2|singlet molecular oxygen singlet molecular oxygen (1)O2|singlet molecular oxygen http://purl.obolibrary.org/obo/CHEBI_26689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26706 biolink:ChemicalEntity sn-glycerol 3-phosphates Graph http://purl.obolibrary.org/obo/CHEBI_26706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26707 biolink:ChemicalEntity glycerol phosphate Graph glycerol phosphates glycerol phosphates http://purl.obolibrary.org/obo/CHEBI_26707 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26708 biolink:ChemicalEntity sodium atom cas:7440-23-5|gmelin:16221|kegg.compound:C01330|webelements:Na Graph 11Na|Na|Natrium|natrium|sodio|sodium sodium 11Na|Na|Natrium|natrium|sodio|sodium http://purl.obolibrary.org/obo/CHEBI_26708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26710 biolink:ChemicalEntity sodium chloride An inorganic chloride salt having sodium(1+) as the counterion. cas:7647-14-5|gmelin:13673|kegg.compound:C13563|kegg.drug:D02056|metacyc.compound:NACL|ppdb:595|reaxys:3534976|wikipedia.en:Sodium_Chloride Graph Kochsalz|NaCl|Natriumchlorid|chlorure de sodium|cloruro sodico|common salt|halite|natrii chloridum|rock salt|salt|sodium chloride|table salt sodium chloride Kochsalz|NaCl|Natriumchlorid|chlorure de sodium|cloruro sodico|common salt|halite|natrii chloridum|rock salt|salt|sodium chloride|table salt http://purl.obolibrary.org/obo/CHEBI_26710 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26712 biolink:ChemicalEntity sodium molecular entity Graph sodium compounds|sodium molecular entities sodium compounds|sodium molecular entities http://purl.obolibrary.org/obo/CHEBI_26712 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26714 biolink:ChemicalEntity sodium salt Any alkali metal salt having sodium(1+) as the cation. Graph Natriumsalz|Natriumsalze|sodium salts Natriumsalz|Natriumsalze|sodium salts http://purl.obolibrary.org/obo/CHEBI_26714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26718 biolink:ChemicalEntity solanesol A nonaprenol that is hexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol substituted by 9 methyl groups at positions 3, 7, 11, 15, 19, 23, 27, 31 and 35 (the all-trans0stereoisomer). cas:13190-97-1|reaxys:1717721 Graph (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol http://purl.obolibrary.org/obo/CHEBI_26718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26725 biolink:ChemicalEntity glucitol phosphate Graph glucitol phosphates|sorbitol phosphate glucitol phosphates|sorbitol phosphate http://purl.obolibrary.org/obo/CHEBI_26725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2673 biolink:ChemicalEntity amobarbital A member of the class of barbiturates that is pyrimidine-2,4,6(1H,3H,5H)-trione substituted by a 3-methylbutyl and an ethyl group at position 5. Amobarbital has been shown to exhibit sedative and hypnotic properties. cas:57-43-2|drugbank:DB01351|drugcentral:184|gmelin:281708|hmdb:HMDB0015440|kegg.compound:C07536|kegg.drug:D00555|metacyc.compound:CPD-5742|patent:US3507960|reaxys:211172|wikipedia.en:Amobarbital Graph 5-ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|5-ethyl-5-(3-methylbutyl)barbituric acid|5-ethyl-5-(3-methylbutyl)pyrimidine-2,4,6(1H,3H,5H)-trione|5-ethyl-5-isoamylbarbituric acid|5-ethyl-5-isopentylbarbituric acid|Amobarbital|amylobarbitone|amytal|barbamil|barbamyl 5-ethyl-5-(3-methylbutyl)pyrimidine-2,4,6(1H,3H,5H)-trione 5-ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|5-ethyl-5-(3-methylbutyl)barbituric acid|5-ethyl-5-(3-methylbutyl)pyrimidine-2,4,6(1H,3H,5H)-trione|5-ethyl-5-isoamylbarbituric acid|5-ethyl-5-isopentylbarbituric acid|Amobarbital|amylobarbitone|amytal|barbamil|barbamyl http://purl.obolibrary.org/obo/CHEBI_2673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26735 biolink:ChemicalEntity substituted spermine Graph spermines|substituted spermines spermines|substituted spermines http://purl.obolibrary.org/obo/CHEBI_26735 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26738 biolink:ChemicalEntity sphingenine A 2-aminooctadecene-1,3-diol having (2S,3R)-configuration. Graph sphingenines sphingenines http://purl.obolibrary.org/obo/CHEBI_26738 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26739 biolink:ChemicalEntity sphingolipid Sphingolipids are a complex family of compounds that share a common structural feature, a sphingoid base backbone. Graph sphingolipids sphingolipids http://purl.obolibrary.org/obo/CHEBI_26739 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2674 biolink:ChemicalEntity amodiaquine A quinoline having a chloro group at the 7-position and an aryl amino group at the 4-position. cas:86-42-0|drugbank:DB00613|drugcentral:186|kegg.compound:C07626|kegg.drug:D02922|lincs.smallmolecule:LSM-4042|patent:US2474821|pdb-ccd:CQA|pubmed:11044276|pubmed:11971651|pubmed:17046445|pubmed:17222819|pubmed:18419816|pubmed:18855526|pubmed:19024339|pubmed:19245687|pubmed:26206402|pubmed:26597254|pubmed:26647924|pubmed:26735991|pubmed:26851641|pubmed:26900802|pubmed:26930583|pubmed:27031231|pubmed:8885219|reaxys:300962|wikipedia.en:Amodiaquine Graph 4-[(7-chloroquinolin-4-yl)amino]-2-[(diethylamino)methyl]phenol|Amodiaquine|amodiaquina|amodiaquine|amodiaquinum 4-[(7-chloroquinolin-4-yl)amino]-2-[(diethylamino)methyl]phenol 4-[(7-chloroquinolin-4-yl)amino]-2-[(diethylamino)methyl]phenol|Amodiaquine|amodiaquina|amodiaquine|amodiaquinum http://purl.obolibrary.org/obo/CHEBI_2674 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:267413 biolink:ChemicalEntity balsalazide A monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-β-alanine via an azo bond. cas:80573-04-2|drugbank:DB01014|drugcentral:284|kegg.drug:D07488|patent:GB2080796|patent:US4412992|reaxys:8081576|wikipedia.en:Balsalazide Graph (E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid|(E)-5-({p-[(2-carboxyethyl)carbamoyl]phenyl}azo)-2-salicylic acid|3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acid|5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid|5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid|balsalazida|balsalazide|balsalazido|balsalazidum 5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid (E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid|(E)-5-({p-[(2-carboxyethyl)carbamoyl]phenyl}azo)-2-salicylic acid|3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acid|5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid|5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid|balsalazida|balsalazide|balsalazido|balsalazidum http://purl.obolibrary.org/obo/CHEBI_267413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26743 biolink:ChemicalEntity sphing-4-enine A sphingenine in which the C=C double bond is located at the 4-position. beilstein:7794904|lincs.smallmolecule:LSM-5718 Graph (2S,3R)-2-aminooctadec-4-ene-1,3-diol|4-sphingenine|sphing-4-enine (2S,3R)-2-aminooctadec-4-ene-1,3-diol (2S,3R)-2-aminooctadec-4-ene-1,3-diol|4-sphingenine|sphing-4-enine http://purl.obolibrary.org/obo/CHEBI_26743 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26745 biolink:ChemicalEntity spirostan Graph spirostan spirostan spirostan http://purl.obolibrary.org/obo/CHEBI_26745 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26747 biolink:ChemicalEntity squalene triterpenoid A triterpenoid based on a squalene skeleton and its substituted derivatives thereof. Graph squalene triterpenoids squalene triterpenoids http://purl.obolibrary.org/obo/CHEBI_26747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2675 biolink:ChemicalEntity amoxapine A dibenzooxazepine compound having a chloro substituent at the 2-position and a piperazin-1-yl group at the 11-position. beilstein:832057|cas:14028-44-5|drugbank:DB00543|drugcentral:191|kegg.drug:D00228|lincs.smallmolecule:LSM-2021|patent:FR1508536|patent:US3663696|pubmed:24134630|wikipedia.en:Amoxapine Graph 2-Chloro-11-(1-piperazinyl)dibenz(b,f)(1,4)oxazepine|2-chloro-11-(piperazin-1-yl)dibenzo[b,f][1,4]oxazepine|Desmethylloxapin|amoxapina|amoxapine|amoxapinum 2-chloro-11-(piperazin-1-yl)dibenzo[b,f][1,4]oxazepine 2-Chloro-11-(1-piperazinyl)dibenz(b,f)(1,4)oxazepine|2-chloro-11-(piperazin-1-yl)dibenzo[b,f][1,4]oxazepine|Desmethylloxapin|amoxapina|amoxapine|amoxapinum http://purl.obolibrary.org/obo/CHEBI_2675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26753 biolink:ChemicalEntity stearoyl group Graph CH3-[CH2]16-CO-|Ste|octadecanoyl|stearoyl octadecanoyl CH3-[CH2]16-CO-|Ste|octadecanoyl|stearoyl http://purl.obolibrary.org/obo/CHEBI_26753 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26756 biolink:ChemicalEntity stercobilin beilstein:635511 Graph 3,18-diethyl-2,7,13,17-tetramethyl-1,19-dioxo-1,2,3,4,5,15,16,17,18,19,22,24-dodecahydro-21H-biline-8,12-dipropanoic acid|8,12-bis(2-carboxyethyl)-3,18-diethyl-2,3,17,18-tetrahydro-2,7,13,17-tetramethylbilene-b-1,19(4H,16H)-dione|stercobilin|stercobilin IXalpha 3,18-diethyl-2,7,13,17-tetramethyl-1,19-dioxo-1,2,3,4,5,15,16,17,18,19,22,24-dodecahydro-21H-biline-8,12-dipropanoic acid|stercobilin 3,18-diethyl-2,7,13,17-tetramethyl-1,19-dioxo-1,2,3,4,5,15,16,17,18,19,22,24-dodecahydro-21H-biline-8,12-dipropanoic acid|8,12-bis(2-carboxyethyl)-3,18-diethyl-2,3,17,18-tetrahydro-2,7,13,17-tetramethylbilene-b-1,19(4H,16H)-dione|stercobilin|stercobilin IXalpha http://purl.obolibrary.org/obo/CHEBI_26756 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26759 biolink:ChemicalEntity sterigmatocystins Graph sterigmatocystins sterigmatocystins http://purl.obolibrary.org/obo/CHEBI_26759 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:2676 biolink:ChemicalEntity amoxicillin A penicillin in which the substituent at position 6 of the penam ring is a 2-amino-2-(4-hydroxyphenyl)acetamido group. cas:26787-78-0|drugbank:DB01060|drugcentral:192|hmdb:HMDB0015193|kegg.compound:C06827|kegg.drug:D07452|lincs.smallmolecule:LSM-5654|patent:DE1942693|patent:GB1241844|patent:GB978178|patent:US3192198|pubmed:10930630|pubmed:11431418|pubmed:11906332|pubmed:12569987|pubmed:12833570|pubmed:12850488|pubmed:16033609|pubmed:2083978|pubmed:24595455|pubmed:24631718|pubmed:24759068|pubmed:25998949|pubmed:27731424|pubmed:28987997|pubmed:29017833|reaxys:4274654|vsdb:1741|wikipedia.en:Amoxicillin Graph (2S,5R,6R)-6-{[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6-(p-hydroxy-alpha-aminophenylacetamido)penicillanic acid|6beta-[(2R)-2-amino-2-(4-hydroxyphenyl)acetamido]-2,2-dimethylpenam-3alpha-carboxylic acid|AMPC|AX|Amolin|Amopenixin|Amoxicillin|Amoxicillin anhydrous|Clamoxyl|Moxal|alpha-amino-p-hydroxybenzylpenicillin|amoxicilina|amoxicillin|amoxicilline|amoxicillinum|amoxycilin|amoxycillin|p-hydroxyampicillin 6beta-[(2R)-2-amino-2-(4-hydroxyphenyl)acetamido]-2,2-dimethylpenam-3alpha-carboxylic acid (2S,5R,6R)-6-{[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|6-(p-hydroxy-alpha-aminophenylacetamido)penicillanic acid|6beta-[(2R)-2-amino-2-(4-hydroxyphenyl)acetamido]-2,2-dimethylpenam-3alpha-carboxylic acid|AMPC|AX|Amolin|Amopenixin|Amoxicillin|Amoxicillin anhydrous|Clamoxyl|Moxal|alpha-amino-p-hydroxybenzylpenicillin|amoxicilina|amoxicillin|amoxicilline|amoxicillinum|amoxycilin|amoxycillin|p-hydroxyampicillin http://purl.obolibrary.org/obo/CHEBI_2676 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26761 biolink:ChemicalEntity steroid antibiotic Graph steroid antibiotics steroid antibiotics http://purl.obolibrary.org/obo/CHEBI_26761 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26763 biolink:ChemicalEntity steroid glucosiduronic acid Graph steroid glucosiduronic acid|steroid glucosiduronic acids steroid glucosiduronic acid|steroid glucosiduronic acids http://purl.obolibrary.org/obo/CHEBI_26763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26764 biolink:ChemicalEntity steroid hormone Any steroid that acts as hormone. Graph Steroidhormon|Steroidhormone|hormona esteroide|hormonas esteroideas|hormone steroide|hormones steroides|steroid hormones Steroidhormon|Steroidhormone|hormona esteroide|hormonas esteroideas|hormone steroide|hormones steroides|steroid hormones http://purl.obolibrary.org/obo/CHEBI_26764 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26766 biolink:ChemicalEntity steroid lactone kegg.compound:C15507 Graph steroid lactones steroid lactones http://purl.obolibrary.org/obo/CHEBI_26766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2677 biolink:ChemicalEntity Augmentin A mixture composed of amoxicillin trihydrate and potassium clavulanate; a broad-spectrum antibiotic. The potassium clavulanate component is particularly active against the clinically important plasmid-mediated β-lactamases frequently responsible for transferred drug resistance to penicillins and cephalosporins. cas:74469-00-4|kegg.drug:D00230|pubmed:25544822|reaxys:23956304 Graph Amoxicillin / clavulanic acid|Amoxicillin and clavulanate potassium|Amoxicillin hydrate-potassium clavulanate mixt|Amoxicillin mixture with Clavulanate potassium|Amoxicillin-potassium clavulanate combination|Augmentin|Potassium clavulanate mixed with amoxicillin Amoxicillin / clavulanic acid|Amoxicillin and clavulanate potassium|Amoxicillin hydrate-potassium clavulanate mixt|Amoxicillin mixture with Clavulanate potassium|Amoxicillin-potassium clavulanate combination|Augmentin|Potassium clavulanate mixed with amoxicillin http://purl.obolibrary.org/obo/CHEBI_2677 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26773 biolink:ChemicalEntity stigmastane beilstein:8170826|lipidmaps:LMST01040000 Graph stigmastane stigmastane stigmastane http://purl.obolibrary.org/obo/CHEBI_26773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26775 biolink:ChemicalEntity stilbene beilstein:1904445|cas:588-59-0|gmelin:67845|wikipedia.en:Stilbene Graph 1,1'-(1,2-ethenediyl)bis[benzene]|1,1'-(1,2-ethenediyl)bisbenzene|1,1'-(1,2-ethenediyl)dibenzene|1,1'-(ethene-1,2-diyl)dibenzene|1,1'-ethene-1,2-diyldibenzene|1,2-diphenylethylene|alpha,beta-diphenylethylene|stilbene 1,1'-(ethene-1,2-diyl)dibenzene 1,1'-(1,2-ethenediyl)bis[benzene]|1,1'-(1,2-ethenediyl)bisbenzene|1,1'-(1,2-ethenediyl)dibenzene|1,1'-(ethene-1,2-diyl)dibenzene|1,1'-ethene-1,2-diyldibenzene|1,2-diphenylethylene|alpha,beta-diphenylethylene|stilbene http://purl.obolibrary.org/obo/CHEBI_26775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26776 biolink:ChemicalEntity stilbenoid Any olefinic compound characterised by a 1,2-diphenylethylene backbone. Graph stilbenes|stilbenoids stilbenes|stilbenoids http://purl.obolibrary.org/obo/CHEBI_26776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26787 biolink:ChemicalEntity streptomycin phosphate Graph streptomycin phosphate|streptomycin phosphates streptomycin phosphate|streptomycin phosphates http://purl.obolibrary.org/obo/CHEBI_26787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26788 biolink:ChemicalEntity streptomycins Graph http://purl.obolibrary.org/obo/CHEBI_26788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26789 biolink:ChemicalEntity streptothricin An N-glycosyl compound consisting of 2-amino-4-O-carbamoyl-2-deoxy-N-[(3aS,7R,7aS)-7-hydroxy-4-oxooctahydro-2H-imidazo[4,5-c]pyridin-2-ylidene]-β-D-gulopyranosylamine in which the amino group at position 2 of the gulopyranosyl moiety is acylated by a peptide unit made up of between 1 and 7 Nε-linked units of β-lysine. Graph racemomycins|streptothricins|yazumycins racemomycins|streptothricins|yazumycins http://purl.obolibrary.org/obo/CHEBI_26789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2679 biolink:ChemicalEntity amphetamine A racemate comprising equimolar amounts of (R)-amphetamine (also known as levamphetamine or levoamphetamine) and (S)-amphetamine (also known as dexamfetamine or dextroamphetamine. cas:300-62-9|drugbank:DB00182|gmelin:406210|hmdb:HMDB0014328|kegg.compound:C07514|kegg.drug:D07445|pubmed:23889359|pubmed:24408209|reaxys:507867|wikipedia.en:Amphetamine Graph 1-Phenylpropan-2-amin|1-phenyl-2-aminopropane|Amfetamine|Amphetamin|Amphetamine|Benzedrine|alpha-methylbenzeneethaneamine|alpha-methylphenylethylamine|amfetamina|amfetamine|amfetaminum|amphetamine|amphetaminium|anfetamina|beta-Phenylisopropylamin|beta-aminopropylbenzene|beta-phenylisopropylamine|desoxynorephedrine|rac-(2R)-1-phenylpropan-2-amine|rac-amphetamine rac-(2R)-1-phenylpropan-2-amine 1-Phenylpropan-2-amin|1-phenyl-2-aminopropane|Amfetamine|Amphetamin|Amphetamine|Benzedrine|alpha-methylbenzeneethaneamine|alpha-methylphenylethylamine|amfetamina|amfetamine|amfetaminum|amphetamine|amphetaminium|anfetamina|beta-Phenylisopropylamin|beta-aminopropylbenzene|beta-phenylisopropylamine|desoxynorephedrine|rac-(2R)-1-phenylpropan-2-amine|rac-amphetamine http://purl.obolibrary.org/obo/CHEBI_2679 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26799 biolink:ChemicalEntity styrenes Graph http://purl.obolibrary.org/obo/CHEBI_26799 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26806 biolink:ChemicalEntity succinate A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of succinic acid. Graph succinate anion|succinates|succinic acid anion succinate anion|succinates|succinic acid anion http://purl.obolibrary.org/obo/CHEBI_26806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26816 biolink:ChemicalEntity carbohydrate phosphate Graph carbohydrate phosphates carbohydrate phosphates http://purl.obolibrary.org/obo/CHEBI_26816 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26819 biolink:ChemicalEntity sulfuric ester An ester of an alcohol and sulfuric acid. Graph sulfate ester|sulfuric acid ester|sulfuric acid esters sulfate ester|sulfuric acid ester|sulfuric acid esters http://purl.obolibrary.org/obo/CHEBI_26819 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2682 biolink:ChemicalEntity amphotericin B A macrolide antibiotic used to treat potentially life-threatening fungal infections. cas:1397-89-3|drugbank:DB00681|drugcentral:197|kegg.compound:C06573|kegg.drug:D00203|lipidmaps:LMPK06000002|patent:US2908611|pubmed:11429202|pubmed:11930683|pubmed:15793154|pubmed:16120633|pubmed:16793999|pubmed:1732516|pubmed:17507115|pubmed:33846129|reaxys:4645978|wikipedia.en:Amphotericin_B Graph (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid|AMPH-B|Amphotericine B|Liposomal Amphotericin B|amfotericina B|amphotericin B|amphotericine B|amphotericinum B (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid|AMPH-B|Amphotericine B|Liposomal Amphotericin B|amfotericina B|amphotericin B|amphotericine B|amphotericinum B http://purl.obolibrary.org/obo/CHEBI_2682 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26820 biolink:ChemicalEntity sulfates Salts and esters of sulfuric acid Graph sulfates|sulfuric acid derivative|sulphates sulfates|sulfuric acid derivative|sulphates http://purl.obolibrary.org/obo/CHEBI_26820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26822 biolink:ChemicalEntity sulfide Any sulfur molecular entity that involves either covalently bonded or anionic sulfur. Graph sulphides sulphides http://purl.obolibrary.org/obo/CHEBI_26822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26825 biolink:ChemicalEntity sulfobenzoic acid Graph sulfobenzoic acids sulfobenzoic acids http://purl.obolibrary.org/obo/CHEBI_26825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26826 biolink:ChemicalEntity dihydroxybenzenesulfonic acid Graph dihydroxybenzenesulfonic acids|sulfocatechols dihydroxybenzenesulfonic acids|sulfocatechols http://purl.obolibrary.org/obo/CHEBI_26826 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26829 biolink:ChemicalEntity sulfoglycolipid A sulfate ester of a glycolipid. Graph sulfoglycolipids sulfoglycolipids http://purl.obolibrary.org/obo/CHEBI_26829 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26830 biolink:ChemicalEntity sulfonium compound Graph sulfonium compounds sulfonium compounds http://purl.obolibrary.org/obo/CHEBI_26830 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26831 biolink:ChemicalEntity N,N''-sulfonyldiurea cas:35507-37-0 Graph N,N''-Sulfonylbisurea|N,N''-sulfonyldiurea|Sulfonylurea|sulfonylurea N,N''-sulfonyldiurea N,N''-Sulfonylbisurea|N,N''-sulfonyldiurea|Sulfonylurea|sulfonylurea http://purl.obolibrary.org/obo/CHEBI_26831 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26833 biolink:ChemicalEntity sulfur atom cas:7704-34-9|kegg.compound:C00087|kegg.drug:D06527|ppdb:605|webelements:S Graph 16S|Elemental sulfur|S|Schwefel|azufre|soufre|sulfur|sulphur|theion sulfur 16S|Elemental sulfur|S|Schwefel|azufre|soufre|sulfur|sulphur|theion http://purl.obolibrary.org/obo/CHEBI_26833 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26834 biolink:ChemicalEntity sulfur-containing amino acid Graph sulfur-containing amino acids sulfur-containing amino acids http://purl.obolibrary.org/obo/CHEBI_26834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26835 biolink:ChemicalEntity sulfur molecular entity Graph sulfur molecular entities|sulfur molecular entity sulfur molecular entities|sulfur molecular entity http://purl.obolibrary.org/obo/CHEBI_26835 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26836 biolink:ChemicalEntity sulfuric acid A sulfur oxoacid that consists of two oxo and two hydroxy groups joined covalently to a central sulfur atom. cas:7664-93-9|gmelin:2122|kegg.compound:C00059|kegg.drug:D05963|knapsack:C00007530|molbase:4|ppdb:606|pubmed:13568755|pubmed:16122922|pubmed:19397353|pubmed:22047659|pubmed:22136045|pubmed:22204399|pubmed:22267186|pubmed:22296037|pubmed:22364556|pubmed:22435616|reaxys:2037554|wikipedia.en:Sulfuric_acid Graph Acide sulfurique|Acido sulfurico|Acidum sulfuricum|H2SO4|Schwefelsaeureloesungen|Sulfuric acid|[S(OH)2O2]|[SO2(OH)2]|dihydrogen tetraoxosulfate|dihydroxidodioxidosulfur|hydrogen tetraoxosulfate(2-)|hydrogen tetraoxosulfate(VI)|sulfuric acid|sulphuric acid|tetraoxosulfuric acid dihydrogen tetraoxosulfate|dihydroxidodioxidosulfur|hydrogen tetraoxosulfate(2-)|hydrogen tetraoxosulfate(VI)|sulfuric acid|tetraoxosulfuric acid Acide sulfurique|Acido sulfurico|Acidum sulfuricum|H2SO4|Schwefelsaeureloesungen|Sulfuric acid|[S(OH)2O2]|[SO2(OH)2]|dihydrogen tetraoxosulfate|dihydroxidodioxidosulfur|hydrogen tetraoxosulfate(2-)|hydrogen tetraoxosulfate(VI)|sulfuric acid|sulphuric acid|tetraoxosulfuric acid http://purl.obolibrary.org/obo/CHEBI_26836 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26841 biolink:ChemicalEntity synthetic auxin A synthetic compound exhibiting auxin activity. Graph synthetic auxins synthetic auxins http://purl.obolibrary.org/obo/CHEBI_26841 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26845 biolink:ChemicalEntity tagaturonic acid Graph http://purl.obolibrary.org/obo/CHEBI_26845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26847 biolink:ChemicalEntity altraric acid Graph talaric acid talaric acid http://purl.obolibrary.org/obo/CHEBI_26847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26848 biolink:ChemicalEntity tannin Any of a group of astringent polyphenolic vegetable principles or compounds, chiefly complex glucosides of catechol and pyrogallol. wikipedia.en:Tannin Graph tannins tannins http://purl.obolibrary.org/obo/CHEBI_26848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26849 biolink:ChemicalEntity DL-tartaric acid A racemate comprising equimolar amounts of D- and L-tartaric acid. cas:133-37-9|gmelin:82691|pubmed:24507823|pubmed:24556732|pubmed:32132279|reaxys:510169|wikipedia.en:Racemic_acid Graph (+-)-2,3-dihydroxybutanedioic acid|(+-)-tartaric acid|(2RS,3RS)-tartaric acid|(R*,R*)-(+-)-2,3-dihydroxybutanedioic acid|(R*,R*)-2,3-dihydroxybutanedioic acid|DL-2,3-dihydroxybutanedioic acid|DL-tartaric acid|Traubensaeure|Vogesensaeure|acide tartrique|acido tartarico|dl-tartaric acid|para-Weinsaeure|paratartaric acid|rac-(2R,3R)-2,3-dihydroxybutanedioic acid|racemic acid|racemic tartaric acid|racemische Weinsaeure|resolvable tartaric acid|uvic acid rac-(2R,3R)-2,3-dihydroxybutanedioic acid (+-)-2,3-dihydroxybutanedioic acid|(+-)-tartaric acid|(2RS,3RS)-tartaric acid|(R*,R*)-(+-)-2,3-dihydroxybutanedioic acid|(R*,R*)-2,3-dihydroxybutanedioic acid|DL-2,3-dihydroxybutanedioic acid|DL-tartaric acid|Traubensaeure|Vogesensaeure|acide tartrique|acido tartarico|dl-tartaric acid|para-Weinsaeure|paratartaric acid|rac-(2R,3R)-2,3-dihydroxybutanedioic acid|racemic acid|racemic tartaric acid|racemische Weinsaeure|resolvable tartaric acid|uvic acid http://purl.obolibrary.org/obo/CHEBI_26849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2686 biolink:ChemicalEntity amrinone A 3,4'-bipyridine substituted at positions 5 and 6 by an amino group and a keto function respectively. A pyridine phosphodiesterase 3 inhibitor, it is a drug that may improve the prognosis in patients with congestive heart failure. cas:60719-84-8|drugbank:DB01427|drugcentral:201|hmdb:HMDB0015496|kegg.drug:D00231|lincs.smallmolecule:LSM-6600|pubmed:10513074|pubmed:10835763|pubmed:10919416|pubmed:10969688|pubmed:10972600|pubmed:12076859|pubmed:12111179|pubmed:12354747|pubmed:14754535|pubmed:15064331|pubmed:15892406|pubmed:15972057|pubmed:16154150|pubmed:16236146|pubmed:17582263|pubmed:18468627|pubmed:23112975|pubmed:23184630|pubmed:23908328|pubmed:28166217|pubmed:29764757|pubmed:31194440|pubmed:3764113|pubmed:3916118|pubmed:39684|pubmed:7379253|wikipedia.en:Amrinone Graph 3-amino-5-(4-pyridinyl)-1,2-dihydro-2-pyridone|3-amino-5-(4-pyridinyl)-2(1H)-pyridinone|3-amino-5-(pyridin-4-yl)pyridin-2(1H)-one|3-amino-5-pyridin-4-yl-1H-pyridin-2-one|5-amino-1,6-dihydro-6-oxo-[3,4'-bipyridine]|5-amino[3,4'-bipyridin]-6(1H)-one|WIN 40680|WIN-40680|amrinona|amrinone|amrinonum|inamrinone 5-amino[3,4'-bipyridin]-6(1H)-one 3-amino-5-(4-pyridinyl)-1,2-dihydro-2-pyridone|3-amino-5-(4-pyridinyl)-2(1H)-pyridinone|3-amino-5-(pyridin-4-yl)pyridin-2(1H)-one|3-amino-5-pyridin-4-yl-1H-pyridin-2-one|5-amino-1,6-dihydro-6-oxo-[3,4'-bipyridine]|5-amino[3,4'-bipyridin]-6(1H)-one|WIN 40680|WIN-40680|amrinona|amrinone|amrinonum|inamrinone http://purl.obolibrary.org/obo/CHEBI_2686 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2687 biolink:ChemicalEntity amsacrine A sulfonamide that is N-phenylmethanesulfonamide substituted by a methoxy group at position 3 and an acridin-9-ylamino group at position 4. It exhibits antineoplastic activity. cas:51264-14-3|drugbank:DB00276|drugcentral:203|hmdb:HMDB0014421|kegg.compound:C01553|kegg.drug:D02321|pubmed:17675230|pubmed:9625435|reaxys:500176|wikipedia.en:Amsacrine Graph 4'-(9-Acridinylamino)-3'-methoxymethanesulfonanilide|4'-(9-Acridinylamino)methanesulfon-m-anisidide|4'-(9-Acridinylamino)methanesulfon-meta-anisidide|4'-(9-Acridinylamino)methanesulphon-m-anisidide|Amsacrine|N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide|amsacrina|amsacrinum|mAMSA N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide 4'-(9-Acridinylamino)-3'-methoxymethanesulfonanilide|4'-(9-Acridinylamino)methanesulfon-m-anisidide|4'-(9-Acridinylamino)methanesulfon-meta-anisidide|4'-(9-Acridinylamino)methanesulphon-m-anisidide|Amsacrine|N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide|amsacrina|amsacrinum|mAMSA http://purl.obolibrary.org/obo/CHEBI_2687 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26871 biolink:ChemicalEntity terpene alkaloid Graph terpene alkaloids terpene alkaloids http://purl.obolibrary.org/obo/CHEBI_26871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26872 biolink:ChemicalEntity terpene ketone Any terpenoid which contains a keto group. Graph http://purl.obolibrary.org/obo/CHEBI_26872 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26873 biolink:ChemicalEntity terpenoid Any isoprenoid that is a natural product or related compound formally derived from isoprene units. Terpenoids may contain oxygen in various functional groups. This class is subdivided according to the number of carbon atoms in the parent terpene. The skeleton of terpenoids may differ from strict additivity of isoprene units by the loss or shift of a fragment, generally a methyl group. wikipedia.en:Terpenoid Graph Terpenoid|terpenoide|terpenoides|terpenoids terpenoids Terpenoid|terpenoide|terpenoides|terpenoids http://purl.obolibrary.org/obo/CHEBI_26873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26874 biolink:ChemicalEntity terpenol Graph terpenols terpenols http://purl.obolibrary.org/obo/CHEBI_26874 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26875 biolink:ChemicalEntity terpenyl phosphate Graph terpenyl phosphates terpenyl phosphates http://purl.obolibrary.org/obo/CHEBI_26875 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26876 biolink:ChemicalEntity terpineol A family of monoterpenols that have a p-menthane skeleton containing one double bond and bearing a single hydroxy substituent. wikipedia.en:Terpineol Graph http://purl.obolibrary.org/obo/CHEBI_26876 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26878 biolink:ChemicalEntity tertiary alcohol A tertiary alcohol is a compound in which a hydroxy group, ‒OH, is attached to a saturated carbon atom which has three other carbon atoms attached to it. Graph tertiary alcohol|tertiary alcohols tertiary alcohol|tertiary alcohols http://purl.obolibrary.org/obo/CHEBI_26878 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26888 biolink:ChemicalEntity tetrachlorobenzene Any member of the class of chlorobenzenes carrying four chloro groups at unspecified positions. cas:12408-10-5 Graph Tetrachlorbenzol|tetrachlorobenzene tetrachlorobenzene Tetrachlorbenzol|tetrachlorobenzene http://purl.obolibrary.org/obo/CHEBI_26888 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26893 biolink:ChemicalEntity tetracyclic triterpenoid Any triterpenoid consisting of a tetracyclic skeleton. Graph tetracyclic triterpenoids tetracyclic triterpenoids http://purl.obolibrary.org/obo/CHEBI_26893 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26895 biolink:ChemicalEntity tetracyclines A subclass of polyketides having an octahydrotetracene-2-carboxamide skeleton, substituted with many hydroxy and other groups. Graph http://purl.obolibrary.org/obo/CHEBI_26895 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26900 biolink:ChemicalEntity tetradecenoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of a tetradecenoic acid. Graph tetradecenoyl-coenzyme A|tetradecenoyl-coenzyme As tetradecenoyl-coenzyme A|tetradecenoyl-coenzyme As http://purl.obolibrary.org/obo/CHEBI_26900 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26901 biolink:ChemicalEntity benzyltetrahydroisoquinoline Graph benzyltetrahydroisoquinolines|tetrahydrobenzylisoquinolines benzyltetrahydroisoquinolines|tetrahydrobenzylisoquinolines http://purl.obolibrary.org/obo/CHEBI_26901 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26907 biolink:ChemicalEntity tetrahydrofolic acid A group of heterocyclic compounds based on the 5,6,7,8-tetrahydropteroic acid skeleton conjugated with one or more L-glutamic acid units. Graph tetrahydrofolate|tetrahydrofolates|tetrahydrofolic acids tetrahydrofolate|tetrahydrofolates|tetrahydrofolic acids http://purl.obolibrary.org/obo/CHEBI_26907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26908 biolink:ChemicalEntity tetrahydrofolyl glutamate Graph tetrahydrofolyl glutamates tetrahydrofolyl glutamates http://purl.obolibrary.org/obo/CHEBI_26908 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26911 biolink:ChemicalEntity oxolane A cyclic ether that is butane in which one hydrogen from each methyl group is substituted by an oxygen. cas:109-99-9|gmelin:1767|hmdb:HMDB0000246|pubmed:12571688|pubmed:1811956|pubmed:1911404|pubmed:19716170|pubmed:21316415|pubmed:21842397|pubmed:2675957|reaxys:102391|umbbd.compound:c0019|wikipedia.en:THF Graph 1,4-epoxybutane|THF|butane alpha,delta-oxide|butylene oxide|furanidine|oxolane|tetrahydrofuran|tetramethylene oxide oxolane 1,4-epoxybutane|THF|butane alpha,delta-oxide|butylene oxide|furanidine|oxolane|tetrahydrofuran|tetramethylene oxide http://purl.obolibrary.org/obo/CHEBI_26911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26912 biolink:ChemicalEntity oxolanes Any oxacycle having an oxolane (tetrahydrofuran) skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_26912 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26914 biolink:ChemicalEntity tetrahydromethanopterin wikipedia.en:Tetrahydromethanopterin Graph tetrahydromethanopterins tetrahydromethanopterins http://purl.obolibrary.org/obo/CHEBI_26914 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26916 biolink:ChemicalEntity tetrahydronicotinamide adenine dinucleotide Graph tetrahydronicotinamide adenine dinucleotides tetrahydronicotinamide adenine dinucleotides http://purl.obolibrary.org/obo/CHEBI_26916 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26920 biolink:ChemicalEntity tetrahydropteroyltri-L-glutamate Graph tetrahydropteroyltri-L-glutamates tetrahydropteroyltri-L-glutamates http://purl.obolibrary.org/obo/CHEBI_26920 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26921 biolink:ChemicalEntity tetrahydropyridine Graph tetrahydropyridines tetrahydropyridines http://purl.obolibrary.org/obo/CHEBI_26921 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26925 biolink:ChemicalEntity naphthalenetetrol A hydroxynaphthalene carrying four hydroxy substituents. Graph http://purl.obolibrary.org/obo/CHEBI_26925 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26932 biolink:ChemicalEntity tetrapyrrole A natural pigment containing four pyrrole rings joined by one-carbon units linking position 2 of one pyrrole ring to position 5 of the next. Graph a tetrapyrrole|tetrapyrrole|tetrapyrroles tetrapyrrole|tetrapyrroles a tetrapyrrole|tetrapyrrole|tetrapyrroles http://purl.obolibrary.org/obo/CHEBI_26932 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26933 biolink:ChemicalEntity tetraric acid Graph tetraric acids tetraric acids http://purl.obolibrary.org/obo/CHEBI_26933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26935 biolink:ChemicalEntity tetraterpenoid Any terpenoid derived from a tetraterpene. The term includes compounds in which the C40 skeleton of the parent tetraterpene has been rearranged or modified by the removal of one or more skeletal atoms (generally methyl groups). lipidmaps_class:LMPR0107 Graph C40 isoprenoids|tetraterpenoides|tetraterpenoids tetraterpenoids C40 isoprenoids|tetraterpenoides|tetraterpenoids http://purl.obolibrary.org/obo/CHEBI_26935 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26936 biolink:ChemicalEntity tetrathionate ion kegg.compound:C02084|umbbd.compound:c0571 Graph tetrathionate ions|tetrathionates tetrathionate ions|tetrathionates http://purl.obolibrary.org/obo/CHEBI_26936 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26937 biolink:ChemicalEntity monoatomic tetracation Graph monoatomic tetracations|tetravalent inorganic cations monoatomic tetracations|tetravalent inorganic cations http://purl.obolibrary.org/obo/CHEBI_26937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26938 biolink:ChemicalEntity tetrose A four-carbon monosaccharide which in its linear form contains either an aldehyde group at position 1 (aldotetrose) or a ketone group at position 2 (ketotetrose). Graph tetrose|tetroses tetrose|tetroses http://purl.obolibrary.org/obo/CHEBI_26938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26945 biolink:ChemicalEntity thiamine phosphate Graph thiamine phosphates thiamine phosphates http://purl.obolibrary.org/obo/CHEBI_26945 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26948 biolink:ChemicalEntity vitamin B1 "Any member of the group of 1,3-thiazolium cations that exhibit biological activity against vitamin B1 deficiency in animals. Symptoms of vitamin B1 deficiency include constipation, loss of apetite, fatigue, nausea, delirium, blurry vision and muscle weakness. Severe vitamin B1 deficiency can also lead to a disease known as beriberi. Vitamin B1 consists of the vitamer thiamin and its acid, aldehyde and phosphorylated derivatives (and their corresponding ionized, salt and hydrate forms)." pubmed:28859374|pubmed:32554808 Graph thiamine|thiamines|thiamins|vitamin B1|vitamin B1 vitamer|vitamin B1 vitamers|vitamins B1 thiamine|thiamines|thiamins|vitamin B1|vitamin B1 vitamer|vitamin B1 vitamers|vitamins B1 http://purl.obolibrary.org/obo/CHEBI_26948 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26952 biolink:ChemicalEntity thioacetic acid kegg.compound:C01857 Graph Thioessigsaeure|ethanethioic acid ethanethioic acid Thioessigsaeure|ethanethioic acid http://purl.obolibrary.org/obo/CHEBI_26952 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26953 biolink:ChemicalEntity thioadenosine Graph thioadenosines thioadenosines http://purl.obolibrary.org/obo/CHEBI_26953 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26955 biolink:ChemicalEntity thiocyanates Esters of thiocyanic acid with general formula RSC≡N. Graph thiocyanates thiocyanates thiocyanates http://purl.obolibrary.org/obo/CHEBI_26955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26959 biolink:ChemicalEntity thiocarboxylic ester An ester in which one or both oxygens of an ester group have been replaced by divalent sulfur. Graph thiocarboxylic esters thiocarboxylic esters http://purl.obolibrary.org/obo/CHEBI_26959 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26961 biolink:ChemicalEntity thiophenes Compounds containing at least one thiophene ring. Graph http://purl.obolibrary.org/obo/CHEBI_26961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26965 biolink:ChemicalEntity thioglycines Graph thioglycines thioglycines http://purl.obolibrary.org/obo/CHEBI_26965 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:26975 biolink:ChemicalEntity thioribose phosphate Graph thioribose phosphate|thioribose phosphates thioribose phosphate|thioribose phosphates http://purl.obolibrary.org/obo/CHEBI_26975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26976 biolink:ChemicalEntity thioribose Any ribose derivative in which at least one of the oxygen atoms of the ribose moiety has been replaced by sulfur. Graph thioriboses thioriboses http://purl.obolibrary.org/obo/CHEBI_26976 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26977 biolink:ChemicalEntity thiosulfate An ester of thiosulfuric acid. Graph ester of thiosulfuric acid|esters of thiosulfuric acid|thiosulfate ester|thiosulfate esters|thiosulfates|thiosulphate|thiosulphates ester of thiosulfuric acid|esters of thiosulfuric acid|thiosulfate ester|thiosulfate esters|thiosulfates|thiosulphate|thiosulphates http://purl.obolibrary.org/obo/CHEBI_26977 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26979 biolink:ChemicalEntity organic heterotricyclic compound An organic tricyclic compound in which at least one of the rings of the tricyclic skeleton contains one or more heteroatoms. Graph heterotricyclic compounds|organic heterotricyclic compounds heterotricyclic compounds|organic heterotricyclic compounds http://purl.obolibrary.org/obo/CHEBI_26979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26980 biolink:ChemicalEntity tetritol phosphate Graph tetritol phosphate|tetritol phosphates tetritol phosphate|tetritol phosphates http://purl.obolibrary.org/obo/CHEBI_26980 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26981 biolink:ChemicalEntity threitol cas:7493-90-5|gmelin:82500|pubmed:20717558 Graph (R*,R*)-1,2,3,4-butanetetrol|rel-(2R,3R)-butane-1,2,3,4-tetrol|threo-tetritol rel-(2R,3R)-butane-1,2,3,4-tetrol (R*,R*)-1,2,3,4-butanetetrol|rel-(2R,3R)-butane-1,2,3,4-tetrol|threo-tetritol http://purl.obolibrary.org/obo/CHEBI_26981 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26984 biolink:ChemicalEntity threonic acid beilstein:1722842|beilstein:8036290|cas:3909-12-4 Graph (R*,S*)-2,3,4-trihydroxybutanoic acid|2,3,4-trihydroxy-(threo)-butanoic acid|rel-(2R,3S)-2,3,4-trihydroxybutanoic acid|threonic acid rel-(2R,3S)-2,3,4-trihydroxybutanoic acid|threonic acid (R*,S*)-2,3,4-trihydroxybutanoic acid|2,3,4-trihydroxy-(threo)-butanoic acid|rel-(2R,3S)-2,3,4-trihydroxybutanoic acid|threonic acid http://purl.obolibrary.org/obo/CHEBI_26984 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26986 biolink:ChemicalEntity threonine An α-amino acid in which one of the hydrogens attached to the α-carbon of glycine is substituted by a 1-hydroxyethyl group. beilstein:8204750|cas:80-68-2|pubmed:11379295|pubmed:15221503|pubmed:22264337|wikipedia.en:Threonine Graph Threonin|threonine threonine Threonin|threonine http://purl.obolibrary.org/obo/CHEBI_26986 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26987 biolink:ChemicalEntity threonine derivative An amino acid derivative resulting from reaction of threonine at the amino group or the carboxy group, or from the replacement of any hydrogen of threonine by a heteroatom. The definition normally excludes peptides containing threonine residues. Graph threonine derivatives threonine derivatives http://purl.obolibrary.org/obo/CHEBI_26987 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26995 biolink:ChemicalEntity thromboxane A class of oxygenated oxane derivatives, originally derived from prostaglandin precursors in platelets, that stimulate aggregation of platelets and constriction of blood vessels. lipidmaps_class:LMFA0303|wikipedia.en:Thromboxane Graph thromboxane|thromboxanes thromboxane|thromboxanes http://purl.obolibrary.org/obo/CHEBI_26995 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:26996 biolink:ChemicalEntity thromboxanes B Graph TXB TXB http://purl.obolibrary.org/obo/CHEBI_26996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2700 biolink:ChemicalEntity anandamide An N-acylethanolamine 20:4 resulting from the formal condensation of carboxy group of arachidonic acid with the amino group of ethanolamine. cas:94421-68-8|chemspider:4445241|foodb.food:FDB023303|hmdb:HMDB0004080|kegg.compound:C11695|lipidmaps:LMFA08040001|metacyc.compound:CPD-7598|pdb-ccd:E7Y|pubmed:15047233|pubmed:15797258|pubmed:15944392|pubmed:15997233|pubmed:16118355|pubmed:16957004|pubmed:18227059|pubmed:18691603|pubmed:19330032|pubmed:29363071|pubmed:29546791|pubmed:31610409|pubmed:32195347|pubmed:33551019|pubmed:33713246|pubmed:33731590|reaxys:7079463|wikipedia.en:Anandamide Graph (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-5,8,11,14-eicosatetraenamide|(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-tetraenamide|(all-Z)-N-(2-hydroxyethyl)-5,8,11,14-eicosatetraenamide|AEA|Anandamide|Anandamide (20.4, N-6)|Anandamide(20:4, N-6)|Arachidonic acid N-(hydroxyethyl)amide|Arachidonylethanolamide|N-(2-Hydroxyethyl)anachidonamide|N-(5Z,8Z,11Z,14Z-Eicosatetraenoyl)-ethanolamine|N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine|N-(5Z,8Z,11Z,14Z-icosatetraenoyl)-ethanolamide|N-arachidonoyl ethanolamine|N-arachidonoyl-2-hydroxyethylamide|N-arachidonoylethanolamine|arachidonoyl ethanolamide (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-tetraenamide (5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)-5,8,11,14-eicosatetraenamide|(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-tetraenamide|(all-Z)-N-(2-hydroxyethyl)-5,8,11,14-eicosatetraenamide|AEA|Anandamide|Anandamide (20.4, N-6)|Anandamide(20:4, N-6)|Arachidonic acid N-(hydroxyethyl)amide|Arachidonylethanolamide|N-(2-Hydroxyethyl)anachidonamide|N-(5Z,8Z,11Z,14Z-Eicosatetraenoyl)-ethanolamine|N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine|N-(5Z,8Z,11Z,14Z-icosatetraenoyl)-ethanolamide|N-arachidonoyl ethanolamine|N-arachidonoyl-2-hydroxyethylamide|N-arachidonoylethanolamine|arachidonoyl ethanolamide http://purl.obolibrary.org/obo/CHEBI_2700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27001 biolink:ChemicalEntity thymidine phosphate Graph thymidine phosphates thymidine phosphates http://purl.obolibrary.org/obo/CHEBI_27001 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27007 biolink:ChemicalEntity tin atom cas:7440-31-5|umbbd.compound:c0585|webelements:Sn Graph 50Sn|Sn|Zinn|estano|etain|stannum|tin tin 50Sn|Sn|Zinn|estano|etain|stannum|tin http://purl.obolibrary.org/obo/CHEBI_27007 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27008 biolink:ChemicalEntity tin molecular entity Graph tin compounds|tin molecular entities tin compounds|tin molecular entities http://purl.obolibrary.org/obo/CHEBI_27008 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27013 biolink:ChemicalEntity tocopherol A collective name for a group of closely related lipids that contain a chroman-6-ol nucleus substituted at position 2 by a methyl group and by a saturated hydrocarbon chain consisting of three isoprenoid units. They are designated as α-, β-, γ-, and δ-tocopherol depending on the number and position of additional methyl substituents on the aromatic ring. Tocopherols occur in vegetable oils and vegetable oil products, almost exclusively with R,R,R configuration. Tocotrienols differ from tocopherols only in having three double bonds in the hydrocarbon chain. cas:1406-66-2|wikipedia.en:Tocopherol Graph Methyltocols|Tocopherol|Tocopherols|tocoferol|tocoferoles|tocopherol|tocopherols Methyltocols|Tocopherol|Tocopherols|tocoferol|tocoferoles|tocopherol|tocopherols http://purl.obolibrary.org/obo/CHEBI_27013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27021 biolink:ChemicalEntity toluate Graph toluates toluates http://purl.obolibrary.org/obo/CHEBI_27021 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27023 biolink:ChemicalEntity toluene-4-sulfonate An arenesulfonate oxoanion that is the conjugate base of toluene-4-sulfonic acid. beilstein:1569490|cas:16722-51-3|gmelin:327129|umbbd.compound:c0301 Graph 4-methylbenzenesulfonate|4-methylbenzenesulfonic acid, ion(1-)|4-toluene sulfonate|4-toluenesulfonate|p-toluene sulfonate|p-toluenesulfonate|toluene-4-sulfonate|tosylate 4-methylbenzenesulfonate 4-methylbenzenesulfonate|4-methylbenzenesulfonic acid, ion(1-)|4-toluene sulfonate|4-toluenesulfonate|p-toluene sulfonate|p-toluenesulfonate|toluene-4-sulfonate|tosylate http://purl.obolibrary.org/obo/CHEBI_27023 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27024 biolink:ChemicalEntity toluenes Any member of the class of benzenes that is a substituted benzene in which the substituents include one (and only one) methyl group. Graph http://purl.obolibrary.org/obo/CHEBI_27024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27026 biolink:ChemicalEntity toxin Poisonous substance produced by a biological organism such as a microbe, animal or plant. wikipedia.en:Toxin Graph toxin|toxins toxin toxin|toxins http://purl.obolibrary.org/obo/CHEBI_27026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27027 biolink:ChemicalEntity micronutrient Any nutrient required in small quantities by organisms throughout their life in order to orchestrate a range of physiological functions. wikipedia.en:Micronutrient Graph micronutrients|trace elements micronutrients|trace elements http://purl.obolibrary.org/obo/CHEBI_27027 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2704 biolink:ChemicalEntity anastrozole A 1,2,4-triazole compound having a 3,5-bis(2-cyano-2-propyl)benzyl group at the 1-position. beilstein:8005958|cas:120511-73-1|drugbank:DB01217|drugcentral:210|kegg.compound:C08159|kegg.drug:D00960|lincs.smallmolecule:LSM-5631|patent:EP296749|patent:US4935437|wikipedia.en:Anastrozole Graph 2,2'-[5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-phenylene]bis(2-methylpropanenitrile)|Anastrozol|alpha,alpha,alpha',alpha'-Tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile|anastrozole 2,2'-[5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-phenylene]bis(2-methylpropanenitrile) 2,2'-[5-(1H-1,2,4-triazol-1-ylmethyl)-1,3-phenylene]bis(2-methylpropanenitrile)|Anastrozol|alpha,alpha,alpha',alpha'-Tetramethyl-5-(1H-1,2,4-triazol-1-ylmethyl)-m-benzenediacetonitrile|anastrozole http://purl.obolibrary.org/obo/CHEBI_2704 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27066 biolink:ChemicalEntity (9R,10R)-9,10-dihydrophenanthrene-9,10-diol beilstein:2053335|beilstein:5743772|umbbd.compound:c0534 Graph (9R,10R)-9,10-dihydrophenanthrene-9,10-diol|trans-9R,10R-dihydrodiolphenanthrene (9R,10R)-9,10-dihydrophenanthrene-9,10-diol (9R,10R)-9,10-dihydrophenanthrene-9,10-diol|trans-9R,10R-dihydrodiolphenanthrene http://purl.obolibrary.org/obo/CHEBI_27066 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27081 biolink:ChemicalEntity transition element atom An element whose atom has an incomplete d sub-shell, or which can give rise to cations with an incomplete d sub-shell. Graph Uebergangselement|Uebergangsmetalle|metal de transicion|metal de transition|metales de transicion|metaux de transition|transition element|transition elements|transition metal|transition metals transition element Uebergangselement|Uebergangsmetalle|metal de transicion|metal de transition|metales de transicion|metaux de transition|transition element|transition elements|transition metal|transition metals http://purl.obolibrary.org/obo/CHEBI_27081 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27082 biolink:ChemicalEntity trehalose A disaccharide formed by a (1↔1)-glycosidic bond between two units of D-glucose. Graph http://purl.obolibrary.org/obo/CHEBI_27082 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27083 biolink:ChemicalEntity trehalose mycolate Graph trehalose mycolates trehalose mycolates http://purl.obolibrary.org/obo/CHEBI_27083 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27084 biolink:ChemicalEntity trehalose phosphate Graph trehalose phosphates trehalose phosphates http://purl.obolibrary.org/obo/CHEBI_27084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27086 biolink:ChemicalEntity tributylstannane beilstein:3587329|cas:688-73-3|gmelin:4258|umbbd.compound:c0579 Graph SnBu3H|TBT|Tri-n-butyltin|Tri-n-butyltin hydride|Tributyltin|[Sn(Bu)3H]|tributylstannane tributylstannane SnBu3H|TBT|Tri-n-butyltin|Tri-n-butyltin hydride|Tributyltin|[Sn(Bu)3H]|tributylstannane http://purl.obolibrary.org/obo/CHEBI_27086 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27092 biolink:ChemicalEntity tricarboxylic acid trianion Graph tricarboxylate|tricarboxylates|tricarboxylic acid trianions tricarboxylate|tricarboxylates|tricarboxylic acid trianions http://purl.obolibrary.org/obo/CHEBI_27092 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27093 biolink:ChemicalEntity tricarboxylic acid An oxoacid containing three carboxy groups. wikipedia.en:Tricarboxylic_acid Graph Tricarbonsaeure|Trikarbonsaeure|tricarboxylic acids Tricarbonsaeure|Trikarbonsaeure|tricarboxylic acids http://purl.obolibrary.org/obo/CHEBI_27093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27096 biolink:ChemicalEntity trichlorobenzene Any member of the class of chlorobenzenes carrying three chloro substituents at unspecified positions. wikipedia.en:Trichlorobenzene Graph Trichlorbenzol|trichlorobenzene trichlorobenzene Trichlorbenzol|trichlorobenzene http://purl.obolibrary.org/obo/CHEBI_27096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27102 biolink:ChemicalEntity trichlorophenol Any one of the six possible isomers of trichlorophenol. wikipedia.en:Trichlorophenol Graph http://purl.obolibrary.org/obo/CHEBI_27102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27105 biolink:ChemicalEntity tridecadienoic acid A C13 carboxylic acid having two double bonds at unspecified positions in the chain. Graph tridecadienoic acids tridecadienoic acids http://purl.obolibrary.org/obo/CHEBI_27105 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27110 biolink:ChemicalEntity trifluoroacetate cas:14477-72-6|gmelin:82342|umbbd.compound:c0799 Graph CF3CO2 anion|CF3COO(-)|tfa|trifluoroacetate|trifluoroacetic acid, ion(1-) trifluoroacetate CF3CO2 anion|CF3COO(-)|tfa|trifluoroacetate|trifluoroacetic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_27110 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27114 biolink:ChemicalEntity trihydroxy-5beta-cholanic acid Graph trihydroxy-5beta-cholanic acids trihydroxy-5beta-cholanic acids http://purl.obolibrary.org/obo/CHEBI_27114 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27115 biolink:ChemicalEntity trihydroxybenzoic acid Graph trihydroxybenzoic acids trihydroxybenzoic acids http://purl.obolibrary.org/obo/CHEBI_27115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27116 biolink:ChemicalEntity trihydroxyflavone Any hydroxyflavone carrying three hydroxy groups at unspecified positions. Graph trihydroxyflavones trihydroxyflavones http://purl.obolibrary.org/obo/CHEBI_27116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27118 biolink:ChemicalEntity naphthalenetriol A hydroxynaphthalene substituted by at least three hydroxy groups. Graph http://purl.obolibrary.org/obo/CHEBI_27118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27119 biolink:ChemicalEntity trihydroxytoluene Any hydroxytoluene that has three hydroxy substituents. Graph http://purl.obolibrary.org/obo/CHEBI_27119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27120 biolink:ChemicalEntity triihydroxypyridine Graph triihydroxypyridines triihydroxypyridines http://purl.obolibrary.org/obo/CHEBI_27120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27124 biolink:ChemicalEntity trimethoxyflavone A methoxyflavone that is flavone substituted by three methoxy groups. Graph trimethoxyflavones trimethoxyflavones http://purl.obolibrary.org/obo/CHEBI_27124 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27134 biolink:ChemicalEntity trimethylxanthine Graph trimethylxanthines trimethylxanthines http://purl.obolibrary.org/obo/CHEBI_27134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27135 biolink:ChemicalEntity trinitrotoluene umbbd.compound:c0439 Graph TNT|trinitrotoluenes TNT|trinitrotoluenes http://purl.obolibrary.org/obo/CHEBI_27135 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27136 biolink:ChemicalEntity triol A chemical compound containing three hydroxy groups. Graph triols triols http://purl.obolibrary.org/obo/CHEBI_27136 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27137 biolink:ChemicalEntity triose A monosaccharide containing three carbon atoms, which is important in respiration. Only two trioses occur naturally: the aldotriose glyceraldehyde and the ketotriose dihydroxyacetone. Graph triose|trioses triose|trioses http://purl.obolibrary.org/obo/CHEBI_27137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:271436 biolink:ChemicalEntity N,N-dimethylethanolamine A tertiary amine that is ethanolamine having two N-methyl substituents. cas:108-01-0|drugcentral:787|hmdb:HMDB0032231|pubmed:10930630|pubmed:112632|pubmed:150413|pubmed:15675889|pubmed:17300230|pubmed:22300295|pubmed:251230|pubmed:3173167|pubmed:3361965|pubmed:6099712|pubmed:6106283|pubmed:6679337|pubmed:6694079|pubmed:7020434|pubmed:830732|pubmed:850128|pubmed:913228|reaxys:1209235|wikipedia.en:Dimethylethanolamine Graph (2-Hydroxyethyl)dimethylamine|2-(Dimethylamino)-1-ethanol|2-(N,N-Dimethylamino)ethanol|2-(dimethylamino)ethanol|2-Dimethylaminoethanol|DMAE|DMEA|Deanol|Dimethyl(2-hydroxyethyl)amine|Dimethyl(hydroxyethyl)amine|Dimethylaethanolamin|Dimethylaminoaethanol|Dimethylethanolamine|Dimethylmonoethanolamine|N,N-Dimethyl-2-aminoethanol|N,N-Dimethyl-2-hydroxyethylamine|N,N-Dimethyl-N-(2-hydroxyethyl)amine|N,N-Dimethyl-N-(beta-hydroxyethyl)amine|N,N-Dimethylaminoethanol|N,N-Dimethylethanolamine|N,N-dimethylethanolamine|N-(2-Hydroxyethyl)dimethylamine|N-Dimethylaminoethanol|Norcholine|Propamine A|beta-Dimethylaminoethyl alcohol|beta-Hydroxyethyldimethylamine 2-(dimethylamino)ethanol (2-Hydroxyethyl)dimethylamine|2-(Dimethylamino)-1-ethanol|2-(N,N-Dimethylamino)ethanol|2-(dimethylamino)ethanol|2-Dimethylaminoethanol|DMAE|DMEA|Deanol|Dimethyl(2-hydroxyethyl)amine|Dimethyl(hydroxyethyl)amine|Dimethylaethanolamin|Dimethylaminoaethanol|Dimethylethanolamine|Dimethylmonoethanolamine|N,N-Dimethyl-2-aminoethanol|N,N-Dimethyl-2-hydroxyethylamine|N,N-Dimethyl-N-(2-hydroxyethyl)amine|N,N-Dimethyl-N-(beta-hydroxyethyl)amine|N,N-Dimethylaminoethanol|N,N-Dimethylethanolamine|N,N-dimethylethanolamine|N-(2-Hydroxyethyl)dimethylamine|N-Dimethylaminoethanol|Norcholine|Propamine A|beta-Dimethylaminoethyl alcohol|beta-Hydroxyethyldimethylamine http://purl.obolibrary.org/obo/CHEBI_271436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27150 biolink:ChemicalEntity trisaccharide wikipedia.en:Trisaccharide Graph trisaccharides trisaccharides http://purl.obolibrary.org/obo/CHEBI_27150 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27153 biolink:ChemicalEntity monoatomic trication Graph monoatomic trications|trivalent inorganic cations monoatomic trications|trivalent inorganic cations http://purl.obolibrary.org/obo/CHEBI_27153 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2716 biolink:ChemicalEntity anethole A monomethoxybenzene that is methoxybenzene substituted by a prop-1-en-1-yl group at position 4. cas:104-46-1|lincs.smallmolecule:LSM-37103|pubmed:24689303|reaxys:774229 Graph 1-methoxy-4-(prop-1-en-1-yl)benzene|methyl 4-(prop-1-en-1-yl)phenyl ether|p-propenylanisole 1-methoxy-4-(prop-1-en-1-yl)benzene 1-methoxy-4-(prop-1-en-1-yl)benzene|methyl 4-(prop-1-en-1-yl)phenyl ether|p-propenylanisole http://purl.obolibrary.org/obo/CHEBI_2716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27162 biolink:ChemicalEntity tryptamines Tryptamine and its substitution derivatives. Graph http://purl.obolibrary.org/obo/CHEBI_27162 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27164 biolink:ChemicalEntity tryptophan derivative An amino acid derivative resulting from reaction of tryptophan at the amino group or the carboxy group, or from the replacement of any hydrogen of tryptophan by a heteroatom. The definition normally excludes peptides containing tryptophan residues. Graph tryptophan derivatives tryptophan derivatives http://purl.obolibrary.org/obo/CHEBI_27164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27171 biolink:ChemicalEntity organic heterobicyclic compound Graph heterobicyclic compounds|organic heterobicyclic compounds heterobicyclic compounds|organic heterobicyclic compounds http://purl.obolibrary.org/obo/CHEBI_27171 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27175 biolink:ChemicalEntity tyramines Aralkylamino compounds which contain a tyramine skeleton. Graph http://purl.obolibrary.org/obo/CHEBI_27175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27177 biolink:ChemicalEntity L-tyrosine derivative A proteinogenic amino acid derivative resulting from reaction of L-tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of L-tyrosine by a heteroatom. Graph L-tyrosine derivatives L-tyrosine derivatives http://purl.obolibrary.org/obo/CHEBI_27177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27191 biolink:ChemicalEntity undecaprenols Polyprenols comprising eleven prenyl units with a terminal hydroxy group. Graph http://purl.obolibrary.org/obo/CHEBI_27191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27193 biolink:ChemicalEntity undecaprenyl phosphate Graph undecaprenyl phosphates undecaprenyl phosphates http://purl.obolibrary.org/obo/CHEBI_27193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27194 biolink:ChemicalEntity undecaprenyldiphospho-N-acetylmuramoyl peptide Graph undecaprenyldiphospho-N-acetylmuramoyl peptides undecaprenyldiphospho-N-acetylmuramoyl peptides http://purl.obolibrary.org/obo/CHEBI_27194 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27207 biolink:ChemicalEntity univalent carboacyl group A univalent carboacyl group is a group formed by loss of OH from the carboxy group of a carboxylic acid. Graph univalent acyl group|univalent carboacyl groups|univalent carboxylic acyl groups univalent acyl group|univalent carboacyl groups|univalent carboxylic acyl groups http://purl.obolibrary.org/obo/CHEBI_27207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27208 biolink:ChemicalEntity unsaturated fatty acid Any fatty acid containing at least one C=C or C≡C bond. lipidmaps_class:LMFA0103|pubmed:5322381 Graph alkene acid|olefinic acid|unsaturated fatty acids alkene acid|olefinic acid|unsaturated fatty acids http://purl.obolibrary.org/obo/CHEBI_27208 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27216 biolink:ChemicalEntity urate(2-) Graph urate dianion urate dianion http://purl.obolibrary.org/obo/CHEBI_27216 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27226 biolink:ChemicalEntity uric acid An oxopurine that is the final oxidation product of purine metabolism. hmdb:HMDB0000289|wikipedia.en:Uric_acid Graph uric acids uric acids http://purl.obolibrary.org/obo/CHEBI_27226 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27232 biolink:ChemicalEntity uridine 5'-phosphate Graph uridine 5'-phosphates uridine 5'-phosphates http://purl.obolibrary.org/obo/CHEBI_27232 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27237 biolink:ChemicalEntity uridine phosphate Graph uridine phosphates uridine phosphates http://purl.obolibrary.org/obo/CHEBI_27237 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27242 biolink:ChemicalEntity uridines Graph http://purl.obolibrary.org/obo/CHEBI_27242 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27247 biolink:ChemicalEntity urocanate An monocarboxylic acid anion that is the conjugate base of urocanic acid. ecmdb:ECMDB21396|kegg.compound:C00785|metacyc.compound:UROCANATE Graph 3-(1H-imidazol-4-yl)prop-2-enoate|urocanate 3-(1H-imidazol-4-yl)prop-2-enoate 3-(1H-imidazol-4-yl)prop-2-enoate|urocanate http://purl.obolibrary.org/obo/CHEBI_27247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27248 biolink:ChemicalEntity urocanic acid An α,β-unsaturated monocarboxylic acid that is prop-2-enoic acid substituted by a 1H-imidazol-4-yl group at position 3. It is a metabolite of hidtidine. cas:104-98-3|ecmdb:ECMDB21396|hmdb:HMDB0000301|metacyc.compound:UROCANATE|pdb-ccd:URO|pubmed:11669511|pubmed:24397532|pubmed:24627570|reaxys:8128219|wikipedia.en:Urocanic_acid Graph 3-(1H-imidazol-4-yl)-2-propenoic acid|3-(1H-imidazol-4-yl)prop-2-enoic acid|3-imidazol-4-ylacrylic acid 3-(1H-imidazol-4-yl)prop-2-enoic acid 3-(1H-imidazol-4-yl)-2-propenoic acid|3-(1H-imidazol-4-yl)prop-2-enoic acid|3-imidazol-4-ylacrylic acid http://purl.obolibrary.org/obo/CHEBI_27248 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27252 biolink:ChemicalEntity uronic acid A carbohydrate acid formally derived by oxidation to a carboxy group of the terminal ‒CH2OH group of any aldose or ketose. Graph uronic acid|uronic acids uronic acid|uronic acids http://purl.obolibrary.org/obo/CHEBI_27252 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27258 biolink:ChemicalEntity uroporphyrinogen Graph uroporphyrinogens uroporphyrinogens http://purl.obolibrary.org/obo/CHEBI_27258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27266 biolink:ChemicalEntity valine A branched-chain amino acid that consists of glycine in which one of the hydrogens attached to the α-carbon is substituted by an isopropyl group. cas:516-06-3|gmelin:49877|kegg.compound:C16436|pubmed:17190852|pubmed:22770225|reaxys:506689|wikipedia.en:Valine Graph 2-amino-3-methylbutanoic acid|DL-valine|Hval|Valin|valina|valine valine 2-amino-3-methylbutanoic acid|DL-valine|Hval|Valin|valina|valine http://purl.obolibrary.org/obo/CHEBI_27266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27267 biolink:ChemicalEntity valine derivative An amino acid derivative resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of valine by a heteroatom. The definition normally excludes peptides containing valine residues. Graph http://purl.obolibrary.org/obo/CHEBI_27267 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27273 biolink:ChemicalEntity vanadic acid gmelin:82029 Graph H3VO4|Vanadiumsaeure|[VO(OH)3]|trihydrogen(tetraoxidovanadate)|trihydroxidooxidovanadium trihydrogen(tetraoxidovanadate)|trihydroxidooxidovanadium H3VO4|Vanadiumsaeure|[VO(OH)3]|trihydrogen(tetraoxidovanadate)|trihydroxidooxidovanadium http://purl.obolibrary.org/obo/CHEBI_27273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27275 biolink:ChemicalEntity vanadium molecular entity Graph vanadium compounds|vanadium molecular entities|vanadium molecular entity vanadium compounds|vanadium molecular entities|vanadium molecular entity http://purl.obolibrary.org/obo/CHEBI_27275 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27283 biolink:ChemicalEntity very long-chain fatty acid A fatty acid which has a chain length greater than C22. Very long-chain fatty acids which have a chain length greater than C27 are also known as ultra-long-chain fatty acids. lipidmaps:LMFA01010025 Graph VLCFA|VLCFAs|higher fatty acid|very long-chain fatty acids VLCFA|VLCFAs|higher fatty acid|very long-chain fatty acids http://purl.obolibrary.org/obo/CHEBI_27283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27288 biolink:ChemicalEntity vinca alkaloid A group of indole-indoline dimers which are alkaloids obtained from the Vinca genus of plants, together with semi-synthetic and fully synthetic analogues. wikipedia.en:Vinca_alkaloid Graph vinca alkaloid|vinca alkaloids|vincaleukoblastines vinca alkaloid|vinca alkaloids|vincaleukoblastines http://purl.obolibrary.org/obo/CHEBI_27288 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27295 biolink:ChemicalEntity violaxanthin An epoxycarotenol that is 5,5',6,6'-tetrahydro-5,6:5',6'-diepoxy-β,β-carotene substituted by hydroxy groups at positions 3 and 3'. It is the naturally occurring xanthophyll pigment found in a variety of plants. Graph http://purl.obolibrary.org/obo/CHEBI_27295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27300 biolink:ChemicalEntity vitamin D Any member of a group of fat-soluble hydroxy seco-steroids that exhibit biological activity against vitamin D deficiency. Vitamin D can be obtained from sun exposure, food and supplements and is biologically inactive and converted into the biologically active calcitriol via double hydroxylation in the body. metacyc.compound:Vitamin-D|wikipedia.en:Vitamin_D Graph D vitamins|vitamin D vitamer|vitamin D vitamers|vitamin Ds|vitamins D D vitamins|vitamin D vitamer|vitamin D vitamers|vitamin Ds|vitamins D http://purl.obolibrary.org/obo/CHEBI_27300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27306 biolink:ChemicalEntity vitamin B6 Any member of the group of pyridines that exhibit biological activity against vitamin B6 deficiency. Vitamin B6 deficiency is associated with microcytic anemia, electroencephalographic abnormalities, dermatitis with cheilosis (scaling on the lips and cracks at the corners of the mouth) and glossitis (swollen tongue), depression and confusion, and weakened immune function. Vitamin B6 consists of the vitamers pyridoxine, pyridoxal, and pyridoxamine and their respective 5'-phosphate esters (and includes their corresponding ionized and salt forms). Graph Vitamin B6|vitamin B-6|vitamin B6 vitamer|vitamin B6 vitamers|vitamina B6|vitamine B6|vitamins B6 Vitamin B6|vitamin B-6|vitamin B6 vitamer|vitamin B6 vitamers|vitamina B6|vitamine B6|vitamins B6 http://purl.obolibrary.org/obo/CHEBI_27306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27311 biolink:ChemicalEntity volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. wikipedia.en:Essential_oil Graph essential oil component|essential oil components|ethereal oil component|ethereal oil components|volatile oil components essential oil component|essential oil components|ethereal oil component|ethereal oil components|volatile oil components http://purl.obolibrary.org/obo/CHEBI_27311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27314 biolink:ChemicalEntity water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. Graph wasserloesliche Vitamine|water-soluble vitamin|water-soluble vitamins wasserloesliche Vitamine|water-soluble vitamin|water-soluble vitamins http://purl.obolibrary.org/obo/CHEBI_27314 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27323 biolink:ChemicalEntity xanthommatins Graph http://purl.obolibrary.org/obo/CHEBI_27323 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27325 biolink:ChemicalEntity xanthophyll A subclass of carotenoids consisting of the oxygenated carotenes. drugbank:DB00137 Graph xanthophylls xanthophylls xanthophylls http://purl.obolibrary.org/obo/CHEBI_27325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27329 biolink:ChemicalEntity xanthosine phosphate Graph xanthosine phosphates xanthosine phosphates http://purl.obolibrary.org/obo/CHEBI_27329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27338 biolink:ChemicalEntity xylene cas:1330-20-7|kegg.compound:C19551|wikipedia.en:Xylene Graph Dimethylbenzol|Xylol|Xylole|dimethylbenzene|methyl toluene|methyltoluene|xileno|xilenos|xylene|xylenes xylene Dimethylbenzol|Xylol|Xylole|dimethylbenzene|methyl toluene|methyltoluene|xileno|xilenos|xylene|xylenes http://purl.obolibrary.org/obo/CHEBI_27338 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27341 biolink:ChemicalEntity xylitol phosphate Graph xylitol phosphate|xylitol phosphates xylitol phosphate|xylitol phosphates http://purl.obolibrary.org/obo/CHEBI_27341 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27343 biolink:ChemicalEntity xylogalacturonan Graph xylogalacturonans xylogalacturonans http://purl.obolibrary.org/obo/CHEBI_27343 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27345 biolink:ChemicalEntity xylonate Graph rel-(2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|xylonate rel-(2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|xylonate rel-(2R,3S,4R)-2,3,4,5-tetrahydroxypentanoate|xylonate http://purl.obolibrary.org/obo/CHEBI_27345 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27346 biolink:ChemicalEntity xylonates Graph http://purl.obolibrary.org/obo/CHEBI_27346 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27347 biolink:ChemicalEntity xylonolactone Graph xylonolactones xylonolactones http://purl.obolibrary.org/obo/CHEBI_27347 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27349 biolink:ChemicalEntity xylose phosphate Graph xylose phosphate|xylose phosphates xylose phosphate|xylose phosphates http://purl.obolibrary.org/obo/CHEBI_27349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2735 biolink:ChemicalEntity Anisodamine cas:55869-99-3|kegg.compound:C10842|knapsack:C00002274 Graph 6-Hydroxyhyoscyamine|Anisodamine 6-Hydroxyhyoscyamine|Anisodamine http://purl.obolibrary.org/obo/CHEBI_2735 http://purl.obolibrary.org/obo/chebi/2_STAR
CHEBI:27350 biolink:ChemicalEntity xyloside Graph xyloside|xylosides xyloside|xylosides http://purl.obolibrary.org/obo/CHEBI_27350 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27353 biolink:ChemicalEntity xylulose Graph threo-pent-2-ulose threo-pent-2-ulose threo-pent-2-ulose http://purl.obolibrary.org/obo/CHEBI_27353 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27354 biolink:ChemicalEntity xylulose 5-phosphate A xylulose phosphate in which the phosphate group is at position 5. It is an intermediate metabolite in the pentose phosphate pathway. pubmed:24659577|wikipedia.en:Xylulose_5-phosphate Graph xylulose 5-(dihydrogen phosphate) xylulose 5-(dihydrogen phosphate) xylulose 5-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_27354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27355 biolink:ChemicalEntity xylulose phosphate Graph xylulose phosphate|xylulose phosphates xylulose phosphate|xylulose phosphates http://purl.obolibrary.org/obo/CHEBI_27355 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27358 biolink:ChemicalEntity yohimban alkaloid Graph yohimban alkaloids yohimban alkaloids http://purl.obolibrary.org/obo/CHEBI_27358 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27362 biolink:ChemicalEntity zeta-carotene kegg.compound:C05430 Graph 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene 2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene http://purl.obolibrary.org/obo/CHEBI_27362 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27363 biolink:ChemicalEntity zinc atom cas:7440-66-6|gmelin:16321|kegg.compound:C00038|pdb-ccd:ZN|webelements:Zn Graph 30Zn|Zink|Zn|Zn(II)|Zn2+|cinc|zinc|zincum zinc 30Zn|Zink|Zn|Zn(II)|Zn2+|cinc|zinc|zincum http://purl.obolibrary.org/obo/CHEBI_27363 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27364 biolink:ChemicalEntity zinc molecular entity Graph zinc compounds|zinc molecular entities zinc compounds|zinc molecular entities http://purl.obolibrary.org/obo/CHEBI_27364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27365 biolink:ChemicalEntity zinc ion Graph zinc ion|zinc ions zinc ion|zinc ions http://purl.obolibrary.org/obo/CHEBI_27365 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27369 biolink:ChemicalEntity zwitterion A neutral compound having formal unit electrical charges of opposite sign on non-adjacent atoms. Sometimes referred to as inner salts, dipolar ions (a misnomer). Graph compose zwitterionique|compuestos zwitterionicos|zwitterion|zwitteriones|zwitterionic compounds|zwitterions zwitterion|zwitterions compose zwitterionique|compuestos zwitterionicos|zwitterion|zwitteriones|zwitterionic compounds|zwitterions http://purl.obolibrary.org/obo/CHEBI_27369 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27372 biolink:ChemicalEntity 1D-chiro-inositol Belonging to the inositol family of compounds, D-chiro-inositol (DCI) is an isomer of glucose. It is an important secondary messenger in insulin signal transduction. cas:643-12-9|chemspider:10254647|drugbank:DB15350|foodb.food:FDB001138|hmdb:HMDB0240209|kegg.compound:C19891|knapsack:C00053119|pdb-ccd:CBU|pubmed:18783340|pubmed:22843669|pubmed:25315464|pubmed:31382802|pubmed:33188584|pubmed:33506934|pubmed:33755975|pubmed:33859622|pubmed:34073634|pubmed:34078260|pubmed:34335474|pubmed:37111094|pubmed:38005597|pubmed:38117862|pubmed:38568465|wikipedia.en:1D-chiro-Inositol Graph (+)-Inositol|(+)-chiro-inositol|(1R,2R,3S,4S,5S,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,4/3,5,6-cyclohexanehexol|1D-chiro-inositol|D-(+)-chiro-inositol|D-chiro-inositol|D-inositol|DCI|cis-1,2,4-trans-3,5,6-Cyclohexanehexol 1D-chiro-inositol (+)-Inositol|(+)-chiro-inositol|(1R,2R,3S,4S,5S,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,4/3,5,6-cyclohexanehexol|1D-chiro-inositol|D-(+)-chiro-inositol|D-chiro-inositol|D-inositol|DCI|cis-1,2,4-trans-3,5,6-Cyclohexanehexol http://purl.obolibrary.org/obo/CHEBI_27372 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27373 biolink:ChemicalEntity pantothenol A monocarboxylic acid amide that is 3,3-dimethylbutanamide substituted by hydroxy groups at positions 2 and 4 and a 3-hydroxypropyl group at the carbomyl nitrogen. cas:81-13-0|drugcentral:838|kegg.compound:C05944|kegg.drug:D00193|patent:CH227706|patent:GB582156|patent:US2413077|pubmed:24506320|pubmed:24759689|pubmed:25040679|reaxys:1724947|wikipedia.en:Dexpanthenol Graph (+)-Panthenol|(2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|(R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|Bepanthen|Bepanthene|Bepantol|Cozyme|D(+)-Panthenol|D(+)-Pantothenyl alcohol|D-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide|D-P-A Injection|D-Panthenol|Dexpanthenol|Ilopan|Motilyn|N-Pantoyl-propanolamine|Panadon|Panthenol|Panthoderm|Pantol|Pantothenol|Pantothenyl alcohol|Provitamin B|Synapan|Thenalton|Zentinic|d-Pantothenol|d-Pantothenyl alcohol|dexpanthenol (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (+)-Panthenol|(2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|(R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide|Bepanthen|Bepanthene|Bepantol|Cozyme|D(+)-Panthenol|D(+)-Pantothenyl alcohol|D-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide|D-P-A Injection|D-Panthenol|Dexpanthenol|Ilopan|Motilyn|N-Pantoyl-propanolamine|Panadon|Panthenol|Panthoderm|Pantol|Pantothenol|Pantothenyl alcohol|Provitamin B|Synapan|Thenalton|Zentinic|d-Pantothenol|d-Pantothenyl alcohol|dexpanthenol http://purl.obolibrary.org/obo/CHEBI_27373 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27374 biolink:ChemicalEntity 1L-chiro-inositol cas:551-72-4|kegg.compound:C06151 Graph (-)-Inositol|(1R,2R,3R,4R,5S,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,4/3,5,6-cyclohexanehexol|1L-chiro-inositol|L-Inositol 1L-chiro-inositol (-)-Inositol|(1R,2R,3R,4R,5S,6S)-cyclohexane-1,2,3,4,5,6-hexol|1,2,4/3,5,6-cyclohexanehexol|1L-chiro-inositol|L-Inositol http://purl.obolibrary.org/obo/CHEBI_27374 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27375 biolink:ChemicalEntity vincaleukoblastine beilstein:4779207|cas:865-21-4|drugbank:DB00570|drugcentral:2823|hmdb:HMDB0014710|kegg.compound:C07201|kegg.drug:D08675|knapsack:C00001781|pdb-ccd:VLB|pubmed:11878966|pubmed:15917812|pubmed:20394103|pubmed:22868758|pubmed:25586069|pubmed:26660762|pubmed:27518442|pubmed:35404502|wikipedia.en:Vinblastine Graph (+)-vinblastine|(2ALPHA,2'BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLASTINE|VLB|vinblastina|vinblastine|vinblastinum|vincaleukoblastine vincaleukoblastine (+)-vinblastine|(2ALPHA,2'BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLASTINE|VLB|vinblastina|vinblastine|vinblastinum|vincaleukoblastine http://purl.obolibrary.org/obo/CHEBI_27375 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27376 biolink:ChemicalEntity methanesulfonic acid An alkanesulfonic acid in which the alkyl group directly linked to the sulfo functionality is methyl. cas:75-75-2|gmelin:1681|kegg.compound:C11145|metacyc.compound:CPD-3746|pubmed:24304088|pubmed:24593036|reaxys:1446024|wikipedia.en:Methanesulfonic_acid Graph Methanesulfonic acid|Methansulfonsaeure|methanesulfonic acid|methylsulfonic acid Methanesulfonic acid|methanesulfonic acid Methanesulfonic acid|Methansulfonsaeure|methanesulfonic acid|methylsulfonic acid http://purl.obolibrary.org/obo/CHEBI_27376 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27378 biolink:ChemicalEntity (2S,3R)-aldopyranose Any aldose having 2S,3R-threo stereochemistry. A representative structure is provided. kegg.compound:C02143|metacyc.compound:CPD-8548 Graph (2S,3R)-Aldose|D-threo-aldose|a D-threo-aldose (2S,3R)-Aldose|D-threo-aldose|a D-threo-aldose http://purl.obolibrary.org/obo/CHEBI_27378 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27379 biolink:ChemicalEntity 3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α,12α-trihydroxy-24-oxo-5β-cholestan-26-oic acid and coenzyme A. kegg.compound:C05467 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-24-oxo-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-24-oxo-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA|3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27380 biolink:ChemicalEntity (1->6)-beta-D-glucan kegg.compound:C02493 Graph (1->6)-beta-D-glucopyranan|1,6-beta-D-Glucan (1->6)-beta-D-glucopyranan (1->6)-beta-D-glucopyranan|1,6-beta-D-Glucan http://purl.obolibrary.org/obo/CHEBI_27380 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27384 biolink:ChemicalEntity 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid An imidazol-4-one having a 2-carboxyethyl substituent at the 5-position. cas:17340-16-8|kegg.compound:C03680 Graph 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid|4,5-Dihydro-4-oxo-5-imidazolepropanoate|4,5-Dihydro-5-oxo-1H-imidazole-4-propanoic acid|4-Imidazolone-5-propanoate|4-Imidazolone-5-propionic acid|Imidazol-4-one-5-propionic acid 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid|4,5-Dihydro-4-oxo-5-imidazolepropanoate|4,5-Dihydro-5-oxo-1H-imidazole-4-propanoic acid|4-Imidazolone-5-propanoate|4-Imidazolone-5-propionic acid|Imidazol-4-one-5-propionic acid http://purl.obolibrary.org/obo/CHEBI_27384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27385 biolink:ChemicalEntity tetrachloromethane A chlorocarbon that is methane in which all the hydrogens have been replaced by chloro groups. cas:56-23-5|drugcentral:3067|gmelin:2347|hmdb:HMDB0031330|kegg.compound:C07561|lincs.smallmolecule:LSM-37019|ppdb:1350|pubmed:24395137|pubmed:24726765|reaxys:1098295|umbbd.compound:c0486|wikipedia.en:Carbon_Tetrachloride Graph CCl4|Carbon tetrachloride|Kohlenstofftetrachlorid|Tetra|Tetrachlorkohlenstoff|Tetrachlormethan|Tetrachloromethane|tetrachloridocarbon|tetrachloromethane Tetrachloromethane|tetrachloromethane CCl4|Carbon tetrachloride|Kohlenstofftetrachlorid|Tetra|Tetrachlorkohlenstoff|Tetrachlormethan|Tetrachloromethane|tetrachloridocarbon|tetrachloromethane http://purl.obolibrary.org/obo/CHEBI_27385 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27386 biolink:ChemicalEntity cinnamic acid A monocarboxylic acid that consists of acrylic acid bearing a phenyl substituent at the 3-position. It is found in Cinnamomum cassia. cas:621-82-9|gmelin:328659|hmdb:HMDB0000567|kegg.compound:C10438|pubmed:19238838|pubmed:24636064|pubmed:24868863|pubmed:7628877|reaxys:507757|wikipedia.en:Cinnamic_acid Graph 3-phenyl-2-propenoic acid|3-phenylacrylic acid|3-phenylprop-2-enoic acid|3-phenylpropenoic acid|Cinnamic acid|PhCH=CHCO2H|Zimtsaeure|benzenepropenoic acid|benzylideneacetic acid|beta-phenylacrylic acid|phenylacrylic acid 3-phenylprop-2-enoic acid 3-phenyl-2-propenoic acid|3-phenylacrylic acid|3-phenylprop-2-enoic acid|3-phenylpropenoic acid|Cinnamic acid|PhCH=CHCO2H|Zimtsaeure|benzenepropenoic acid|benzylideneacetic acid|beta-phenylacrylic acid|phenylacrylic acid http://purl.obolibrary.org/obo/CHEBI_27386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27389 biolink:ChemicalEntity 3-aminoisobutyric acid A β-amino-acid that is isobutyric acid in which one of the methyl hydrogens is substituted by an amino group. beilstein:1720958|beilstein:1745458|cas:10569-72-9|cas:144-90-1|gmelin:1520758|hmdb:HMDB0003911|kegg.compound:C05145|lipidmaps:LMFA01100054|metacyc.compound:3-AMINO-ISOBUTYRATE|pubmed:11785300|pubmed:14576092|pubmed:18299183|pubmed:18600547|pubmed:19186330|pubmed:19735301|pubmed:22735334|pubmed:2274753|pubmed:5776546|pubmed:639325|pubmed:8307374|reaxys:1720958|wikipedia.en:3-Aminoisobutyric_acid Graph 2-(aminomethyl)propionic acid|2-Methyl-beta-alanine|3-Amino-2-methylpropanoate|3-Aminoisobutanoate|3-Aminoisobutanoic acid|3-amino-2-methylpropanoic acid|3-aminoisobutyric acid|BAIB|DL-beta-aminoisobutyric acid|alpha-Methyl-beta-alanine|bAib|beta-aminoisobutyric acid 3-amino-2-methylpropanoic acid 2-(aminomethyl)propionic acid|2-Methyl-beta-alanine|3-Amino-2-methylpropanoate|3-Aminoisobutanoate|3-Aminoisobutanoic acid|3-amino-2-methylpropanoic acid|3-aminoisobutyric acid|BAIB|DL-beta-aminoisobutyric acid|alpha-Methyl-beta-alanine|bAib|beta-aminoisobutyric acid http://purl.obolibrary.org/obo/CHEBI_27389 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27390 biolink:ChemicalEntity omega-aminoaldehyde An amino aldehyde that is an aliphatic aldehyde in which one of the hydrogens of the terminal methyl group has been replaced by an amino group. H2NCH2(CH2)nCHO, where n = 0, 1, 2, etc. kegg.compound:C02903 Graph omega-aminoaldehyde|omega-aminoaldehydes omega-aminoaldehyde|omega-aminoaldehydes http://purl.obolibrary.org/obo/CHEBI_27390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27391 biolink:ChemicalEntity 1-pyrroline-3-hydroxy-5-carboxylic acid beilstein:121071|kegg.compound:C04281 Graph 4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid 4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid 4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_27391 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27393 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-5beta-cholest-24-enoyl-CoA kegg.compound:C05447 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27398 biolink:ChemicalEntity imidazole-4-acetaldehyde cas:645-14-7|kegg.compound:C05130 Graph 1H-Imidazole-4-acetaldehyde|1H-imidazol-4-ylacetaldehyde|Imidazole acetaldehyde|Imidazole-4-acetaldehyde|imidazole-4-acetaldehyde 1H-imidazol-4-ylacetaldehyde 1H-Imidazole-4-acetaldehyde|1H-imidazol-4-ylacetaldehyde|Imidazole acetaldehyde|Imidazole-4-acetaldehyde|imidazole-4-acetaldehyde http://purl.obolibrary.org/obo/CHEBI_27398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27402 biolink:ChemicalEntity (S)-3-hydroxypalmitoyl-CoA A long-chain (3S)-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxypalmitic acid. kegg.compound:C05258 Graph (S)-3-Hydroxyhexadecanoyl-CoA|(S)-3-hydroxyhexadecanoyl-coenzyme A|(S)-3-hydroxypalmitoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxyhexadecanoyl-CoA|(S)-3-hydroxyhexadecanoyl-coenzyme A|(S)-3-hydroxypalmitoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexadecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_27402 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27403 biolink:ChemicalEntity 3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α,24-trihydroxy-5β-cholestanoic acid and coenzyme A. kegg.compound:C05448 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27403 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27404 biolink:ChemicalEntity 5,6-dihydroxyindole cas:3131-52-0|drugbank:DB01811|kegg.compound:C05578 Graph 1H-indole-5,6-diol|5,6-Dihydroxyindole|5,6-dihydroxyindole|DHI|Dopamine lutine 1H-indole-5,6-diol 1H-indole-5,6-diol|5,6-Dihydroxyindole|5,6-dihydroxyindole|DHI|Dopamine lutine http://purl.obolibrary.org/obo/CHEBI_27404 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27405 biolink:ChemicalEntity streptidine An amino cyclitol that is scyllo-inositol in which the hydroxy groups at positions 1 and 3 are replaced by guanidino groups. cas:85-17-6|hmdb:HMDB0258506|kegg.compound:C00837|metacyc.compound:CPD-10148|pubmed:11642734|pubmed:15736038|pubmed:16956741|pubmed:17011831|pubmed:17609790|pubmed:6076630|reaxys:2816623 Graph 1,1'-(2,4,5,6-Tetrahydroxy-1,3-cyclohexylene)diguanidine|1,1'-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine|1,3-diguanidino-2,4,5,6-cyclohexanetetrol|N,N'''-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine|N,N'-bis(aminoiminomethyl)streptamine|N,N'-diamidinostreptamine|Streptamine, N,N'-bis(aminoiminomethyl)-|Streptidine|streptidin 1,1'-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine|N,N'''-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine 1,1'-(2,4,5,6-Tetrahydroxy-1,3-cyclohexylene)diguanidine|1,1'-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine|1,3-diguanidino-2,4,5,6-cyclohexanetetrol|N,N'''-[(1R,2s,3S,4R,5r,6S)-2,4,5,6-tetrahydroxycyclohexane-1,3-diyl]diguanidine|N,N'-bis(aminoiminomethyl)streptamine|N,N'-diamidinostreptamine|Streptamine, N,N'-bis(aminoiminomethyl)-|Streptidine|streptidin http://purl.obolibrary.org/obo/CHEBI_27405 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27412 biolink:ChemicalEntity gentamycin C1 cas:25876-10-2|kegg.compound:C07656 Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-beta-L-lyxo-heptopyranoside|Gentamicin C1|O-2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-alpha-D-ribo-heptopyranosyl-(1-4)-O-(3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6))-2-deoxy-D-streptamine (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-beta-L-lyxo-heptopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-beta-L-lyxo-heptopyranoside|Gentamicin C1|O-2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-alpha-D-ribo-heptopyranosyl-(1-4)-O-(3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6))-2-deoxy-D-streptamine http://purl.obolibrary.org/obo/CHEBI_27412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27417 biolink:ChemicalEntity p-xylene A xylene with methyl groups at positions 1 and 4. cas:106-42-3|drugbank:DB03463|gmelin:2697|hmdb:HMDB0059924|kegg.compound:C06756|metacyc.compound:CPD-1422|pdb-ccd:PXY|pubmed:23316419|pubmed:24028095|reaxys:1901563|umbbd.compound:c0083|wikipedia.en:P-Xylene Graph 1,4-Dimethylbenzene|1,4-Dimethylbenzol|1,4-xylene|4-methyltoluene|4-xylene|PARA-XYLENE|p-Methyltoluene|p-Xylene|p-Xylol|p-dimethylbenzene|p-xylene|para-xylene 1,4-xylene 1,4-Dimethylbenzene|1,4-Dimethylbenzol|1,4-xylene|4-methyltoluene|4-xylene|PARA-XYLENE|p-Methyltoluene|p-Xylene|p-Xylol|p-dimethylbenzene|p-xylene|para-xylene http://purl.obolibrary.org/obo/CHEBI_27417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27418 biolink:ChemicalEntity 1,4-naphthoquinone The parent structure of the family of 1,4-naphthoquinones, in which the oxo groups of the quinone moiety are at positions 1 and 4 of the naphthalene ring. Derivatives have pharmacological properties. cas:130-15-4|gmelin:240850|kegg.compound:C02617|pubmed:26684482|pubmed:28166217|reaxys:878524 Graph 1,4-NQ|1,4-Naphthalenedione|1,4-Naphthoquinone|1,4-dihydro-1,4-diketonaphthalene|[1,4]naphthoquinon|alpha-naphthoquinone|naphthalene-1,4-dione|naphthoquinone|p-naphthoquinone naphthalene-1,4-dione 1,4-NQ|1,4-Naphthalenedione|1,4-Naphthoquinone|1,4-dihydro-1,4-diketonaphthalene|[1,4]naphthoquinon|alpha-naphthoquinone|naphthalene-1,4-dione|naphthoquinone|p-naphthoquinone http://purl.obolibrary.org/obo/CHEBI_27418 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27425 biolink:ChemicalEntity N-acetyl-alpha-D-glucosaminide Any N-acetyl-D-glucosaminide having α-configuration at the anomeric centre. kegg.compound:C04019 Graph N-Acetyl-alpha-D-glucosaminide|N-acetyl-alpha-D-glucosaminides|an N-acetyl-alpha-D-glucosaminyl derivative N-Acetyl-alpha-D-glucosaminide|N-acetyl-alpha-D-glucosaminides|an N-acetyl-alpha-D-glucosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_27425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27428 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-5beta-cholestan-26-al kegg.compound:C05445 Graph 3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al|3alpha,7alpha-dihydroxy-5beta-cholestan-26-al 3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al|3alpha,7alpha-dihydroxy-5beta-cholestan-26-al 3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al|3alpha,7alpha-dihydroxy-5beta-cholestan-26-al http://purl.obolibrary.org/obo/CHEBI_27428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27432 biolink:ChemicalEntity alpha-linolenic acid A linolenic acid with cis-double bonds at positions 9, 12 and 15. Shown to have an antithrombotic effect. cas:463-40-1|drugbank:DB00132|drugcentral:4618|gmelin:57558|hmdb:HMDB0001388|kegg.compound:C06427|knapsack:C00007247|lipidmaps:LMFA01030152|metacyc.compound:LINOLENIC_ACID|pdb-ccd:LNL|pubmed:10232625|pubmed:11304127|pubmed:19269799|pubmed:24320056|pubmed:24639012|pubmed:24855655|reaxys:1727693|wikipedia.en:Alpha-Linolenic_acid Graph (9,12,15)-linolenic acid|(9Z,12Z,15Z)-Octadecatrienoic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid|(Z,Z,Z)-9,12,15-octadecatrienoic acid|9,12,15-Octadecatrienoic acid|9-cis,12-cis,15-cis-octadecatrienoic acid|ALA|ALPHA-LINOLENIC ACID|all-cis-9,12,15-octadecatrienoic acid|alpha-Linolenic acid|alpha-linolenic acid|cis,cis,cis-9,12,15-octadecatrienoic acid|cis-Delta(9,12,15)-octadecatrienoic acid|linolenic acid (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid (9,12,15)-linolenic acid|(9Z,12Z,15Z)-Octadecatrienoic acid|(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid|(Z,Z,Z)-9,12,15-octadecatrienoic acid|9,12,15-Octadecatrienoic acid|9-cis,12-cis,15-cis-octadecatrienoic acid|ALA|ALPHA-LINOLENIC ACID|all-cis-9,12,15-octadecatrienoic acid|alpha-Linolenic acid|alpha-linolenic acid|cis,cis,cis-9,12,15-octadecatrienoic acid|cis-Delta(9,12,15)-octadecatrienoic acid|linolenic acid http://purl.obolibrary.org/obo/CHEBI_27432 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27436 biolink:ChemicalEntity methyltestosterone A 17β-hydroxy steroid that is testosterone bearing a methyl group at the 17α position. cas:58-18-4|drugbank:DB06710|drugcentral:3356|kegg.compound:C07198|kegg.drug:D00408|patent:US2374369|patent:US2374370|patent:US2384355|patent:US2386331|patent:US2435013|pubmed:19199316|reaxys:2057425 Graph (17beta)-17-hydroxy-17-methylandrost-4-en-3-one|17(alpha)-methyl-Delta(4)-androsten-17(beta)-ol-3-one|17-beta-hydroxy-17-methylandrost-4-en-3-one|17-methyltestosterone|17alpha-methyl-3-oxo-4-androsten-17beta-ol|17alpha-methyl-Delta(4)-androsten-17beta-ol-3-one|17alpha-methyltestosterone|17beta-hydroxy-17-methylandrost-4-en-3-one|4-androstene-17alpha-methyl-17beta-ol-3-one|Android|Methyltestosterone|NSC-9701|Testred|Virilon|methyltestosterone|methyltestosteronum|metiltestosterona (17beta)-17-hydroxy-17-methylandrost-4-en-3-one (17beta)-17-hydroxy-17-methylandrost-4-en-3-one|17(alpha)-methyl-Delta(4)-androsten-17(beta)-ol-3-one|17-beta-hydroxy-17-methylandrost-4-en-3-one|17-methyltestosterone|17alpha-methyl-3-oxo-4-androsten-17beta-ol|17alpha-methyl-Delta(4)-androsten-17beta-ol-3-one|17alpha-methyltestosterone|17beta-hydroxy-17-methylandrost-4-en-3-one|4-androstene-17alpha-methyl-17beta-ol-3-one|Android|Methyltestosterone|NSC-9701|Testred|Virilon|methyltestosterone|methyltestosteronum|metiltestosterona http://purl.obolibrary.org/obo/CHEBI_27436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27438 biolink:ChemicalEntity N-acetylneuraminic acid 9-phosphate kegg.compound:C06241 Graph 5-acetamido-3,5-dideoxy-9-phosphono-D-galacto-non-2-ulopyranosonic acid|5-acetamido-3,5-dideoxy-9-phosphono-D-glycero-D-galacto-2-nonulosonic acid|N-Acetylneuraminate 9-phosphate 5-acetamido-3,5-dideoxy-9-phosphono-D-galacto-non-2-ulopyranosonic acid|5-acetamido-3,5-dideoxy-9-phosphono-D-glycero-D-galacto-2-nonulosonic acid 5-acetamido-3,5-dideoxy-9-phosphono-D-galacto-non-2-ulopyranosonic acid|5-acetamido-3,5-dideoxy-9-phosphono-D-glycero-D-galacto-2-nonulosonic acid|N-Acetylneuraminate 9-phosphate http://purl.obolibrary.org/obo/CHEBI_27438 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27442 biolink:ChemicalEntity beta-D-fucose A D-fucopyranose with a β-configuration at the anomeric position. drugbank:DB04062|glytoucan:G82562YG|hmdb:HMDB0003081|kegg.compound:C02095|metacyc.compound:CPD-13293|pdb-ccd:FCB|pubmed:6812077|reaxys:1617037 Graph 6-deoxy-beta-D-galactopyranose|BETA-D-FUCOSE|beta-D-Fuc|beta-D-Fucose|beta-D-fucopyranose 6-deoxy-beta-D-galactopyranose|beta-D-fucopyranose 6-deoxy-beta-D-galactopyranose|BETA-D-FUCOSE|beta-D-Fuc|beta-D-Fucose|beta-D-fucopyranose http://purl.obolibrary.org/obo/CHEBI_27442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27445 biolink:ChemicalEntity maltohexaose A maltohexaose hexasaccharide in which the glucose residue at the reducing end is in the aldehydo open-chain form. cas:34620-77-4|kegg.compound:C01936|kegg.glycan:G00755 Graph Maltohexaose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glc|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose Maltohexaose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glc|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose http://purl.obolibrary.org/obo/CHEBI_27445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27446 biolink:ChemicalEntity phenoxymethylpenicillin A penicillin compound having a 6β-(phenoxyacetyl)amino side-chain. cas:87-08-1|drugbank:DB00417|drugcentral:2083|kegg.compound:C08126|kegg.drug:D05411|pdb-ccd:PNV|pubmed:10930630|pubmed:12569987|pubmed:13377278|pubmed:14687482|pubmed:16033609|pubmed:19357666|pubmed:19496253|pubmed:21148688|pubmed:22763423|pubmed:23732051|pubmed:26986755|pubmed:27731424|pubmed:8566082|reaxys:96259|wikipedia.en:Phenoxymethylpenicillin Graph (2S,5R,6R)-3,3-DIMETHYL-7-OXO-6-(2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID|(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|2,2-dimethyl-6beta-[(phenoxyacetyl)amino]penam-3alpha-carboxylic acid|3,3-dimethyl-6beta-[(phenoxyacetyl)amino]penam-2alpha-carboxylic acid (PIN)|6-phenoxyacetamidopenicillanic acid|Fenospen|Oracillin|PV|Penicillin V|V-Cillin|fenoximetilpenicilina|penicillin phenoxymethyl|phenoxomethylpenicillin|phenoxymethylenepenicillinic acid|phenoxymethylpenicillin|phenoxymethylpenicilline|phenoxymethylpenicillinum 2,2-dimethyl-6beta-[(phenoxyacetyl)amino]penam-3alpha-carboxylic acid|3,3-dimethyl-6beta-[(phenoxyacetyl)amino]penam-2alpha-carboxylic acid (PIN) (2S,5R,6R)-3,3-DIMETHYL-7-OXO-6-(2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID|(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|2,2-dimethyl-6beta-[(phenoxyacetyl)amino]penam-3alpha-carboxylic acid|3,3-dimethyl-6beta-[(phenoxyacetyl)amino]penam-2alpha-carboxylic acid (PIN)|6-phenoxyacetamidopenicillanic acid|Fenospen|Oracillin|PV|Penicillin V|V-Cillin|fenoximetilpenicilina|penicillin phenoxymethyl|phenoxomethylpenicillin|phenoxymethylenepenicillinic acid|phenoxymethylpenicillin|phenoxymethylpenicilline|phenoxymethylpenicillinum http://purl.obolibrary.org/obo/CHEBI_27446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27450 biolink:ChemicalEntity 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonic acid beilstein:10297030|kegg.compound:C06118|kegg.glycan:G10587|pdb-ccd:UNF Graph 4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate|4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate|4-(4-deoxy-alpha-D-galact-4-enosyluronic acid)-D-galacturonic acid|4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid|Unsaturated digalacturonate 4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid 4-(4-Deoxy-alpha-D-galact-4-enuronosyl)-D-galacturonate|4-(4-Deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate|4-(4-deoxy-alpha-D-galact-4-enosyluronic acid)-D-galacturonic acid|4-O-(4-deoxy-beta-L-threo-hex-4-enopyranosyluronic acid)-D-galactopyranuronic acid|Unsaturated digalacturonate http://purl.obolibrary.org/obo/CHEBI_27450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27452 biolink:ChemicalEntity styrene A vinylarene that is benzene carrying a vinyl group. It has been isolated from the benzoin resin produced by Styrax species. cas:100-42-5|gmelin:2991|hmdb:HMDB0034240|kegg.compound:C07083|metacyc.compound:CPD-1092|pubmed:11934013|pubmed:24320693|reaxys:1071236|umbbd.compound:c0115|wikipedia.en:Styrene Graph Phenylethylene|Styren|Styrene|Styrol|ethenylbenzene|phenylethene|styrene|vinylbenzene Styrene|styrene Phenylethylene|Styren|Styrene|Styrol|ethenylbenzene|phenylethene|styrene|vinylbenzene http://purl.obolibrary.org/obo/CHEBI_27452 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27455 biolink:ChemicalEntity trichloroacetate A monocarboxylic acid anion that results from the removal of a proton from the carboxylic acid group of trichloroacetic acid. cas:14357-05-2|gmelin:200855|metacyc.compound:CPD-9675|reaxys:3588433|umbbd.compound:c0016 Graph 2,2,2-trichloroacetate|trichloroacetate|trichloroacetate anion|trichloroacetate(1-)|trichloroacetic acid, ion(1-) trichloroacetate 2,2,2-trichloroacetate|trichloroacetate|trichloroacetate anion|trichloroacetate(1-)|trichloroacetic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_27455 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27458 biolink:ChemicalEntity 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α,12α,24-tetrahydroxy-5β-cholestan-26-oic acid and coenzyme A. kegg.compound:C05450 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-coenzyme A|3alpha,7alpha,12alpha,24zeta-Tetrahydroxy-5beta-cholestanoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA|3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-coenzyme A|3alpha,7alpha,12alpha,24zeta-Tetrahydroxy-5beta-cholestanoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27458 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27459 biolink:ChemicalEntity N-glycoloyl-D-glucosamine An N-glycoloylglucosamine of D configuration. kegg.compound:C03146 Graph 2-deoxy-2-glycoloylamino-D-glucopyranose|2-deoxy-2-glycoloylamino-D-glucose|N-Glycolyl-D-glucosamine|N-glycoloyl-D-glucosamine 2-deoxy-2-glycoloylamino-D-glucopyranose|2-deoxy-2-glycoloylamino-D-glucose 2-deoxy-2-glycoloylamino-D-glucopyranose|2-deoxy-2-glycoloylamino-D-glucose|N-Glycolyl-D-glucosamine|N-glycoloyl-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_27459 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27466 biolink:ChemicalEntity (S)-3-hydroxytetradecanoyl-CoA A long-chain (3S)-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxytetradecanoic acid. kegg.compound:C05260 Graph (S)-3-Hydroxytetradecanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxytetradecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxytetradecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxytetradecanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxytetradecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_27466 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27468 biolink:ChemicalEntity 5,6-dihydrothymine A pyrimidone obtained by formal addition of hydrogen across the 5,6-position of thymine. cas:696-04-8|kegg.compound:C00906|pubmed:12798197|pubmed:20509700|pubmed:2669952|reaxys:81983 Graph 5,6-Dihydro-5-methyluracil|5,6-Dihydrothymine|5,6-dihydrothymine|5-Methyl-5,6-dihydrouracil|5-methyldihydropyrimidine-2,4(1H,3H)-dione|Dihydrothymine 5,6-Dihydrothymine|5,6-dihydrothymine|5-methyldihydropyrimidine-2,4(1H,3H)-dione 5,6-Dihydro-5-methyluracil|5,6-Dihydrothymine|5,6-dihydrothymine|5-Methyl-5,6-dihydrouracil|5-methyldihydropyrimidine-2,4(1H,3H)-dione|Dihydrothymine http://purl.obolibrary.org/obo/CHEBI_27468 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27469 biolink:ChemicalEntity 2-dehydro-D-gluconic acid A ketoaldonic acid that is D-gluconic acid in which the hydroxy group at position 2 has been oxidised to a keto group. cas:669-90-9|kegg.compound:C06473|pubmed:1106345|pubmed:14325279|pubmed:24572278|reaxys:1726797 Graph 2-Dehydro-D-gluconate|2-Dehydro-D-gluconic acid|2-Keto-D-gluconic acid|2-Oxogluconic acid|2-ketogluconic acid|D-arabino-hex-2-ulosonic acid D-arabino-hex-2-ulosonic acid 2-Dehydro-D-gluconate|2-Dehydro-D-gluconic acid|2-Keto-D-gluconic acid|2-Oxogluconic acid|2-ketogluconic acid|D-arabino-hex-2-ulosonic acid http://purl.obolibrary.org/obo/CHEBI_27469 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27470 biolink:ChemicalEntity folic acid An N-acyl-amino acid that is a form of the water-soluble vitamin B9. Its biologically active forms (tetrahydrofolate and others) are essential for nucleotide biosynthesis and homocysteine remethylation. agr:IND606960789|cas:59-30-3|chemspider:5815|drugbank:DB00158|drugcentral:1231|foodb.food:FDB014504|hmdb:HMDB0000121|kegg.compound:C00504|kegg.drug:D00070|knapsack:C00001539|lincs.smallmolecule:LSM-5355|metacyc.compound:CPD-12826|pdb-ccd:FOL|pubmed:10138938|pubmed:10897644|pubmed:10958818|pubmed:11261364|pubmed:11451208|pubmed:11959400|pubmed:14387833|pubmed:15321809|pubmed:15523939|pubmed:15754725|pubmed:15797531|pubmed:15797685|pubmed:15831910|pubmed:15990733|pubmed:16093404|pubmed:16277678|pubmed:16380297|pubmed:16871332|pubmed:17784727|pubmed:18788725|pubmed:19121630|pubmed:19335717|pubmed:19355913|pubmed:24650098|pubmed:33624660|pubmed:33965562|pubmed:33968971|pubmed:34207319|pubmed:34219855|pubmed:7738698|pubmed:8235383|pubmed:9040515|pubmed:9420019|pubmed:9565830|pubmed:9683174|pubmed:9781393|pubmed:9808640|pubmed:9808641|reaxys:100781|wikipedia.en:Folic_Acid Graph (2S)-2-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzamido)pentanedioic acid|Acfol|Folate|Folicet|Folsaeure|N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-[(4-{[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}phenyl)carbonyl]-L-glutamic acid|N-pteroyl-L-glutamic acid|PGA|PteGlu|acide folique|acido folico|acidum folicum|folic acid|pteroyl-L-glutamic acid|pteroyl-L-monoglutamic acid|pteroylglutamic acid|pteroylmonoglutamic acid|vitamin B11|vitamin B9|vitamin Bc|vitamin Be|vitamin M N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid (2S)-2-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzamido)pentanedioic acid|Acfol|Folate|Folicet|Folsaeure|N-(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-L-glutamic acid|N-[(4-{[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}phenyl)carbonyl]-L-glutamic acid|N-pteroyl-L-glutamic acid|PGA|PteGlu|acide folique|acido folico|acidum folicum|folic acid|pteroyl-L-glutamic acid|pteroyl-L-monoglutamic acid|pteroylglutamic acid|pteroylmonoglutamic acid|vitamin B11|vitamin B9|vitamin Bc|vitamin Be|vitamin M http://purl.obolibrary.org/obo/CHEBI_27470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27475 biolink:ChemicalEntity cyanidin 3-O-beta-D-galactoside An anthocyanin cation that is cyanidin(1+) carrying a single β-D-galactosyl substituent at position 3. kegg.compound:C08647|knapsack:C00006652|pubmed:19351112|pubmed:21302942|pubmed:22739086|pubmed:23215441|reaxys:3920159 Graph 3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium|Cyanidin 3-O-galactoside 3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium 3-(beta-D-galactopyranosyloxy)-3',4',5,7-tetrahydroxyflavylium|Cyanidin 3-O-galactoside http://purl.obolibrary.org/obo/CHEBI_27475 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27477 biolink:ChemicalEntity D-valine The D-enantiomer of valine. cas:640-68-6|gmelin:82413|kegg.compound:C06417|metacyc.compound:CPD-3642|pdb-ccd:DVA|pubmed:13465080|pubmed:23085840|pubmed:236834|pubmed:7118128|reaxys:1721135 Graph (2R)-2-amino-3-methylbutanoic acid|(R)-2-Amino-3-methylbutyric acid|(R)-valine|D-Valin|D-Valine|D-valine|DVA D-Valine|D-valine (2R)-2-amino-3-methylbutanoic acid|(R)-2-Amino-3-methylbutyric acid|(R)-valine|D-Valin|D-Valine|D-valine|DVA http://purl.obolibrary.org/obo/CHEBI_27477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27479 biolink:ChemicalEntity 2'-hydroxydaidzein A hydroxyisoflavone that is daidzein bearing an additional hydroxy substituent at position 2'. cas:7678-85-5|hmdb:HMDB0029372|kegg.compound:C02495|knapsack:C00009383|lipidmaps:LMPK12050083|metacyc.compound:2-HYDROXYDAIDZEIN|pubmed:15013012|pubmed:2306102|pubmed:9790908|reaxys:1256280 Graph 2',4',7-trihydroxyisoflavone|2'-Hydroxydaidzein|3-(2,4-dihydroxyphenyl)-7-hydroxy-4H-1-benzopyran-4-one|3-(2,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one|4H-1-benzopyran-4-one, 3-(2,4-dihydroxyphenyl)-7-hydroxy- 3-(2,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one 2',4',7-trihydroxyisoflavone|2'-Hydroxydaidzein|3-(2,4-dihydroxyphenyl)-7-hydroxy-4H-1-benzopyran-4-one|3-(2,4-dihydroxyphenyl)-7-hydroxy-4H-chromen-4-one|4H-1-benzopyran-4-one, 3-(2,4-dihydroxyphenyl)-7-hydroxy- http://purl.obolibrary.org/obo/CHEBI_27479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27480 biolink:ChemicalEntity phenylacetylglycine A N-acylglycine that is glycine substituted on nitrogen with a phenylacetyl group. cas:500-98-1|hmdb:HMDB0000821|kegg.compound:C05598|metacyc.compound:CPD-11715|pubmed:15764292|pubmed:19961175|pubmed:21167146|pubmed:22770225|pubmed:22935565|reaxys:1107116 Graph N-(phenylacetyl)glycine|N-Phenacetylglycine|N-Phenylacetylglycine|Phenaceturic acid|Phenacetylglycine|Phenylacetylglycine N-(phenylacetyl)glycine N-(phenylacetyl)glycine|N-Phenacetylglycine|N-Phenylacetylglycine|Phenaceturic acid|Phenacetylglycine|Phenylacetylglycine http://purl.obolibrary.org/obo/CHEBI_27480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27482 biolink:ChemicalEntity (R)-coclaurine beilstein:1546873|cas:2196-60-3|kegg.compound:C06349|knapsack:C00025652|knapsack:C00027647 Graph (+)-Coclaurine|(1R)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol|(R)-Coclaurine|6-Methoxy-7-hydroxy-(1R)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Machiline|d-Coclaurine (1R)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol (+)-Coclaurine|(1R)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol|(R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol|(R)-Coclaurine|6-Methoxy-7-hydroxy-(1R)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline|Machiline|d-Coclaurine http://purl.obolibrary.org/obo/CHEBI_27482 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27485 biolink:ChemicalEntity prostaglandin J2 A member of the class of prostaglandins J that consists of prosta-5,9,13-trien-1-oic acid substituted by an oxo group at position 11 and a hydroxy group at position 15 (the 5Z,13E,15S stereoisomer). cas:60203-57-8|hmdb:HMDB0002710|kegg.compound:C05957|lipidmaps:LMFA03010019|pubmed:12213491|reaxys:8353080 Graph (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oic acid|9-Deoxy-delta-9-pgd2|9-Deoxy-delta-9-prostaglandin D2|PGJ2|Prostaglandin J2 (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oic acid (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oic acid|9-Deoxy-delta-9-pgd2|9-Deoxy-delta-9-prostaglandin D2|PGJ2|Prostaglandin J2 http://purl.obolibrary.org/obo/CHEBI_27485 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27493 biolink:ChemicalEntity juvenile hormone III A member of the juvenile hormone family of compounds that is the methyl ester of (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoic acid. Juvenile hormone III is found in most insect species. cas:22963-93-5|kegg.compound:C09694|knapsack:C00003157|lipidmaps:LMPR0103010004|metacyc.compound:CPD-8838|pdb-ccd:JH3|pubmed:22664054|pubmed:23034815|pubmed:23121109|pubmed:24657668|reaxys:4453965 Graph (+)-Juvenile hormone III|(10R)-Juvenile hormone III|JH III|Juvenile hormone 3|Methyl (2E,6E)-(10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate|Methyl (R-(E,E))-9-(3,3-dimethyloxiranyl)-3,7-dimethyl-2,6-nonadienoate|Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-(10R)-2,6-dodecadienoate|Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-2,6-dodecadienoate|Methyl R-(+)-10,11-epoxyfarnesate|juvenile hormone III|methyl (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate methyl (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate (+)-Juvenile hormone III|(10R)-Juvenile hormone III|JH III|Juvenile hormone 3|Methyl (2E,6E)-(10R)-10,11-epoxy-3,7,11-trimethyl-2,6-dodecadienoate|Methyl (R-(E,E))-9-(3,3-dimethyloxiranyl)-3,7-dimethyl-2,6-nonadienoate|Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-(10R)-2,6-dodecadienoate|Methyl 10,11-epoxy-3,7,11-trimethyl-trans,trans-2,6-dodecadienoate|Methyl R-(+)-10,11-epoxyfarnesate|juvenile hormone III|methyl (2E,6E)-9-[(2R)-3,3-dimethyloxiran-2-yl]-3,7-dimethylnona-2,6-dienoate http://purl.obolibrary.org/obo/CHEBI_27493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27503 biolink:ChemicalEntity aldehydo-D-mannosamine A D-mannosamine in open-chain aldehydo-form. cas:14307-02-9|cas:2636-92-2|pubmed:12596851|pubmed:16076127|pubmed:19309147|pubmed:20096904|reaxys:1724601 Graph 2-Amino-2-deoxy-D-mannose|2-amino-2-deoxy-D-mannose|2-amino-2-deoxymannose|D-(+)-Mannosamine|D-ManN|D-Mannosamine|Manosamine 2-Amino-2-deoxy-D-mannose|2-amino-2-deoxy-D-mannose 2-Amino-2-deoxy-D-mannose|2-amino-2-deoxy-D-mannose|2-amino-2-deoxymannose|D-(+)-Mannosamine|D-ManN|D-Mannosamine|Manosamine http://purl.obolibrary.org/obo/CHEBI_27503 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27504 biolink:ChemicalEntity mitomycin C beilstein:3570056|cas:50-07-7|drugbank:DB00305|drugcentral:1819|kegg.compound:C06681|kegg.drug:D00208|knapsack:C00018668|lincs.smallmolecule:LSM-6310|pubmed:36194168|pubmed:36453313|pubmed:36473690|wikipedia.en:Mitomycin Graph 7-Amino-9alpha-methoxymitosane|Ametycine|MMC|Mitocin-C|Mitomycin|Mitomycin C|Mutamycin|[(1aS,8S,8aR,8bS)-6-amino-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate [(1aS,8S,8aR,8bS)-6-amino-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate 7-Amino-9alpha-methoxymitosane|Ametycine|MMC|Mitocin-C|Mitomycin|Mitomycin C|Mutamycin|[(1aS,8S,8aR,8bS)-6-amino-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate http://purl.obolibrary.org/obo/CHEBI_27504 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27505 biolink:ChemicalEntity 3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA A steroidal acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3α,7α,12α-trihydroxy-5β-cholest-24-en-26-oic acid. kegg.compound:C05460 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27505 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27510 biolink:ChemicalEntity umbelliferone A hydroxycoumarin that is coumarin substituted by a hydroxy group ay position 7. beilstein:127683|cas:93-35-6|gmelin:1220112|kegg.compound:C09315|knapsack:C00002503|lincs.smallmolecule:LSM-3960 Graph 7-Hydroxycoumarin|7-hydroxy-2H-1-benzopyran-2-one|7-hydroxy-2H-chromen-2-one|Umbelliferone|beta-umbelliferone|hydrangin|skimmetin|umbelliferone 7-hydroxy-2H-chromen-2-one 7-Hydroxycoumarin|7-hydroxy-2H-1-benzopyran-2-one|7-hydroxy-2H-chromen-2-one|Umbelliferone|beta-umbelliferone|hydrangin|skimmetin|umbelliferone http://purl.obolibrary.org/obo/CHEBI_27510 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27513 biolink:ChemicalEntity precorrin-6X The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which six methyl groups have been introduced into the tetrapyrrole framework, together with ring contraction. beilstein:4901842|kegg.compound:C06320 Graph 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 6A|Precorrin 6X 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 6A|Precorrin 6X http://purl.obolibrary.org/obo/CHEBI_27513 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27514 biolink:ChemicalEntity genistein 7-O-beta-D-glucoside cas:529-59-9|foodb.food:FDB012221|hmdb:HMDB0033988|kegg.compound:C09126|knapsack:C00002528|lipidmaps:LMPK12050166|metacyc.compound:CPD-3421|pubmed:23435915|pubmed:27087823|pubmed:30049985|pubmed:31720546|pubmed:32253713|pubmed:32349444|pubmed:33075375|pubmed:36336175|pubmed:36746262|pubmed:36903488|pubmed:38409838|pubmed:38617546|pubmed:39444613|pubmed:39641093|wikipedia.en:Genistin Graph 4',5,7-trihydroxyisoflavone 7-D-glucoside|5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|Genistein 7-O-beta-D-glucoside|Genistein 7-glucoside|Genisteol 7-monoglucoside|Genistin|Genistine|Genistoside 5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside 4',5,7-trihydroxyisoflavone 7-D-glucoside|5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|Genistein 7-O-beta-D-glucoside|Genistein 7-glucoside|Genisteol 7-monoglucoside|Genistin|Genistine|Genistoside http://purl.obolibrary.org/obo/CHEBI_27514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27515 biolink:ChemicalEntity alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-D-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer kegg.compound:C06139|kegg.glycan:G00117|lipidmaps:LMSP0601AV00|pubmed:1371229|pubmed:1514781|pubmed:1567198|pubmed:16341241|pubmed:1724444|pubmed:17855742|pubmed:19726417|pubmed:20478781|pubmed:2303428|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:27485170|pubmed:28416698|pubmed:7534889|pubmed:7693874 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)4 (Cer)1|GQ1|GQ1b|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|Neu5Acalpha2-8Neu5Acalpha2-3Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-8Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1'Cer|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->3GalNAcbeta1->4(Neu5Acalpha2->8Neu5Acalpha2->3)Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|ganglioside GQ1b|tetrasialoganglioside GQ1b (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)4 (Cer)1|GQ1|GQ1b|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|Neu5Acalpha2-8Neu5Acalpha2-3Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-8Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1'Cer|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->3GalNAcbeta1->4(Neu5Acalpha2->8Neu5Acalpha2->3)Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|ganglioside GQ1b|tetrasialoganglioside GQ1b http://purl.obolibrary.org/obo/CHEBI_27515 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27517 biolink:ChemicalEntity (1->2)-beta-D-glucan kegg.compound:C02490 Graph (1,2-beta-D-glucosyl)(n)|(1->2)-beta-D-glucopyranan|1,2-beta-D-Glucan (1->2)-beta-D-glucopyranan (1,2-beta-D-glucosyl)(n)|(1->2)-beta-D-glucopyranan|1,2-beta-D-Glucan http://purl.obolibrary.org/obo/CHEBI_27517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27518 biolink:ChemicalEntity acetylene beilstein:906677|cas:74-86-2|gmelin:210|kegg.compound:C01548|molbase:936|umbbd.compound:c0526 Graph Acetylen|Acetylene|Azetylen|C2H2|CH#CH|Ethin|Ethyne|HC#CH|HCCH|Narcylen|[CH(CH)]|acetylene|ethyne|vinylene Acetylene|Ethyne|acetylene|ethyne Acetylen|Acetylene|Azetylen|C2H2|CH#CH|Ethin|Ethyne|HC#CH|HCCH|Narcylen|[CH(CH)]|acetylene|ethyne|vinylene http://purl.obolibrary.org/obo/CHEBI_27518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27530 biolink:ChemicalEntity 4-hydroxy-2-oxohexanoic acid A hydroxy- and oxo- fatty acid comprising hexanoic acid substituted at C-2 and C-4 with oxo and hydroxy groups respectively. kegg.compound:C06762|lipidmaps:LMFA01050343|reaxys:2637006 Graph 2-Oxo-4-hydroxycapronsaeure|4-Hydroxy-2-oxohexanoate|4-Hydroxy-2-oxohexanoic acid|4-hydroxy-2-oxocaproic acid|4-hydroxy-2-oxohexanoic acid 4-Hydroxy-2-oxohexanoic acid|4-hydroxy-2-oxohexanoic acid 2-Oxo-4-hydroxycapronsaeure|4-Hydroxy-2-oxohexanoate|4-Hydroxy-2-oxohexanoic acid|4-hydroxy-2-oxocaproic acid|4-hydroxy-2-oxohexanoic acid http://purl.obolibrary.org/obo/CHEBI_27530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27532 biolink:ChemicalEntity L-cysteine thioether Any L-cysteine derivative obtained by conversion of the thiol group into a sulfide. Graph L-cysteine thioethers|cysteine thioether L-cysteine thioethers|cysteine thioether http://purl.obolibrary.org/obo/CHEBI_27532 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27533 biolink:ChemicalEntity beta-zeacarotene beilstein:2571810|kegg.compound:C05434|knapsack:C00022807|lipidmaps:LMPR01070259 Graph 7',8'-dihydro-beta,psi-carotene|beta-Zeacarotene|beta-zeacarotene 7',8'-dihydro-beta,psi-carotene 7',8'-dihydro-beta,psi-carotene|beta-Zeacarotene|beta-zeacarotene http://purl.obolibrary.org/obo/CHEBI_27533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27535 biolink:ChemicalEntity alpha-D-mannoside Any mannoside in which the anomeric centre has α-configuration. kegg.compound:C02603 Graph alpha-D-Mannoside|alpha-D-mannopyranoside|alpha-D-mannopyranosides|alpha-D-mannose derivative|alpha-D-mannosides alpha-D-Mannoside|alpha-D-mannopyranoside|alpha-D-mannopyranosides|alpha-D-mannose derivative|alpha-D-mannosides http://purl.obolibrary.org/obo/CHEBI_27535 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27537 biolink:ChemicalEntity trans-oct-2-enoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-oct-2-enoic acid. hmdb:HMDB0003949|kegg.compound:C05276|lipidmaps:LMFA07050024|metacyc.compound:CPD0-2108|pubmed:16046200|reaxys:11165742 Graph (2E)-Octenoyl-CoA|(2E)-octenoyl-coenzyme A|2,3-trans-octenoyl coenzyme A|2E-octenoyl-CoA|2E-octenoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-oct-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|oct-2-trans-enoyl-CoA|oct-trans-2-enoyl-CoA|trans-2-octenoyl-coenzyme A|trans-Oct-2-enoyl-CoA|trans-oct-2-enoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-oct-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate} (2E)-Octenoyl-CoA|(2E)-octenoyl-coenzyme A|2,3-trans-octenoyl coenzyme A|2E-octenoyl-CoA|2E-octenoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-oct-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}|oct-2-trans-enoyl-CoA|oct-trans-2-enoyl-CoA|trans-2-octenoyl-coenzyme A|trans-Oct-2-enoyl-CoA|trans-oct-2-enoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27539 biolink:ChemicalEntity isatin An indoledione that is the 2,3-diketo derivative of indole. cas:91-56-5|drugbank:DB02095|gmelin:165206|kegg.compound:C11129|knapsack:C00026981|metacyc.compound:ISATIN|pdb-ccd:ISN|pubmed:15876476|pubmed:16236622|pubmed:1650428|pubmed:17330218|pubmed:17447419|pubmed:19834914|pubmed:23744416|pubmed:26846278|pubmed:9510091|reaxys:383659|wikipedia.en:Isatin Graph 1H-indole-2,3-dione|ISATIN|Isatin|indole-2,3-dione|isatin 1H-indole-2,3-dione 1H-indole-2,3-dione|ISATIN|Isatin|indole-2,3-dione|isatin http://purl.obolibrary.org/obo/CHEBI_27539 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27540 biolink:ChemicalEntity hexanoyl-CoA A medium-chain fatty acyl-CoA having hexanoyl as the S-acyl group. cas:5060-32-2|drugbank:DB02563|hmdb:HMDB0002845|kegg.compound:C05270|pdb-ccd:HXC|pubmed:18215412|pubmed:19391105|pubmed:19501572|pubmed:19581347|pubmed:7370014|pubmed:7988059|reaxys:78347 Graph 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(hexanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Coenzyme A, S-hexanoate|Hexanoyl-CoA|Hexanoyl-coenzyme A|S-Hexanoyl-coenzym-A|S-hexanoyl-CoA|S-hexanoyl-coenzyme-A|caproyl-CoA|caproyl-coenzyme A|hexanoyl-CoA|n-hexanoyl-CoA|n-hexanoyl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(hexanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-4-[(3-{[2-(hexanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|Coenzyme A, S-hexanoate|Hexanoyl-CoA|Hexanoyl-coenzyme A|S-Hexanoyl-coenzym-A|S-hexanoyl-CoA|S-hexanoyl-coenzyme-A|caproyl-CoA|caproyl-coenzyme A|hexanoyl-CoA|n-hexanoyl-CoA|n-hexanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27541 biolink:ChemicalEntity 3',5'-cyclic IMP A 3',5'-cyclic purine nucleotide having hypoxanthine as the nucleobase. cas:3545-76-4|kegg.compound:C00943|pubmed:24605759|pubmed:24906916|reaxys:629329 Graph 3',5'-Cyclic IMP|Inosine 3',5'-cyclic monophosphate|cyclic IMP|inosine 3',5'-(hydrogen phosphate)|inosine cyclic 3',5'-(hydrogen phosphate) inosine 3',5'-(hydrogen phosphate) 3',5'-Cyclic IMP|Inosine 3',5'-cyclic monophosphate|cyclic IMP|inosine 3',5'-(hydrogen phosphate)|inosine cyclic 3',5'-(hydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_27541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27544 biolink:ChemicalEntity 3,5-dibromo-4-hydroxybenzoate cas:3337-62-0|umbbd.compound:c0509 Graph 3,5-dibromo-4-hydroxybenzoate 3,5-dibromo-4-hydroxybenzoate 3,5-dibromo-4-hydroxybenzoate http://purl.obolibrary.org/obo/CHEBI_27544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27545 biolink:ChemicalEntity 2,5-dichlorohydroquinone A dichlorohydroquinone that is hydroquinone substituted by chloro groups at positions 2 and 5 respectively. cas:824-69-1|kegg.compound:C06600|pubmed:11872169|pubmed:17578411|reaxys:2045064 Graph 2,5-Dichloro-1,4-benzenediol|2,5-Dichloro-1,4-hydroquinone|2,5-Dichloro-p-benzohydroquinone|2,5-Dichloro-p-hydroquinone|2,5-dichlorobenzene-1,4-diol|2,5-dichlorohydroquinone 2,5-dichlorobenzene-1,4-diol 2,5-Dichloro-1,4-benzenediol|2,5-Dichloro-1,4-hydroquinone|2,5-Dichloro-p-benzohydroquinone|2,5-Dichloro-p-hydroquinone|2,5-dichlorobenzene-1,4-diol|2,5-dichlorohydroquinone http://purl.obolibrary.org/obo/CHEBI_27545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27547 biolink:ChemicalEntity zeaxanthin beilstein:2068416|cas:144-68-3|kegg.compound:C06098|knapsack:C00000931|lipidmaps:LMPR01070261|metacyc.compound:CPD1F-130|wikipedia.en:Zeaxanthin Graph (3R,3'R)-beta,beta-carotene-3,3'-diol|(3R,3'R)-dihydroxy-beta,beta-carotene|Zeaxanthin|all-trans-beta-carotene-3,3'-diol|all-trans-zeaxanthin|anchovyxanthin|beta,beta-carotene-3,3'-diol (3R,3'R)-beta,beta-carotene-3,3'-diol (3R,3'R)-beta,beta-carotene-3,3'-diol|(3R,3'R)-dihydroxy-beta,beta-carotene|Zeaxanthin|all-trans-beta-carotene-3,3'-diol|all-trans-zeaxanthin|anchovyxanthin|beta,beta-carotene-3,3'-diol http://purl.obolibrary.org/obo/CHEBI_27547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27551 biolink:ChemicalEntity 5-methylcytosine A pyrimidine that is a derivative of cytosine, having a methyl group at the 5-position. beilstein:120387|cas:554-01-8|kegg.compound:C02376|metacyc.compound:CPD0-2018|pubmed:17325422|pubmed:22770225|pubmed:25304211|pubmed:25421665|pubmed:25510268|pubmed:25510270|pubmed:25522353|pubmed:25620416|pubmed:25675106|reaxys:508871|wikipedia.en:5-Methylcytosine Graph 4-Amino-5-methyl-2-pyrimidinol|4-amino-5-methyl-2(1H)-pyrimidinone|4-amino-5-methylpyrimidin-2(1H)-one|5-Methylcytosine|5-methylcytosine 4-amino-5-methylpyrimidin-2(1H)-one 4-Amino-5-methyl-2-pyrimidinol|4-amino-5-methyl-2(1H)-pyrimidinone|4-amino-5-methylpyrimidin-2(1H)-one|5-Methylcytosine|5-methylcytosine http://purl.obolibrary.org/obo/CHEBI_27551 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27552 biolink:ChemicalEntity 4'-methoxy-5,7-dihydroxyflavanone A dihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5 and 7 and a methoxy group at position 4' (the 2S stereoisomer). cas:480-43-3|kegg.compound:C05334|knapsack:C00000973|lipidmaps:LMPK12140355|pubmed:17401997|pubmed:17880032|pubmed:21384439|pubmed:21864313|reaxys:91627|wikipedia.en:Isosakuranetin Graph (2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-naringenin 4'-methyl ether|(S)-2,3-dihydro-5,7-dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|4'-Methylnaringenin|Isosakuranetin|naringenin 4'-methyl ether (2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one (2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-naringenin 4'-methyl ether|(S)-2,3-dihydro-5,7-dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|4'-Methylnaringenin|Isosakuranetin|naringenin 4'-methyl ether http://purl.obolibrary.org/obo/CHEBI_27552 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27555 biolink:ChemicalEntity prostaglandin C2 A member of the class of prostaglandins C that is prosta-5,11,13-trien-1-oic acid carrying oxo and hydroxy substituents at positions 9 and 15 respectively (the 5Z,13E,15S-stereoisomer). kegg.compound:C05955|lipidmaps:LMFA03010133 Graph (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oic acid|PGC2|Prostaglandin C2 (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oic acid (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,11,13-trien-1-oic acid|PGC2|Prostaglandin C2 http://purl.obolibrary.org/obo/CHEBI_27555 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2756 biolink:ChemicalEntity anthracene-1,8,9-triol An anthracenetriol that is anthracene substituted by hydroxy groups at positions 1, 8 and 9. cas:480-22-8|kegg.compound:C06831|pubmed:25653027|reaxys:1976792 Graph 1,8,9-anthratriol|1,8,9-trihydroxyanthracene|1,8-dihydroxy-9-anthranol|1,8-dihydroxyanthranol|Anthralin|anthracene-1,8,9-triol anthracene-1,8,9-triol 1,8,9-anthratriol|1,8,9-trihydroxyanthracene|1,8-dihydroxy-9-anthranol|1,8-dihydroxyanthranol|Anthralin|anthracene-1,8,9-triol http://purl.obolibrary.org/obo/CHEBI_2756 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27560 biolink:ChemicalEntity boron atom cas:7440-42-8|kegg.compound:C06266|webelements:B Graph 5B|B|Bor|Boron|boracium|bore|boro|boron Boron|boron 5B|B|Bor|Boron|boracium|bore|boro|boron http://purl.obolibrary.org/obo/CHEBI_27560 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27561 biolink:ChemicalEntity oxirane A saturated organic heteromonocyclic parent that is a three-membered heterocycle of two carbon atoms and one oxygen atom. cas:75-21-8|gmelin:676|hmdb:HMDB0031305|kegg.compound:C06548|kegg.drug:D03474|pubmed:11437638|pubmed:24313866|pubmed:24882394|pubmed:25005741|pubmed:3932500|reaxys:102378|umbbd.compound:c0527|wikipedia.en:Oxirane Graph 1,2-Epoxyaethan|1,2-epoxyethane|Aethylenoxid|Amprolene|Anprolene|Anproline|Dihydrooxirene|Dimethylene oxide|ETO|Ethylene oxide|Oxacyclopropane|Oxane|Oxidoethane|Oxyfume|epoxyethane|ethene oxide|oxirane|oxyde d'ethylene oxirane 1,2-Epoxyaethan|1,2-epoxyethane|Aethylenoxid|Amprolene|Anprolene|Anproline|Dihydrooxirene|Dimethylene oxide|ETO|Ethylene oxide|Oxacyclopropane|Oxane|Oxidoethane|Oxyfume|epoxyethane|ethene oxide|oxirane|oxyde d'ethylene http://purl.obolibrary.org/obo/CHEBI_27561 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27562 biolink:ChemicalEntity 20-hydroxy-20-oxoleukotriene B4 A member of the class of leukotrienes that is leukotriene B4 in which the terminal methyl group has undergone formal oxidation to the corresponding carboxylic acid. cas:80434-82-8|kegg.compound:C05950|lipidmaps:LMFA03020016 Graph (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid|20-COOH-LTB4|20-COOH-Leukotriene B4|20-Carboxy-leukotriene B4|20-carboxy-LTB4|5,12-Dihydroxy-delta5,8,11,14-eicosapolyendioic acid (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid|20-COOH-LTB4|20-COOH-Leukotriene B4|20-Carboxy-leukotriene B4|20-carboxy-LTB4|5,12-Dihydroxy-delta5,8,11,14-eicosapolyendioic acid http://purl.obolibrary.org/obo/CHEBI_27562 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27563 biolink:ChemicalEntity arsenic atom cas:7440-38-2|kegg.compound:C06269|webelements:As Graph 33As|Arsen|Arsenic|As|arsenic|arsenico|arsenicum Arsenic|arsenic 33As|Arsen|Arsenic|As|arsenic|arsenico|arsenicum http://purl.obolibrary.org/obo/CHEBI_27563 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27565 biolink:ChemicalEntity 4-aminosalicylic acid An aminobenzoic acid that is salicylic acid substituted by an amino group at position 4. cas:65-49-6|drugbank:DB00233|drugcentral:2050|gmelin:306153|hmdb:HMDB0014378|kegg.compound:C02518|kegg.drug:D00162|lincs.smallmolecule:LSM-5862|patent:DE50835|patent:US2844625|patent:US427564|pdb-ccd:BHA|pubmed:11621575|pubmed:1650428|pubmed:23118010|pubmed:24663015|pubmed:25050392|pubmed:25421465|pubmed:25605031|pubmed:25963985|pubmed:26004847|pubmed:26033719|pubmed:26277036|pubmed:26596566|pubmed:26848874|pubmed:27021327|pubmed:27491492|pubmed:27617928|pubmed:27671064|pubmed:28011126|pubmed:28223391|pubmed:28394286|pubmed:28408267|pubmed:28567674|pubmed:28651968|pubmed:28717039|pubmed:28812999|reaxys:473071|wikipedia.en:Aminosalicylic_Acid Graph 2-HYDROXY-4-AMINOBENZOIC ACID|4-Aminosalicylate|4-Aminosalicylic acid|4-amino-2-hydroxybenzoic acid|Aminosalicylic acid|PAS|Para-amino salicylic acid|Paser|p-aminosalicylic acid 4-amino-2-hydroxybenzoic acid 2-HYDROXY-4-AMINOBENZOIC ACID|4-Aminosalicylate|4-Aminosalicylic acid|4-amino-2-hydroxybenzoic acid|Aminosalicylic acid|PAS|Para-amino salicylic acid|Paser|p-aminosalicylic acid http://purl.obolibrary.org/obo/CHEBI_27565 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27566 biolink:ChemicalEntity 6-prenylnaringenin A trihydroxyflavanone having a structure of naringenin prenylated at C-6. cas:68236-13-5|knapsack:C00000997|pubmed:30031654|reaxys:6233280 Graph (2S)-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one|sophoraflavanone B (2S)-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one|sophoraflavanone B http://purl.obolibrary.org/obo/CHEBI_27566 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27568 biolink:ChemicalEntity selenium atom cas:7782-49-2|drugbank:DB11135|foodb.food:FDB013400|hmdb:HMDB0001349|kegg.compound:C01529|webelements:Se|wikipedia.en:Selenium Graph 34Se|Se|Selen|Selenium|selenio|selenium Selenium|selenium 34Se|Se|Selen|Selenium|selenio|selenium http://purl.obolibrary.org/obo/CHEBI_27568 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27569 biolink:ChemicalEntity arabinogalactan A polysaccharide composed of repeating units of arabinosylgalactose. cas:9036-66-2|kegg.compound:C00569|pubmed:12368438|pubmed:15063212|pubmed:15132700|pubmed:16291675|pubmed:8154046 Graph AG|Arabinogalactan|Arabinogalactoglycan|D-Galacto-L-arabinan|Galactoarabinan AG|Arabinogalactan|Arabinogalactoglycan|D-Galacto-L-arabinan|Galactoarabinan http://purl.obolibrary.org/obo/CHEBI_27569 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27570 biolink:ChemicalEntity histidine An α-amino acid that is propanoic acid bearing an amino substituent at position 2 and a 1H-imidazol-4-yl group at position 3. cas:4998-57-6|gmelin:3656|kegg.compound:C00768|knapsack:C00001363|pubmed:17190852|pubmed:22264337|pubmed:22770225|pubmed:29286160|reaxys:84087|wikipedia.en:Histidine Graph 2-amino-3-(1H-imidazol-4-yl)propanoic acid|DL-Histidine|Histidin|Histidine|alpha-Amino-1H-imidazole-4-propionic acid|histidina|histidine 2-amino-3-(1H-imidazol-4-yl)propanoic acid|Histidine|histidine 2-amino-3-(1H-imidazol-4-yl)propanoic acid|DL-Histidine|Histidin|Histidine|alpha-Amino-1H-imidazole-4-propionic acid|histidina|histidine http://purl.obolibrary.org/obo/CHEBI_27570 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27573 biolink:ChemicalEntity silicon atom cas:7440-21-3|kegg.compound:C06263|webelements:Si Graph 14Si|Si|Silicon|Silizium|silicio|silicium|silicon Silicon|silicon 14Si|Si|Silicon|Silizium|silicio|silicium|silicon http://purl.obolibrary.org/obo/CHEBI_27573 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27574 biolink:ChemicalEntity N(2)-succinyl-L-ornithine kegg.compound:C03415|pdb-ccd:SUO Graph (2S)-5-Amino-2-(3-carboxypropanoylamino)pentanoic acid|N(2)-(3-carboxypropanoyl)-L-ornithine|N2-Succinyl-L-ornithine N(2)-(3-carboxypropanoyl)-L-ornithine (2S)-5-Amino-2-(3-carboxypropanoylamino)pentanoic acid|N(2)-(3-carboxypropanoyl)-L-ornithine|N2-Succinyl-L-ornithine http://purl.obolibrary.org/obo/CHEBI_27574 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27577 biolink:ChemicalEntity phosphoramidate ester A phosphoric ester (phosphate) that has an NR2 instead of an OH group. kegg.compound:C01976 Graph Phosphoamide|phosphoramidate esters Phosphoamide|phosphoramidate esters http://purl.obolibrary.org/obo/CHEBI_27577 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27584 biolink:ChemicalEntity aldosterone A pregnane-based steroidal hormone produced by the outer-section (zona glomerulosa) of the adrenal cortex in the adrenal gland, and acts on the distal tubules and collecting ducts of the kidney to cause the conservation of sodium, secretion of potassium, increased water retention, and increased blood pressure. The overall effect of aldosterone is to increase reabsorption of ions and water in the kidney. cas:52-39-1|drugbank:DB04630|drugcentral:111|hmdb:HMDB0000037|kegg.compound:C01780|lincs.smallmolecule:LSM-42770|lipidmaps:LMST02030026|pdb-ccd:AS4|pubmed:10438974|reaxys:3224996|wikipedia.en:Aldosterone Graph (+)-aldosterone|(11beta)-11,21-dihydroxy-3,20-dioxopregn-4-en-18-al|11beta,21-Dihydroxy-3,20-dioxo-4-pregnen-18-al|11beta,21-dihydroxy-3,20-dioxopregn-4-en-18-al|ALDOSTERONE|Aldosterone|aldosterone 11beta,21-dihydroxy-3,20-dioxopregn-4-en-18-al (+)-aldosterone|(11beta)-11,21-dihydroxy-3,20-dioxopregn-4-en-18-al|11beta,21-Dihydroxy-3,20-dioxo-4-pregnen-18-al|11beta,21-dihydroxy-3,20-dioxopregn-4-en-18-al|ALDOSTERONE|Aldosterone|aldosterone http://purl.obolibrary.org/obo/CHEBI_27584 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27585 biolink:ChemicalEntity selenomethionine A selenoamino acid that is the selenium analogue of methionine. cas:1464-42-2|hmdb:HMDB0003966|metacyc.compound:SELENOMETHIONINE|pubmed:14969538|pubmed:20740325|pubmed:21259435|pubmed:21286848|pubmed:21366307|pubmed:21524942|pubmed:21603917|pubmed:21766323|pubmed:21870603|pubmed:21877325|reaxys:1758204|wikipedia.en:Selenomethionine Graph (+-)-selenomethionine|2-amino-4-(methylseleno)butanoic acid|Butanoic acid, 2-amino-4-(methylseleno)-|Selenium methionine|Seleno-DL-methionine 2-amino-4-(methylseleno)butanoic acid (+-)-selenomethionine|2-amino-4-(methylseleno)butanoic acid|Butanoic acid, 2-amino-4-(methylseleno)-|Selenium methionine|Seleno-DL-methionine http://purl.obolibrary.org/obo/CHEBI_27585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27586 biolink:ChemicalEntity beta-L-rhamnopyranose The β-anomer of L-rhamnopyranose. glygen:G51535NO|glytoucan:G51535NO|kegg.compound:C02338|pdb-ccd:RM4 Graph 6-deoxy-beta-L-mannopyranose|beta-6-Deoxy-L-mannose|beta-L-Mannomethylose|beta-L-Rhamnose|beta-L-rhamnopyranose|beta-L-rhamnose 6-deoxy-beta-L-mannopyranose|beta-L-rhamnopyranose 6-deoxy-beta-L-mannopyranose|beta-6-Deoxy-L-mannose|beta-L-Mannomethylose|beta-L-Rhamnose|beta-L-rhamnopyranose|beta-L-rhamnose http://purl.obolibrary.org/obo/CHEBI_27586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27590 biolink:ChemicalEntity 7-hydroxyflavanone 7-O-beta-D-glucoside A flavanone 7-O-β-D-glucoside that consists of 7-hydroxyflavanone attached to a β-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. kegg.compound:C04007|reaxys:62375 Graph 4-oxo-2-phenyl-3,4-dihydro-2H-chromen-7-yl beta-D-glucopyranoside|Flavanone 7-O-beta-D-glucoside|Flavanone 7-O-glucoside|flavanone 7-O-beta-D-glucoside 4-oxo-2-phenyl-3,4-dihydro-2H-chromen-7-yl beta-D-glucopyranoside 4-oxo-2-phenyl-3,4-dihydro-2H-chromen-7-yl beta-D-glucopyranoside|Flavanone 7-O-beta-D-glucoside|Flavanone 7-O-glucoside|flavanone 7-O-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_27590 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27592 biolink:ChemicalEntity ectoine A carboxamidine heterocycle obtained by formal condensation of (2S)-2,4-diaminobutanoic acid with acetic acid. cas:96702-03-3|kegg.compound:C06231|metacyc.compound:ECTOINE|pdb-ccd:4CS|reaxys:7288977|wikipedia.en:Ectoine Graph (+)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid|(4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid|Ectoine|L-Ectoine|L-ectoine (4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid (+)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid|(4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid|Ectoine|L-Ectoine|L-ectoine http://purl.obolibrary.org/obo/CHEBI_27592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27594 biolink:ChemicalEntity carbon atom cas:7440-44-0|kegg.compound:C06265|webelements:C Graph 6C|C|Carbon|Kohlenstoff|carbon|carbone|carbonium|carbono Carbon|carbon 6C|C|Carbon|Kohlenstoff|carbon|carbone|carbonium|carbono http://purl.obolibrary.org/obo/CHEBI_27594 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27595 biolink:ChemicalEntity 11-epi-prostaglandin F2alpha The prostaglandin F that is the 11-epimer of prostaglandin F2α. kegg.compound:C05959|lipidmaps:LMFA03010036 Graph (5Z,13E,15S)-9alpha,11beta,15-trihydroxyprosta-5,13-dien-1-oic acid|11-epi-PGF2a|11-epi-PGF2alpha|11-epi-Prostaglandin F2a|11-epi-Prostaglandin F2alpha|11beta-PGF2alpha|11beta-prostaglandin F2alpha (5Z,13E,15S)-9alpha,11beta,15-trihydroxyprosta-5,13-dien-1-oic acid (5Z,13E,15S)-9alpha,11beta,15-trihydroxyprosta-5,13-dien-1-oic acid|11-epi-PGF2a|11-epi-PGF2alpha|11-epi-Prostaglandin F2a|11-epi-Prostaglandin F2alpha|11beta-PGF2alpha|11beta-prostaglandin F2alpha http://purl.obolibrary.org/obo/CHEBI_27595 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27596 biolink:ChemicalEntity N(pros)-methyl-L-histidine A L-histidine derivative that is L-histidine substituted by a methyl group at position 3 on the imidazole ring. cas:368-16-1|gmelin:1568650|hmdb:HMDB0000479|kegg.compound:C01152|pdb-ccd:MHS|pubmed:22612948|pubmed:24009031|pubmed:24681531|reaxys:83651 Graph (2S)-2-amino-3-(1-methyl-1H-imidazol-5-yl)propanoic acid|1-Methylhistidine|3-Methyl-L-histidine|3-Methylhistidine|3-methylhistidine|N(pai)-Methyl-L-histidine|N(pros)-methyl-L-histidine|N-pros-Methyl-L-histidine|Tau-methylhistidine 1-Methylhistidine|N(pros)-methyl-L-histidine (2S)-2-amino-3-(1-methyl-1H-imidazol-5-yl)propanoic acid|1-Methylhistidine|3-Methyl-L-histidine|3-Methylhistidine|3-methylhistidine|N(pai)-Methyl-L-histidine|N(pros)-methyl-L-histidine|N-pros-Methyl-L-histidine|Tau-methylhistidine http://purl.obolibrary.org/obo/CHEBI_27596 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27601 biolink:ChemicalEntity pteridine beilstein:115341|cas:91-18-9|gmelin:364077|kegg.compound:C07581 Graph 1,3,5,8-tetraazanaphthalene|Pteridine|azinepurine|pteridine Pteridine|pteridine 1,3,5,8-tetraazanaphthalene|Pteridine|azinepurine|pteridine http://purl.obolibrary.org/obo/CHEBI_27601 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27603 biolink:ChemicalEntity 1(F)-alpha-D-galactosylraffinose A tetrasaccharide consisting of raffinose, to the furanose O-1 position of which is linked an α-D-galactosyl group. cas:512-65-2|kegg.compound:C08242|kegg.glycan:G01504|knapsack:C00001139|pubmed:16997290|pubmed:18855444|pubmed:20452631|pubmed:24253101|reaxys:74226 Graph 1(F)-alpha-D-galactosylraffinose|1F-alpha-D-Galactosylraffinose|1F-alpha-D-galactosylraffinose|Lychnose|alpha-D-galactopyranosyl-(1->1)-beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside alpha-D-galactopyranosyl-(1->1)-beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside 1(F)-alpha-D-galactosylraffinose|1F-alpha-D-Galactosylraffinose|1F-alpha-D-galactosylraffinose|Lychnose|alpha-D-galactopyranosyl-(1->1)-beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_27603 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27605 biolink:ChemicalEntity D-psicose The D-enantiomer of psicose. cas:551-68-8|kegg.compound:C06468|metacyc.compound:PSICOSE|pubmed:18517216|pubmed:22224918|wikipedia.en:Psicose Graph D-Allulose|D-Altrulose|D-Pseudofructose|D-Psi|D-Psicose|D-allulose|D-erythro-Hexulose|D-psicose|D-ribo-2-Hexulose|D-ribo-2-Ketohexulose|D-ribo-hex-2-ulose D-Psicose|D-psicose|D-ribo-hex-2-ulose D-Allulose|D-Altrulose|D-Pseudofructose|D-Psi|D-Psicose|D-allulose|D-erythro-Hexulose|D-psicose|D-ribo-2-Hexulose|D-ribo-2-Ketohexulose|D-ribo-hex-2-ulose http://purl.obolibrary.org/obo/CHEBI_27605 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27607 biolink:ChemicalEntity thymol A phenol that is a natural monoterpene derivative of cymene. bpdb:1889|cas:89-83-8|drugbank:DB02513|drugcentral:4258|kegg.compound:C09908|kegg.drug:D01039|knapsack:C00000155|lipidmaps:LMPR0102090029|pdb-ccd:IPB|vsdb:1889 Graph 1-hydroxy-5-methyl-2-isopropylbenzene|2-isopropyl-5-methylphenol|3-p-cymenol|5-METHYL-2-(1-METHYLETHYL)PHENOL|5-methyl-2-(propan-2-yl)phenol|5-methyl-2-isopropylphenol|6-isopropyl-3-methylphenol|6-isopropyl-m-cresol|Thymol|thymol 5-methyl-2-(propan-2-yl)phenol 1-hydroxy-5-methyl-2-isopropylbenzene|2-isopropyl-5-methylphenol|3-p-cymenol|5-METHYL-2-(1-METHYLETHYL)PHENOL|5-methyl-2-(propan-2-yl)phenol|5-methyl-2-isopropylphenol|6-isopropyl-3-methylphenol|6-isopropyl-m-cresol|Thymol|thymol http://purl.obolibrary.org/obo/CHEBI_27607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2761 biolink:ChemicalEntity dipotassium bis[mu-tartrato(4-)]diantimonate(2-) trihydrate A hydrate that is the trihydrate form of dipotassium bis[μ-tartrato(4−)]diantimonate(2−). cas:28300-74-5|gmelin:1332600|kegg.compound:C11340|kegg.drug:D02959 Graph Antimony potassium tartrate|Tartox|dipotassium bis{mu-[2-(hydroxy-1kappaO)-3-(hydroxy-2kappaO)butanedioato(4-)-1kappaO(4):2kappaO(4)]}diantimonate(2-)--water (1/3)|dipotassium bis{mu-[2-(hydroxy-1kappaO)-3-(hydroxy-2kappaO)succinato(4-)-1kappaO(4):2kappaO(4)]}diantimonate(2-) trihydrate|tartar emetic|tartrated antimony dipotassium bis{mu-[2-(hydroxy-1kappaO)-3-(hydroxy-2kappaO)butanedioato(4-)-1kappaO(4):2kappaO(4)]}diantimonate(2-)--water (1/3) Antimony potassium tartrate|Tartox|dipotassium bis{mu-[2-(hydroxy-1kappaO)-3-(hydroxy-2kappaO)butanedioato(4-)-1kappaO(4):2kappaO(4)]}diantimonate(2-)--water (1/3)|dipotassium bis{mu-[2-(hydroxy-1kappaO)-3-(hydroxy-2kappaO)succinato(4-)-1kappaO(4):2kappaO(4)]}diantimonate(2-) trihydrate|tartar emetic|tartrated antimony http://purl.obolibrary.org/obo/CHEBI_2761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27612 biolink:ChemicalEntity hydantoin beilstein:110598|cas:461-72-3|gmelin:101266|kegg.compound:C05146|pdb-ccd:HYN Graph 2,4(3H,5H)-imidazoledione|2,4-imidazolidinedione|Glycolylurea|Hydantoin|imidazole-2,4(3H,5H)-dione|imidazolidine-2,4-dione imidazolidine-2,4-dione 2,4(3H,5H)-imidazoledione|2,4-imidazolidinedione|Glycolylurea|Hydantoin|imidazole-2,4(3H,5H)-dione|imidazolidine-2,4-dione http://purl.obolibrary.org/obo/CHEBI_27612 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27613 biolink:ChemicalEntity amygdalin Graph [(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile|amygdaloside|mandelonitrile-beta-gentiobioside [(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile [(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile|amygdaloside|mandelonitrile-beta-gentiobioside http://purl.obolibrary.org/obo/CHEBI_27613 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27616 biolink:ChemicalEntity psoralen The simplest member of the class of psoralens that is 7H-furo[3,2-g]chromene having a keto group at position 7. It has been found in plants like Psoralea corylifolia and Ficus salicifolia. cas:66-97-7|kegg.compound:C09305|kegg.drug:D08450|knapsack:C00000297|pubmed:20196083|pubmed:21468912|reaxys:152784|wikipedia.en:Psoralen Graph 3-(6-hydroxy-5-benzofuranyl)-2-propenoic acid delta-lactone|6,7-furanocoumarin|6-hydroxy-5-benzofuranacrylic acid delta-lactone|7H-furo[3,2-g][1]benzopyran-7-one|7H-furo[3,2-g]chromen-7-one|Ficusin|Manaderm|Psoralen|furo[2',3':7,6]coumarin|furo[4',5':6,7]coumarin|furocoumarin|psoralen|psoralene 7H-furo[3,2-g]chromen-7-one 3-(6-hydroxy-5-benzofuranyl)-2-propenoic acid delta-lactone|6,7-furanocoumarin|6-hydroxy-5-benzofuranacrylic acid delta-lactone|7H-furo[3,2-g][1]benzopyran-7-one|7H-furo[3,2-g]chromen-7-one|Ficusin|Manaderm|Psoralen|furo[2',3':7,6]coumarin|furo[4',5':6,7]coumarin|furocoumarin|psoralen|psoralene http://purl.obolibrary.org/obo/CHEBI_27616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27617 biolink:ChemicalEntity monensin A A spiroketal, monensin A is the major component of monensin, a mixture of antibiotic substances produced by Streptomyces cinnamonensis. An antiprotozoal, it is used as the sodium salt as a feed additive for the prevention of coccidiosis in poultry and as a growth promoter in cattle. cas:17090-79-8|kegg.compound:C06693|kegg.drug:D08228|lincs.smallmolecule:LSM-5659|pubmed:21215424|reaxys:1633130 Graph (2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-{(2S,2'R,3'S,5R,5'R)-2-ethyl-5'-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyltetrahydro-2H-pyran-2-yl]-3'-methyloctahydro-2,2'-bifuran-5-yl}-9-hydroxy-2,8-dimethyl-1,6-dioxaspiro[4.5]dec-7-yl]-3-methoxy-2-methylpentanoic acid|Monensin|Monensin A|monensic acid|monensin|monensina|monensinum (2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-{(2S,2'R,3'S,5R,5'R)-2-ethyl-5'-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyltetrahydro-2H-pyran-2-yl]-3'-methyloctahydro-2,2'-bifuran-5-yl}-9-hydroxy-2,8-dimethyl-1,6-dioxaspiro[4.5]dec-7-yl]-3-methoxy-2-methylpentanoic acid (2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-{(2S,2'R,3'S,5R,5'R)-2-ethyl-5'-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyltetrahydro-2H-pyran-2-yl]-3'-methyloctahydro-2,2'-bifuran-5-yl}-9-hydroxy-2,8-dimethyl-1,6-dioxaspiro[4.5]dec-7-yl]-3-methoxy-2-methylpentanoic acid|Monensin|Monensin A|monensic acid|monensin|monensina|monensinum http://purl.obolibrary.org/obo/CHEBI_27617 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27618 biolink:ChemicalEntity chalcone A member of the class of chalcones that is acetophenone in which one of the methyl hydrogens has been replaced by a benzylidene group. cas:94-41-7|gmelin:29124|kegg.compound:C01484|pubmed:24510324|reaxys:509985|wikipedia.en:Chalcone Graph 1,3-Diphenyl-2-propen-1-one|1,3-diphenylprop-2-en-1-one|Benzylideneacetophenone|Chalcone|Chalkon|alpha-benzylideneacetophenone|beta-benzoylstyrene|beta-phenylacrylophenone|styryl phenyl ketone 1,3-diphenylprop-2-en-1-one 1,3-Diphenyl-2-propen-1-one|1,3-diphenylprop-2-en-1-one|Benzylideneacetophenone|Chalcone|Chalkon|alpha-benzylideneacetophenone|beta-benzoylstyrene|beta-phenylacrylophenone|styryl phenyl ketone http://purl.obolibrary.org/obo/CHEBI_27618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2762 biolink:ChemicalEntity antimycin A A nine-membered bis-lactone having methyl substituents at the 2- and 6-positions, an n-hexyl substituent at the 8-position, an acyloxy substituent at the 7-position and an aroylamido substituent at the 3-position. It is produced by Streptomyces bacteria and has found commercial use as a fish poison. beilstein:72665|cas:1397-94-0|cas:642-15-9|kegg.compound:C11339|metacyc.compound:CPD-5744|pdb-ccd:AY1|pubmed:16819166|pubmed:29790043|pubmed:30914247|pubmed:31079230|pubmed:32662599 Graph (2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl 3-methylbutanoate|Antimycin A1|Antipiricullin|Fintrol|Virosin|antimycin A1b (2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl 3-methylbutanoate (2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl 3-methylbutanoate|Antimycin A1|Antipiricullin|Fintrol|Virosin|antimycin A1b http://purl.obolibrary.org/obo/CHEBI_2762 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27622 biolink:ChemicalEntity vanillylmandelate A hydroxy monocarboxylic acid anion that is the conjugate base of vanillylmandelic acid. kegg.compound:C05584 Graph 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetate|3-Methoxy-4-hydroxymandelate|vanilmandelate 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetate 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetate|3-Methoxy-4-hydroxymandelate|vanilmandelate http://purl.obolibrary.org/obo/CHEBI_27622 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27625 biolink:ChemicalEntity alpha-D-glucosamine 1-phosphate beilstein:22947|cas:2152-75-2|drugbank:DB03111|kegg.compound:C06156|knapsack:C00019579|pdb-ccd:GP1 Graph 2-amino-2-deoxy-1-O-phosphono-alpha-D-glucopyranose|2-amino-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate)|D-Glucosamine 1-phosphate|GLUCOSAMINE 1-PHOSPHATE|alpha-D-Glucosamine 1-phosphate 2-amino-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate) 2-amino-2-deoxy-1-O-phosphono-alpha-D-glucopyranose|2-amino-2-deoxy-alpha-D-glucopyranose 1-(dihydrogen phosphate)|D-Glucosamine 1-phosphate|GLUCOSAMINE 1-PHOSPHATE|alpha-D-Glucosamine 1-phosphate http://purl.obolibrary.org/obo/CHEBI_27625 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27628 biolink:ChemicalEntity 4-isopropylbenzyl alcohol A member of the class of benzyl alcohols in which the hydrogen at position 4 on the phenyl ring of benzyl alcohol has been replaced by an isopropyl group. agr:IND44465554|cas:536-60-7|hmdb:HMDB0031817|kegg.compound:C06576|knapsack:C00032864|metacyc.compound:CPD-1002|pubmed:11341314|pubmed:19480554|pubmed:19655769|pubmed:20628994|pubmed:21035544|pubmed:21126829|pubmed:21337949|pubmed:21942283|pubmed:22033086|pubmed:23025190|pubmed:23157017|pubmed:23507295|pubmed:25204729|pubmed:25261521|pubmed:27530691|pubmed:27865956|reaxys:636665|umbbd.compound:c0376 Graph (4-isopropylphenyl)methanol|(4-propan-2-ylphenyl)methanol|4-(1-Methylethyl)benzenemethanol|4-isopropylbenzyl alcohol|Cumic alcohol|Cumin alcohol|Cuminic alcohol|Cuminol|Cuminyl alcohol|Cumyl alcohol|P-Mentha-1,3,5-trien-7-ol|[4-(propan-2-yl)phenyl]methanol|p-Cumic alcohol|p-Cumin-7-ol|p-Cymen-7-ol|p-Isopropylbenzyl alcohol|para-Cymen-7-ol [4-(propan-2-yl)phenyl]methanol (4-isopropylphenyl)methanol|(4-propan-2-ylphenyl)methanol|4-(1-Methylethyl)benzenemethanol|4-isopropylbenzyl alcohol|Cumic alcohol|Cumin alcohol|Cuminic alcohol|Cuminol|Cuminyl alcohol|Cumyl alcohol|P-Mentha-1,3,5-trien-7-ol|[4-(propan-2-yl)phenyl]methanol|p-Cumic alcohol|p-Cumin-7-ol|p-Cymen-7-ol|p-Isopropylbenzyl alcohol|para-Cymen-7-ol http://purl.obolibrary.org/obo/CHEBI_27628 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27630 biolink:ChemicalEntity precorrin-5 The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which five methyl groups have been introduced into the tetrapyrrole framework, together with ring contraction. kegg.compound:C06416 Graph 3,3',3'',3'''-[(2S,3S,7S,11S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,11,17-tetramethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 5 3,3',3'',3'''-[(2S,3S,7S,11S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,11,17-tetramethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[(2S,3S,7S,11S,17R)-1-acetyl-2,7,12,18-tetrakis(carboxymethyl)-2,7,11,17-tetramethyl-18,19-didehydrocorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 5 http://purl.obolibrary.org/obo/CHEBI_27630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27632 biolink:ChemicalEntity acetophenone A methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group. cas:98-86-2|drugbank:DB04619|hmdb:HMDB0033910|kegg.compound:C07113|knapsack:C00002685|pubmed:10397882|pubmed:24634568|umbbd.compound:c0117|wikipedia.en:Acetophenone Graph 1-Phenylethanone|1-phenylethan-1-one|1-phenylethanone|Acetophenone|Acetylbenzene|Methyl phenyl ketone|Phenyl methyl ketone|acetophenone|benzoyl methide 1-phenylethan-1-one 1-Phenylethanone|1-phenylethan-1-one|1-phenylethanone|Acetophenone|Acetylbenzene|Methyl phenyl ketone|Phenyl methyl ketone|acetophenone|benzoyl methide http://purl.obolibrary.org/obo/CHEBI_27632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27633 biolink:ChemicalEntity 2,6-dichlorohydroquinone A dichlorohydroquinone that is hydroquinone substituted by chloro groups at positions 2 and 6. cas:20103-10-0|kegg.compound:C07097|knapsack:C00007487|metacyc.compound:26-DICHLORO-P-HYDROQUINONE|pubmed:10526172|pubmed:11476256|pubmed:11731089|pubmed:20307900|pubmed:21870805|pubmed:22043174|reaxys:1945373|umbbd.compound:c0331 Graph 2,6-dichloro-1,4-benzenediol|2,6-dichloro-4-hydroquinone|2,6-dichlorobenzene-1,4-diol 2,6-dichlorobenzene-1,4-diol 2,6-dichloro-1,4-benzenediol|2,6-dichloro-4-hydroquinone|2,6-dichlorobenzene-1,4-diol http://purl.obolibrary.org/obo/CHEBI_27633 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27638 biolink:ChemicalEntity cobalt atom A cobalt group element atom that has atomic number 27. cas:7440-48-4|kegg.compound:C00175|kegg.compound:C19171|pdb-ccd:3CO|webelements:Co Graph 27Co|Co|Cobalt|Kobalt|cobalt|cobalto|cobaltum Cobalt|cobalt 27Co|Co|Cobalt|Kobalt|cobalt|cobalto|cobaltum http://purl.obolibrary.org/obo/CHEBI_27638 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27639 biolink:ChemicalEntity (E)-2-benzylidenesuccinyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (E)-2-benzylidenesuccinic acid. kegg.compound:C09818|umbbd.compound:c0342 Graph (E)-2-Benzylidenesuccinyl-CoA|(E)-2-benzylidenesuccinyl-coenzyme A|(trans)-2-benzylidenesuccinyl-CoA|(trans)-2-benzylidenesuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-2-(carboxymethyl)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|E-Phenylitaconyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-2-(carboxymethyl)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (E)-2-Benzylidenesuccinyl-CoA|(E)-2-benzylidenesuccinyl-coenzyme A|(trans)-2-benzylidenesuccinyl-CoA|(trans)-2-benzylidenesuccinyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-2-(carboxymethyl)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|E-Phenylitaconyl-CoA http://purl.obolibrary.org/obo/CHEBI_27639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27641 biolink:ChemicalEntity cycloheximide A dicarboximide that is 4-(2-hydroxyethyl)piperidine-2,6-dione in which one of the hydrogens attached to the carbon bearing the hydroxy group is replaced by a 3,5-dimethyl-2-oxocyclohexyl group. It is an antibiotic produced by the bacterium Streptomyces griseus. cas:66-81-9|kegg.compound:C06685|kegg.drug:D03625|knapsack:C00047211|lincs.smallmolecule:LSM-2791|pdb-ccd:3HE|ppdb:1680|pubmed:11972861|pubmed:16659174|pubmed:25209664|pubmed:26715760|pubmed:27192630|pubmed:27665925|pubmed:30154175|pubmed:30916348|pubmed:32299921|pubmed:33101237|reaxys:88868|wikipedia.en:Cycloheximide Graph 3-((R)-2-((1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)glutarimide|4-{(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl}piperidine-2,6-dione|Cycloheximid|Cycloheximide|Zykloheximid|cicloheximida|cicloheximide|cicloheximidum|cycloheximide|naramycin|naramycin A 4-{(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl}piperidine-2,6-dione 3-((R)-2-((1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)glutarimide|4-{(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl}piperidine-2,6-dione|Cycloheximid|Cycloheximide|Zykloheximid|cicloheximida|cicloheximide|cicloheximidum|cycloheximide|naramycin|naramycin A http://purl.obolibrary.org/obo/CHEBI_27641 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27642 biolink:ChemicalEntity methyl tert-butyl ether An ether having methyl and tert-butyl as the two alkyl components. cas:1634-04-4|gmelin:773738|kegg.compound:C11344|pubmed:19201538|pubmed:21044818|pubmed:21072404|pubmed:21112690|pubmed:21130999|pubmed:21131048|pubmed:21227585|pubmed:21315889|pubmed:21330701|pubmed:21482276|pubmed:21644118|pubmed:21684239|pubmed:21780613|pubmed:21782339|pubmed:9472332|reaxys:1730942|wikipedia.en:MTBE Graph 2-Methoxy-2-methylpropane|2-Methyl-2-methoxypropane|MTBE|Methyl 1,1-dimethylethyl ether|Methyl t-butyl ether|Methyl tert-butyl ether|Methyl tertiary-butyl ether|t-Butyl methyl ether|tert-Butyl methyl ether|tert-C4H9OCH3|tert-butyl methyl ether tert-Butyl methyl ether|tert-butyl methyl ether 2-Methoxy-2-methylpropane|2-Methyl-2-methoxypropane|MTBE|Methyl 1,1-dimethylethyl ether|Methyl t-butyl ether|Methyl tert-butyl ether|Methyl tertiary-butyl ether|t-Butyl methyl ether|tert-Butyl methyl ether|tert-C4H9OCH3|tert-butyl methyl ether http://purl.obolibrary.org/obo/CHEBI_27642 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27644 biolink:ChemicalEntity chlortetracycline A member of the class of tetracyclines with formula C22H23ClN2O8 isolated from Streptomyces aureofaciens. cas:57-62-5|drugcentral:624|hmdb:HMDB0014401|kegg.compound:C06571|kegg.drug:D07689|lipidmaps:LMPK07000004|patent:US2482055|pdb-ccd:CTC|pubmed:23530364|pubmed:24845506|pubmed:25131164|pubmed:25602656|pubmed:7150561|pubmed:7390959|pubmed:7988792 Graph (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|7-Chlorotetracycline|Aueromycin|chlortetracycline|chlortetracyclinum|clortetraciclina (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|7-Chlorotetracycline|Aueromycin|chlortetracycline|chlortetracyclinum|clortetraciclina http://purl.obolibrary.org/obo/CHEBI_27644 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27647 biolink:ChemicalEntity prostaglandin G2 cas:51982-36-6|drugbank:DB03866|kegg.compound:C05956|lipidmaps:LMFA03010009 Graph (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,9S,11R,13E,15S)-15-hydroperoxy-9,11-epidioxyprosta-5,13-dien-1-oic acid|PGG2|Prostaglandin G2 (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,9S,11R,13E,15S)-15-hydroperoxy-9,11-epidioxyprosta-5,13-dien-1-oic acid (5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3-hydroperoxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid|(5Z,9S,11R,13E,15S)-15-hydroperoxy-9,11-epidioxyprosta-5,13-dien-1-oic acid|PGG2|Prostaglandin G2 http://purl.obolibrary.org/obo/CHEBI_27647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27648 biolink:ChemicalEntity 3-oxohexanoyl-CoA An oxo-fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 3-oxohexanoic acid. cas:19774-86-8|hmdb:HMDB0003943|kegg.compound:C05269|pubmed:1550553|pubmed:344310 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Ketohexanoyl-CoA|3-Ketohexanoyl-coenzyme A|3-Oxohexanoyl-CoA|3-oxohexanoyl-coenzyme A|Coenzyme A, S-(3-oxohexanoate)|adenosine 3'-phosphoric acid 5'-[diphosphoric acid P(2)-[2,2-dimethyl-3-hydroxy-3-[[2-[[2-(3-oxohexanoylthio)ethyl]aminocarbonyl]ethyl]aminocarbonyl]propyl]] ester 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxohexanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Ketohexanoyl-CoA|3-Ketohexanoyl-coenzyme A|3-Oxohexanoyl-CoA|3-oxohexanoyl-coenzyme A|Coenzyme A, S-(3-oxohexanoate)|adenosine 3'-phosphoric acid 5'-[diphosphoric acid P(2)-[2,2-dimethyl-3-hydroxy-3-[[2-[[2-(3-oxohexanoylthio)ethyl]aminocarbonyl]ethyl]aminocarbonyl]propyl]] ester http://purl.obolibrary.org/obo/CHEBI_27648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27656 biolink:ChemicalEntity camptothecin A pyranoindolizinoquinoline that is pyrano[3',4':6,7]indolizino[1,2-b]quinoline which is substituted by oxo groups at positions 3 and 14, and by an ethyl group and a hydroxy group at position 4 (the S enantiomer). cas:7689-03-4|drugbank:DB04690|kegg.compound:C01897|knapsack:C00002145|lincs.smallmolecule:LSM-4611|pdb-ccd:EHD|pubmed:11024478|pubmed:11549373|pubmed:23344961|pubmed:23474217|pubmed:23676007|pubmed:8965250|reaxys:6075662|wikipedia.en:Camptothecin Graph (+)-camptothecin|(+)-camptothecine|(4S)-4-ethyl-4-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione|(S)-(+)-camptothecin|20(S)-camptothecine|21,22-Secocamptothecin-21-oic acid lactone|CPT|Camptothecin|Camptothecine|D-camptothecin (4S)-4-ethyl-4-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione (+)-camptothecin|(+)-camptothecine|(4S)-4-ethyl-4-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione|(S)-(+)-camptothecin|20(S)-camptothecine|21,22-Secocamptothecin-21-oic acid lactone|CPT|Camptothecin|Camptothecine|D-camptothecin http://purl.obolibrary.org/obo/CHEBI_27656 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27657 biolink:ChemicalEntity N-succinyl-L-glutamic 5-semialdehyde A dicarboxylic acid monoamide obtained by the formal condensation of amino group of L-glutamic 5-semialdehyde with one of the carboxy groups of succinic acid. kegg.compound:C05932 Graph (2S)-2-(3-Carboxypropanoylamino)-5-oxopentanoic acid|(2S)-2-[(3-carboxypropanoyl)amino]-5-oxopentanoic acid|N-(3-carboxypropanoyl)-5-oxo-L-norvaline|N-Succinyl-L-glutamate 5-semialdehyde (2S)-2-[(3-carboxypropanoyl)amino]-5-oxopentanoic acid (2S)-2-(3-Carboxypropanoylamino)-5-oxopentanoic acid|(2S)-2-[(3-carboxypropanoyl)amino]-5-oxopentanoic acid|N-(3-carboxypropanoyl)-5-oxo-L-norvaline|N-Succinyl-L-glutamate 5-semialdehyde http://purl.obolibrary.org/obo/CHEBI_27657 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27659 biolink:ChemicalEntity 2-oxo aldehyde Any aldehyde having an oxo substituent at the 2-position. kegg.compound:C00538 Graph 2-Oxoaldehyde|2-oxo aldehydes|2-oxoaldehyde 2-Oxoaldehyde|2-oxo aldehydes|2-oxoaldehyde http://purl.obolibrary.org/obo/CHEBI_27659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2766 biolink:ChemicalEntity aphidicolin A tetracyclic diterpenoid that has an tetradecahydro-8,11a-methanocyclohepta[a]naphthalene skeleton with two hydroxymethyl substituents at positions 4 and 9, two methyl substituents at positions 4 and 11b and two hydroxy substituents at positions 3 and 9. An antibiotic with antiviral and antimitotical properties. Aphidicolin is a reversible inhibitor of eukaryotic nuclear DNA replication. beilstein:4689958|cas:38966-21-1|chemspider:10280269|kegg.compound:C06088|knapsack:C00000873|lincs.smallmolecule:LSM-45486|metacyc.compound:CPD-11426|patent:US3761512|pdb-ccd:2ZE|pubmed:10592317|pubmed:1483268|pubmed:19735659|pubmed:21212237|pubmed:21444690|pubmed:21708134|pubmed:21812410|pubmed:21897020|pubmed:21917855|pubmed:22139884|pubmed:22210918|pubmed:22262459|pubmed:22293751|pubmed:22302683|pubmed:22339690|pubmed:22365495|pubmed:23221037|pubmed:24492257|pubmed:25429975|pubmed:25948499|pubmed:26255574|pubmed:26854444|pubmed:27223263|pubmed:27265376|pubmed:29191129|pubmed:31403790|pubmed:31448675|pubmed:31712575|pubmed:32394671|pubmed:33592314|pubmed:33721476|pubmed:7478586|reaxys:2055641|wikipedia.en:Aphidicolin Graph (3R,4R,4aR,6aS,8R,9R,11aS,11bS)-4,9-bis(hydroxymethyl)-4,11b-dimethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalene-3,9-diol|(3alpha,4alpha,5alpha,17alpha)-3,17-dihydroxy-4-methyl-9,15-cyclo-C,18-dinor-14,15-secoandrostane-4,17-dimethanol|Aphidicolin|aphidocolin (3R,4R,4aR,6aS,8R,9R,11aS,11bS)-4,9-bis(hydroxymethyl)-4,11b-dimethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalene-3,9-diol (3R,4R,4aR,6aS,8R,9R,11aS,11bS)-4,9-bis(hydroxymethyl)-4,11b-dimethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalene-3,9-diol|(3alpha,4alpha,5alpha,17alpha)-3,17-dihydroxy-4-methyl-9,15-cyclo-C,18-dinor-14,15-secoandrostane-4,17-dimethanol|Aphidicolin|aphidocolin http://purl.obolibrary.org/obo/CHEBI_2766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27660 biolink:ChemicalEntity pyrrole-2-carboxylate beilstein:3663073|gmelin:1006285 Graph 1H-pyrrole-2-carboxylate|pyrrole-2-carboxylate 1H-pyrrole-2-carboxylate 1H-pyrrole-2-carboxylate|pyrrole-2-carboxylate http://purl.obolibrary.org/obo/CHEBI_27660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27662 biolink:ChemicalEntity benzquinamide beilstein:502385|cas:63-12-7|drugbank:DB00767|drugcentral:331|kegg.drug:D00243|wikipedia.en:Benzquinamide Graph 2-(acetoxy)-N,N-diethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizine-3-carboxamide|2-(acetyloxy)-N,N-diethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizine-3-carboxamide|3-(diethylcarbamoyl)-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-yl acetate|BZQ|Benzchinamid|Emete-Con|benzochinamide|benzquinamida|benzquinamide|benzquinamidum 3-(diethylcarbamoyl)-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-yl acetate 2-(acetoxy)-N,N-diethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizine-3-carboxamide|2-(acetyloxy)-N,N-diethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizine-3-carboxamide|3-(diethylcarbamoyl)-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-yl acetate|BZQ|Benzchinamid|Emete-Con|benzochinamide|benzquinamida|benzquinamide|benzquinamidum http://purl.obolibrary.org/obo/CHEBI_27662 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27666 biolink:ChemicalEntity actinomycin D beilstein:4173766|cas:50-76-0|drugbank:DB00970|drugcentral:774|kegg.compound:C06770|kegg.drug:D00214|lincs.smallmolecule:LSM-5783|wikipedia.en:Dactinomycin Graph 2-amino-4,6-dimethyl-3-oxo-1-N,9-N-bis-[(18aS)-10c,14,17-trimethyl-5,8,12,15,18-pentaoxo-6c,13t-di(propan-2-yl)-18ar-hexadecahydro-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-9c-yl]-3H-phenoxazine-1,9-dicarboxamide|2-amino-N,N'-bis(hexadecahydro-2,5,9-trimethyl-6,13-bis(1-methylethyl)-1,4,7,11,14-pentaoxo-1H-pyrrolo(2,1-i)(1,4,7,10,13)oxatetra-azacyclohexadecin-10-yl)-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxamide|ActD|Actinomycin D|Dactinomycin|actinomycin C1|actinomycin IV 2-amino-4,6-dimethyl-3-oxo-1-N,9-N-bis-[(18aS)-10c,14,17-trimethyl-5,8,12,15,18-pentaoxo-6c,13t-di(propan-2-yl)-18ar-hexadecahydro-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-9c-yl]-3H-phenoxazine-1,9-dicarboxamide 2-amino-4,6-dimethyl-3-oxo-1-N,9-N-bis-[(18aS)-10c,14,17-trimethyl-5,8,12,15,18-pentaoxo-6c,13t-di(propan-2-yl)-18ar-hexadecahydro-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-9c-yl]-3H-phenoxazine-1,9-dicarboxamide|2-amino-N,N'-bis(hexadecahydro-2,5,9-trimethyl-6,13-bis(1-methylethyl)-1,4,7,11,14-pentaoxo-1H-pyrrolo(2,1-i)(1,4,7,10,13)oxatetra-azacyclohexadecin-10-yl)-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxamide|ActD|Actinomycin D|Dactinomycin|actinomycin C1|actinomycin IV http://purl.obolibrary.org/obo/CHEBI_27666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27667 biolink:ChemicalEntity beta-D-galactose A D-galactopyranose having β configuration at the anomeric centre. cas:7296-64-2|foodb.food:FDB021788|glygen:G65889KE|glytoucan:G65889KE|gmelin:648639|hmdb:HMDB0003449|kegg.compound:C00962|metacyc.compound:GALACTOSE|pdb-ccd:GAL|pubmed:17991151|pubmed:18619283|pubmed:19443021|pubmed:25568069|pubmed:31537530|reaxys:1680744 Graph BETA-D-GALACTOSE|Gal-beta|beta-D-Gal|beta-D-Galactose|beta-D-galactopyranose|beta-D-galactose beta-D-galactopyranose BETA-D-GALACTOSE|Gal-beta|beta-D-Gal|beta-D-Galactose|beta-D-galactopyranose|beta-D-galactose http://purl.obolibrary.org/obo/CHEBI_27667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27668 biolink:ChemicalEntity (S)-3-hydroxylauroyl-CoA A hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxydodecanoic acid. hmdb:HMDB0003936|kegg.compound:C05262|lipidmaps:LMFA07050012 Graph (S)-3-Hydroxydodecanoyl-CoA|(S)-3-hydroxydodecanoyl-coenzyme A|(S)-3-hydroxylauroyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydodecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydodecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxydodecanoyl-CoA|(S)-3-hydroxydodecanoyl-coenzyme A|(S)-3-hydroxylauroyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydodecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_27668 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27669 biolink:ChemicalEntity neoastilbin A flavanone glycoside that is (−)-taxifolin substituted by a α-L-rhamnosyl moiety at position 3 via a glycosidic linkage. cas:29838-67-3|cas:54081-47-9|kegg.compound:C09803|kegg.compound:C17449|knapsack:C00008703|reaxys:100565 Graph (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside|(2S,3S)-Taxifolin 3-rhamnoside|(2S,3S)-dihydroquercetin 3-O-alpha-L-rhamnoside|Neoastilbin (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside|(2S,3S)-Taxifolin 3-rhamnoside|(2S,3S)-dihydroquercetin 3-O-alpha-L-rhamnoside|Neoastilbin http://purl.obolibrary.org/obo/CHEBI_27669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27673 biolink:ChemicalEntity herbacetin A pentahydroxyflavone that is kaempferol substituted by a hydroxy group at position 8. It is a natural flavonoid from flaxseed which exerts antioxidant, anti-inflammatory and anticancer activities. cas:527-95-7|kegg.compound:C02806|knapsack:C00001048|lipidmaps:LMPK12113149|metacyc.compound:CPD-14867|pubmed:23063593|pubmed:24081687|pubmed:26297979|pubmed:26676750|pubmed:26923730|pubmed:29029040|pubmed:29653099|pubmed:30899386|pubmed:31075281|pubmed:31356124|pubmed:31436895|pubmed:31724441|pubmed:32746637|wikipedia.en:Herbacetin Graph 3,4',5,7,8-pentahydroxyflavone|3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|8-hydroxykaempferol|herbacetin 3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 3,4',5,7,8-pentahydroxyflavone|3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|8-hydroxykaempferol|herbacetin http://purl.obolibrary.org/obo/CHEBI_27673 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27680 biolink:ChemicalEntity galactomannan A heteroglycan consisting of a mannan backbone with galactose side groups. pubmed:1375195|pubmed:2426444 Graph http://purl.obolibrary.org/obo/CHEBI_27680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27682 biolink:ChemicalEntity 3',5'-cyclic dGMP kegg.compound:C02507 Graph 3',5'-Cyclic dGMP|3',5'-cyclic dGMP 3',5'-Cyclic dGMP|3',5'-cyclic dGMP http://purl.obolibrary.org/obo/CHEBI_27682 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27684 biolink:ChemicalEntity phenylmercury acetate beilstein:3662930|cas:62-38-4|gmelin:83357|kegg.compound:C11151|kegg.drug:D05464|ppdb:2142|umbbd.compound:c0093 Graph Phenylmercury acetate|acetato(phenyl)mercury|phenyl mercuric acetate|phenylmercuric acetate|phenylmercury(II) acetate acetato(phenyl)mercury Phenylmercury acetate|acetato(phenyl)mercury|phenyl mercuric acetate|phenylmercuric acetate|phenylmercury(II) acetate http://purl.obolibrary.org/obo/CHEBI_27684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27689 biolink:ChemicalEntity decanoate A fatty acid anion 10:0 that is the conjugate base of decanoic acid. gmelin:330643|kegg.compound:C01571|metacyc.compound:CPD-3617|reaxys:3538146 Graph 1-nonanecarboxylate|CH3-[CH2]8-COO(-)|caprate|caprinate|caprynate|decanoate|decanoic acid anion|decoate|decylate|n-caprate|n-decanoate|n-decoate|n-decylate|nC9H19CO2 anion decanoate 1-nonanecarboxylate|CH3-[CH2]8-COO(-)|caprate|caprinate|caprynate|decanoate|decanoic acid anion|decoate|decylate|n-caprate|n-decanoate|n-decoate|n-decylate|nC9H19CO2 anion http://purl.obolibrary.org/obo/CHEBI_27689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2769 biolink:ChemicalEntity apigenin 7,4'-dimethyl ether A dimethoxyflavone that is the 7,4'-dimethyl ether derivative of apigenin. cas:5128-44-9|kegg.compound:C10019|knapsack:C00001016|lipidmaps:LMPK12111029|pubmed:16323541|reaxys:295742 Graph 4',7-dimethylapigenin|4,7-dimethoxy-5-hydroxyflavone|5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|Apigenin dimethylether|apigenin 4',7-dimethyl ether|genkwanin 4'-methyl ether 5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one 4',7-dimethylapigenin|4,7-dimethoxy-5-hydroxyflavone|5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one|Apigenin dimethylether|apigenin 4',7-dimethyl ether|genkwanin 4'-methyl ether http://purl.obolibrary.org/obo/CHEBI_2769 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27690 biolink:ChemicalEntity acetazolamide beilstein:212994|cas:59-66-5|drugbank:DB00819|drugcentral:56|gmelin:365421|kegg.compound:C06805|kegg.drug:D00218|lincs.smallmolecule:LSM-5543|patent:US2554816|pdb-ccd:AZM|wikipedia.en:Acetazolamide Graph 2-acetylamino-1,3,4-thiadiazole-5-sulfonamide|5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE|5-acetylamino-1,3,4-thiadiazole-2-sulfonamide|Acetazolamide|Defiltran|Diacarb|Diamox|Diluran|Glaupax|N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide|N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]acetamide|N-[5-(aminosulfonyl)-1,3,5-thiadiazol-2-yl]acetamide|acetazolamida|acetazolamide|acetazolamidum N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide 2-acetylamino-1,3,4-thiadiazole-5-sulfonamide|5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE|5-acetylamino-1,3,4-thiadiazole-2-sulfonamide|Acetazolamide|Defiltran|Diacarb|Diamox|Diluran|Glaupax|N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide|N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]acetamide|N-[5-(aminosulfonyl)-1,3,5-thiadiazol-2-yl]acetamide|acetazolamida|acetazolamide|acetazolamidum http://purl.obolibrary.org/obo/CHEBI_27690 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27691 biolink:ChemicalEntity alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer kegg.compound:C06138|kegg.glycan:G00112|lipidmaps:LMSP0601AW00|pubmed:1371229|pubmed:1567198|pubmed:17130419|pubmed:1724444|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:27485170 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT1a|Ganglioside GT1a|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->3)LacCer|Neu5Acalpha2-8Neu5Acalpha2-3Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1'Cer|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->3GalNAcbeta1->4(Neu5Acalpha2->3)Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT1a|Ganglioside GT1a|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->8Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->3)LacCer|Neu5Acalpha2-8Neu5Acalpha2-3Galbeta1-3GalNAcbeta1-4(Neu5Acalpha2-3)Galbeta1-4Glcbeta1-1'Cer|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->3GalNAcbeta1->4(Neu5Acalpha2->3)Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer http://purl.obolibrary.org/obo/CHEBI_27691 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27692 biolink:ChemicalEntity lipid II An undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl peptide in which the peptide element is L-alanyl-D-γ-glutamyl-L-lysyl-D-alanyl-D-alanine. beilstein:9039417|kegg.compound:C05893|kegg.glycan:G10553 Graph GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)-diphosphoundecaprenol|N-[(2R)-2-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-2-({hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoyl]-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine|Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine|undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine N-[(2R)-2-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-2-({hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoyl]-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)-diphosphoundecaprenol|N-[(2R)-2-{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-2-({hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoyl]-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine|Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine|undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_27692 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27693 biolink:ChemicalEntity sitosterol A member of the class of phytosterols that is stigmast-5-ene substituted by a β-hydroxy group at position 3. beilstein:1916156|cas:83-46-5|drugcentral:2451|kegg.compound:C01753|kegg.drug:D08518|knapsack:C00003672|knapsack:C00023770|lipidmaps:LMST01040129|pubmed:20525330|pubmed:23199991|pubmed:23215694|pubmed:23250922|pubmed:23266618|pubmed:23516045|pubmed:23624268 Graph (-)-beta-Sitosterol|(24R)-Ethylcholest-5-en-3beta-ol|(24R)-Stigmast-5-en-3beta-ol|(3beta)-Stigmast-5-en-3-ol|22,23-Dihydrostigmasterol|24alpha-Ethylcholesterol|Azuprostat|Cupreol|Nimbosterol|Sitosterol|Triastonal|alpha-Dihydrofucosterol|beta-Sitosterin|beta-Sitosterol|sitosterol|stigmast-5-en-3beta-ol stigmast-5-en-3beta-ol (-)-beta-Sitosterol|(24R)-Ethylcholest-5-en-3beta-ol|(24R)-Stigmast-5-en-3beta-ol|(3beta)-Stigmast-5-en-3-ol|22,23-Dihydrostigmasterol|24alpha-Ethylcholesterol|Azuprostat|Cupreol|Nimbosterol|Sitosterol|Triastonal|alpha-Dihydrofucosterol|beta-Sitosterin|beta-Sitosterol|sitosterol|stigmast-5-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_27693 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27698 biolink:ChemicalEntity vanadium atom cas:7440-62-2|kegg.compound:C06267|webelements:V Graph 23V|V|Vanadium|vanadio|vanadium Vanadium|vanadium 23V|V|Vanadium|vanadio|vanadium http://purl.obolibrary.org/obo/CHEBI_27698 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27700 biolink:ChemicalEntity trans-3-enoyl-CoA A 3-enoyl-CoA in which the β C=C double bond has trans stereochemistry. kegg.compound:C05067 Graph trans-3-Enoyl-CoA trans-3-Enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27701 biolink:ChemicalEntity oxytetracycline A tetracycline used for treatment of infections caused by a variety of Gram positive and Gram negative microorganisms including Mycoplasma pneumoniae, Pasteurella pestis, Escherichia coli, Haemophilus influenzae (respiratory infections), and Diplococcus pneumoniae. beilstein:2686362|bpdb:503|cas:79-57-2|drugbank:DB00595|drugcentral:2041|gmelin:623487|hmdb:HMDB0014733|kegg.compound:C06624|knapsack:C00017127|lipidmaps:LMPK07000005|pesticides:oxytetracycline|pubmed:1650428|pubmed:17386724|pubmed:17638695|pubmed:17870541|pubmed:1833366|pubmed:21136283|pubmed:21488905|pubmed:22013404|pubmed:24247133|pubmed:24281679|pubmed:24290103|pubmed:24362004|pubmed:24510709|pubmed:24607684|pubmed:24853528|pubmed:24983832|pubmed:25019386|pubmed:25035320|pubmed:25081007|reaxys:2714587|vsdb:503|wikipedia.en:Oxytetracycline Graph (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|5-Hydroxytetracycline|Oxyterracin|Oxyterracine|Oxytetracyclin|Oxytetracycline (anhydrous)|Oxytetracycline amphoteric|oxitetraciclina|oxytetracyclinum (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|5-Hydroxytetracycline|Oxyterracin|Oxyterracine|Oxytetracyclin|Oxytetracycline (anhydrous)|Oxytetracycline amphoteric|oxitetraciclina|oxytetracyclinum http://purl.obolibrary.org/obo/CHEBI_27701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27705 biolink:ChemicalEntity delta-carotene beilstein:1896231|cas:472-92-4|kegg.compound:C08586|knapsack:C00003766 Graph delta-carotene|epsilon,psi-carotene epsilon,psi-carotene delta-carotene|epsilon,psi-carotene http://purl.obolibrary.org/obo/CHEBI_27705 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27707 biolink:ChemicalEntity beta-D-Galp-(1->3)-D-GlcpNAc An amino disaccharide consisting of β-D-galactose linked via a (1→3)-glycosidic bond to N-acetyl-D-glucosamine. beilstein:1356092|glygen:G04616ST|glytoucan:G04616ST|kegg.compound:C06372|kegg.glycan:G00284|patent:US2010120096|pubmed:10328550|pubmed:1373551|pubmed:17690443|pubmed:18723650|pubmed:19124470|pubmed:1933953|pubmed:19420691|pubmed:19850285|pubmed:19854932|pubmed:19913595|pubmed:20830443|pubmed:21154671|pubmed:2432147|pubmed:2457603|pubmed:2458640|pubmed:2470785|pubmed:24942885|pubmed:26477523|pubmed:4112563|pubmed:7696864|reaxys:1356092 Graph 2-acetamido-2-deoxy-3-O-beta-D-galactopyranosyl-D-glucopyranose|Galbeta1,3GlcNAc|Galbeta1-3GlcNAc|Lacto-N-biose|beta-D-Gal-(1->3)-D-GlcNAc|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranose|beta-D-galactosyl-(1->3)-N-acetyl-D-glucosamine|beta-D-galactsyl-(1->3)-N-acetyl-D-glucosamine|betaGal1->3DGlcNAc beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranose 2-acetamido-2-deoxy-3-O-beta-D-galactopyranosyl-D-glucopyranose|Galbeta1,3GlcNAc|Galbeta1-3GlcNAc|Lacto-N-biose|beta-D-Gal-(1->3)-D-GlcNAc|beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-D-glucopyranose|beta-D-galactosyl-(1->3)-N-acetyl-D-glucosamine|beta-D-galactsyl-(1->3)-N-acetyl-D-glucosamine|betaGal1->3DGlcNAc http://purl.obolibrary.org/obo/CHEBI_27707 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27708 biolink:ChemicalEntity diethyl hydrogen phosphate A dialkyl phosphate having ethyl as the alkyl group. cas:598-02-7|hmdb:HMDB0012209|kegg.compound:C06608|pdb-ccd:DPF|pubmed:17590257|pubmed:20494630|pubmed:22251442|pubmed:23522525|reaxys:1704113|umbbd.compound:c0087 Graph Diethylphosphate|Diethylphosphoric acid|O,O-Diethylphosphoric acid|diethyl hydrogen phosphate diethyl hydrogen phosphate Diethylphosphate|Diethylphosphoric acid|O,O-Diethylphosphoric acid|diethyl hydrogen phosphate http://purl.obolibrary.org/obo/CHEBI_27708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27711 biolink:ChemicalEntity precorrin-3B The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which three methyl groups have been introduced at positions 2, 7 and 20 of the tetrapyrrole framework and in which the carboxymethyl group at position 2 has been oxidised to form a lactone ring. beilstein:6365776|kegg.compound:C06406 Graph 3,3',3'',3'''-(7S,8S,12S,13S,14R,15S)-2,7,12,18-tetrakis(2-carboxyethyl)-3,8,17-tris(carboxymethyl)-15-hydroxy-8,13,15-trimethyl-7,8,12,13,14,15,20,24-octahydroporphyrin-13(1),14-carbolactone|Precorrin 3B 3,3',3'',3'''-(7S,8S,12S,13S,14R,15S)-2,7,12,18-tetrakis(2-carboxyethyl)-3,8,17-tris(carboxymethyl)-15-hydroxy-8,13,15-trimethyl-7,8,12,13,14,15,20,24-octahydroporphyrin-13(1),14-carbolactone 3,3',3'',3'''-(7S,8S,12S,13S,14R,15S)-2,7,12,18-tetrakis(2-carboxyethyl)-3,8,17-tris(carboxymethyl)-15-hydroxy-8,13,15-trimethyl-7,8,12,13,14,15,20,24-octahydroporphyrin-13(1),14-carbolactone|Precorrin 3B http://purl.obolibrary.org/obo/CHEBI_27711 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27713 biolink:ChemicalEntity (5S)-5-amino-3-oxohexanoic acid kegg.compound:C03656|lipidmaps:LMFA01060173|pdb-ccd:KMH Graph (5S)-5-amino-3-oxohexanoic acid|(S)-5-Amino-3-oxohexanoate|(S)-5-amino-3-oxohexanoate (5S)-5-amino-3-oxohexanoic acid (5S)-5-amino-3-oxohexanoic acid|(S)-5-Amino-3-oxohexanoate|(S)-5-amino-3-oxohexanoate http://purl.obolibrary.org/obo/CHEBI_27713 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27714 biolink:ChemicalEntity 6-acetyl-2-amino-3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one A member of the class of pyrimidodiazepine 3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one bearing amino and acetyl substituents at positions 2 and 6 respectively. cas:80003-63-0|metacyc.compound:A-PYRIMIDODIAZEPINE|pubmed:16712527|pubmed:2775176|pubmed:7171579|reaxys:4191851 Graph 2-Amino-4-oxo-6-acetyl-7,8-dihydro-3H,9H-pyrimidodiazepine|2-amino-6-acetyl-3,7,8,9-tetrahydro-3H-pyrimido(4,5-b)[1,4]diazepin-4-one|6-Acetyldihydrohomopterin|6-Acetylhomopterin|6-acetyl-2-amino-3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one 6-acetyl-2-amino-3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one 2-Amino-4-oxo-6-acetyl-7,8-dihydro-3H,9H-pyrimidodiazepine|2-amino-6-acetyl-3,7,8,9-tetrahydro-3H-pyrimido(4,5-b)[1,4]diazepin-4-one|6-Acetyldihydrohomopterin|6-Acetylhomopterin|6-acetyl-2-amino-3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one http://purl.obolibrary.org/obo/CHEBI_27714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27715 biolink:ChemicalEntity 3-chlorocatechol A chlorocatechol that is catechol in which the hydrogen adjacent to one of the hydroxy groups is replaced by a chlorine. beilstein:1936442|cas:4018-65-9|gmelin:601665|kegg.compound:C05618|umbbd.compound:c0144 Graph 3-Chlorocatechol|3-chlorobenzene-1,2-diol|3-chlorocatechol|3-chloropyrocatechol 3-chlorobenzene-1,2-diol 3-Chlorocatechol|3-chlorobenzene-1,2-diol|3-chlorocatechol|3-chloropyrocatechol http://purl.obolibrary.org/obo/CHEBI_27715 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27717 biolink:ChemicalEntity gibberellin A1 A C19-gibberellin, initially identified in Gibberella fujikuroi. cas:545-97-1|kegg.compound:C00859|knapsack:C00000001|lipidmaps:LMPR0104170001|metacyc.compound:CPD1F-139|pubmed:24100624|pubmed:24232845|pubmed:24281950|reaxys:96530 Graph (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|2beta,7alpha-dihydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid|GA1|Gibberellin 1|Gibberellin A1 (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|2beta,7alpha-dihydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|2beta,7alpha-dihydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid|GA1|Gibberellin 1|Gibberellin A1 http://purl.obolibrary.org/obo/CHEBI_27717 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27721 biolink:ChemicalEntity trans-tetradec-2-enoyl-CoA kegg.compound:C05273 Graph (2E)-Tetradecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-tetradec-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|trans-Tetradec-2-enoyl-CoA|trans-tetradec-2-enoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-tetradec-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} (2E)-Tetradecenoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(2E)-tetradec-2-enoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}|trans-Tetradec-2-enoyl-CoA|trans-tetradec-2-enoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27721 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27726 biolink:ChemicalEntity 6-chloro-1,3,5-triazine-2,4-diamine beilstein:124340|cas:3397-62-4|kegg.compound:C06560|umbbd.compound:c0170 Graph 2,4-diamino-6-chloro-1,3,5-triazine|2,4-diamino-6-chloro-s-triazine|2-chloro-4,6-diamino-s-triazine|2-chloro-4,6-diaminotriazine|6-chloro-1,3,5-triazine-2,4-diamine|Deisopropyldeethylatrazine 6-chloro-1,3,5-triazine-2,4-diamine 2,4-diamino-6-chloro-1,3,5-triazine|2,4-diamino-6-chloro-s-triazine|2-chloro-4,6-diamino-s-triazine|2-chloro-4,6-diaminotriazine|6-chloro-1,3,5-triazine-2,4-diamine|Deisopropyldeethylatrazine http://purl.obolibrary.org/obo/CHEBI_27726 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27727 biolink:ChemicalEntity androstane-3,17-diol beilstein:9220448|cas:25126-76-5|kegg.compound:C07632 Graph Androstane-3,17-diol|Androstanediol|androstane-3,17-diol Androstane-3,17-diol|androstane-3,17-diol Androstane-3,17-diol|Androstanediol|androstane-3,17-diol http://purl.obolibrary.org/obo/CHEBI_27727 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27730 biolink:ChemicalEntity D-isoleucine The D-enantiomer of isoleucine. cas:319-78-8|gmelin:278733|kegg.compound:C06418|patent:US2011059503|patent:US7741540|pdb-ccd:DIL|pubmed:24312553|pubmed:24966047|pubmed:3289762|pubmed:4150713|pubmed:57739|reaxys:1721793|ymdb:YMDB00853 Graph (2R,3R)-2-Amino-3-methylvaleric acid|(2R,3R)-2-amino-3-methylpentanoic acid|(R)-2-Amino-(S)-3-methylvaleric acid|D-ISOLEUCINE|D-Isoleucine|D-isoleucine|DIL D-ISOLEUCINE|D-Isoleucine|D-isoleucine (2R,3R)-2-Amino-3-methylvaleric acid|(2R,3R)-2-amino-3-methylpentanoic acid|(R)-2-Amino-(S)-3-methylvaleric acid|D-ISOLEUCINE|D-Isoleucine|D-isoleucine|DIL http://purl.obolibrary.org/obo/CHEBI_27730 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27731 biolink:ChemicalEntity N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide A glycotriaosylceramide having N-acetyl-β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-β-D-glucosyl as the triaosyl component. kegg.compound:C06135|kegg.glycan:G00123|pubmed:10497228|pubmed:10497993|pubmed:16341241|pubmed:1724444|pubmed:2430018|pubmed:2448252|pubmed:490046|pubmed:512581|pubmed:6802814|pubmed:7691279|pubmed:7691804|pubmed:7961890|pubmed:9972878 Graph (Gal)1 (GalNAc)1 (Glc)1 (Cer)1|Asialo GM2-re-N-acetylated|GA2|GalNAc-beta1->4Gal-beta1->4Glc-beta1->1'Cer|GalNAc-beta1->4LacCer|GgOSe3Cer|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-beta-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|a ganglioside GA2 (d18:1(4E))|asialo GM2|asialoganglioside GM2|beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide (Gal)1 (GalNAc)1 (Glc)1 (Cer)1|Asialo GM2-re-N-acetylated|GA2|GalNAc-beta1->4Gal-beta1->4Glc-beta1->1'Cer|GalNAc-beta1->4LacCer|GgOSe3Cer|N-[(2S,3R,4E)-1-{[2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|N-acetyl-beta-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides|a ganglioside GA2 (d18:1(4E))|asialo GM2|asialoganglioside GM2|beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer|beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer http://purl.obolibrary.org/obo/CHEBI_27731 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27732 biolink:ChemicalEntity caffeine A trimethylxanthine in which the three methyl groups are located at positions 1, 3, and 7. A purine alkaloid that occurs naturally in tea and coffee. cas:58-08-2|drugbank:DB00201|drugcentral:463|gmelin:103040|hmdb:HMDB0001847|kegg.compound:C07481|kegg.drug:D00528|knapsack:C00001492|lincs.smallmolecule:LSM-2026|metacyc.compound:1-3-7-TRIMETHYLXANTHINE|pdb-ccd:CFF|pubmed:10510174|pubmed:10796597|pubmed:10803761|pubmed:10822912|pubmed:10884512|pubmed:10924888|pubmed:10983026|pubmed:11014293|pubmed:11022879|pubmed:11209966|pubmed:11312039|pubmed:11410911|pubmed:11431501|pubmed:11815511|pubmed:11949272|pubmed:12397877|pubmed:12457274|pubmed:12574990|pubmed:12915014|pubmed:12943586|pubmed:14521986|pubmed:14607010|pubmed:15257305|pubmed:15280431|pubmed:15681408|pubmed:15718055|pubmed:15840517|pubmed:16143823|pubmed:16391865|pubmed:16528931|pubmed:16644114|pubmed:16709440|pubmed:16805851|pubmed:16856769|pubmed:17132260|pubmed:17387608|pubmed:17508167|pubmed:17724925|pubmed:17932622|pubmed:17957400|pubmed:18068204|pubmed:18258404|pubmed:18421070|pubmed:18513215|pubmed:18625110|pubmed:18647558|pubmed:19007524|pubmed:19047957|pubmed:19084078|pubmed:19088793|pubmed:19418355|pubmed:19879252|pubmed:20164568|pubmed:20470411|pubmed:22114686|pubmed:22770225|pubmed:23551936|pubmed:24039592|pubmed:7441110|pubmed:7689104|pubmed:8332255|pubmed:8347173|pubmed:8679661|pubmed:9063686|pubmed:9067318|pubmed:9132918|pubmed:9218278|reaxys:17705|wikipedia.en:Caffeine Graph 1,3,7-Trimethylxanthine|1,3,7-trimethyl-2,6-dioxopurine|1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione|1,3,7-trimethylpurine-2,6-dione|1,3,7-trimethylxanthine|1-methyltheobromine|3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion|7-methyltheophylline|CAFFEINE|Caffeine|Coffein|Koffein|Thein|anhydrous caffeine|cafeina|cafeine|caffeine|guaranine|mateina|methyltheobromine|teina|theine 1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione 1,3,7-Trimethylxanthine|1,3,7-trimethyl-2,6-dioxopurine|1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione|1,3,7-trimethylpurine-2,6-dione|1,3,7-trimethylxanthine|1-methyltheobromine|3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion|7-methyltheophylline|CAFFEINE|Caffeine|Coffein|Koffein|Thein|anhydrous caffeine|cafeina|cafeine|caffeine|guaranine|mateina|methyltheobromine|teina|theine http://purl.obolibrary.org/obo/CHEBI_27732 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27735 biolink:ChemicalEntity 5-[(5-phospho-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-phospho-beta-D-ribosyl)imidazole-4-carboxamide kegg.compound:C04916|pdb-ccd:2ER|pubmed:12795595 Graph 5-[(5-O-phosphono-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamide|5-[(5-Phospho-1-deoxyribulos-1-ylamino)methylideneamino]-1-(5-phosphoribosyl)imidazole-4-carboxamide|N(1)-(5'-phosphoribulosyl)-formimino-5-aminoimidazole-4-carboxamide ribonucleotide|N-(5'-Phospho-D-1'-ribulosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4-imidazolecarboxamide|PRFAR|Phosphoribulosyl-formimino-AICAR-phosphate 5-[(5-O-phosphono-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamide 5-[(5-O-phosphono-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-O-phosphono-beta-D-ribosyl)imidazole-4-carboxamide|5-[(5-Phospho-1-deoxyribulos-1-ylamino)methylideneamino]-1-(5-phosphoribosyl)imidazole-4-carboxamide|N(1)-(5'-phosphoribulosyl)-formimino-5-aminoimidazole-4-carboxamide ribonucleotide|N-(5'-Phospho-D-1'-ribulosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4-imidazolecarboxamide|PRFAR|Phosphoribulosyl-formimino-AICAR-phosphate http://purl.obolibrary.org/obo/CHEBI_27735 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27740 biolink:ChemicalEntity gamma-carotene A cyclic carotene obtained by the cyclisation of lycopene. cas:472-93-5|kegg.compound:C05435|knapsack:C00000926|lipidmaps:LMPR01070260|metacyc.compound:CPD1F-126|pubmed:13114888|pubmed:14817276|pubmed:17992006|pubmed:23412054|pubmed:4784609|reaxys:2066713|wikipedia.en:Gamma-carotene Graph Gamma-carotene|beta,psi-carotene|gamma-Carotene beta,psi-carotene Gamma-carotene|beta,psi-carotene|gamma-Carotene http://purl.obolibrary.org/obo/CHEBI_27740 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27741 biolink:ChemicalEntity 3'-hydroxyflavonoid Any hydroxyflavone with a hydroxy substituent at position 3'. kegg.compound:C02790 Graph 3'-Hydroxyflavonoid|3'-hydroxyflavones|3'-hydroxyflavonoids|a 3'-hydroxyflavone 3'-Hydroxyflavonoid|3'-hydroxyflavones|3'-hydroxyflavonoids|a 3'-hydroxyflavone http://purl.obolibrary.org/obo/CHEBI_27741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27742 biolink:ChemicalEntity gibberellin A20 A C19-gibberellin that is a pentacyclic diterpenoid responsible for promoting growth and development. Initially identified in Gibberella fujikuroi, it differs from gibberellin A1 in lacking an OH group at C-2 (gibbane numbering). cas:19143-87-4|kegg.compound:C02035|knapsack:C00000020|lipidmaps:LMPR0104170004|pubmed:24100624|pubmed:24232845|pubmed:24458818|pubmed:24858937|reaxys:8732051 Graph (1R,2R,5S,8S,9S,10R,11R)-5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|7alpha-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid|GA20|Gibberellin 20|Gibberellin A20 (1R,2R,5S,8S,9S,10R,11R)-5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|7alpha-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid (1R,2R,5S,8S,9S,10R,11R)-5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid|7alpha-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid|GA20|Gibberellin 20|Gibberellin A20 http://purl.obolibrary.org/obo/CHEBI_27742 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27744 biolink:ChemicalEntity glyphosate A phosphonic acid resulting from the formal oxidative coupling of the methyl group of methylphosphonic acid with the amino group of glycine. It is one of the most commonly used herbicides worldwide, and the only one to target the enzyme 5-enolpyruvyl-3-shikimate phosphate synthase (EPSPS). beilstein:2045054|cas:1071-83-6|drugbank:DB04539|gmelin:279222|kegg.compound:C01705|pdb-ccd:GPF|pdb-ccd:GPJ|pesticides:glyphosate|ppdb:373|pubmed:27758090|pubmed:28266132|pubmed:28474816|pubmed:28643882|pubmed:28711546|pubmed:30471482|pubmed:30875550|pubmed:31030151|pubmed:31342895|umbbd.compound:c0134|wikipedia.en:Glyphosate Graph Glyphosate|N-(phosphonomethyl)glycine|Roundup N-(phosphonomethyl)glycine Glyphosate|N-(phosphonomethyl)glycine|Roundup http://purl.obolibrary.org/obo/CHEBI_27744 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27747 biolink:ChemicalEntity L-homoarginine An L-lysine derivative that is the L-enantiomer of homoarginine. cas:156-86-5|drugbank:DB03974|hmdb:HMDB0000670|kegg.compound:C01924|knapsack:C00001364|pdb-ccd:HRG|pubmed:12768501|pubmed:18802314|pubmed:21737361|pubmed:25153574|pubmed:25474016|pubmed:25618752|pubmed:25647833|pubmed:25746168|pubmed:25792110|pubmed:25820767|pubmed:25828044|pubmed:25832546|pubmed:25894888|pubmed:25957527|pubmed:26031828|pubmed:26055922|pubmed:26077714|pubmed:26210755|pubmed:26562034|pubmed:26573540|pubmed:26676627|pubmed:6174211|pubmed:6186121|pubmed:6191705|pubmed:7518015|reaxys:1726127 Graph Homo-L-arginine|Homoarginine|L-N(6)-amidinolysine|N(6)-carbamimidoyl-L-lysine|N6-(Aminoiminomethyl)-L-lysine|N6-amidino-L-Lysine|N6-amidino-Lysine N(6)-carbamimidoyl-L-lysine Homo-L-arginine|Homoarginine|L-N(6)-amidinolysine|N(6)-carbamimidoyl-L-lysine|N6-(Aminoiminomethyl)-L-lysine|N6-amidino-L-Lysine|N6-amidino-Lysine http://purl.obolibrary.org/obo/CHEBI_27747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27748 biolink:ChemicalEntity D-ribosylnicotinic acid A pyridine nucleoside consisting of nicotinic acid with a β-D-ribofuranosyl moiety at the 1-position. kegg.compound:C05841|reaxys:7043166 Graph 3-carboxy-1-(D-ribofuranosyl)pyridinium|Nicotinate D-ribonucleoside|nicotinic acid riboside 3-carboxy-1-(D-ribofuranosyl)pyridinium 3-carboxy-1-(D-ribofuranosyl)pyridinium|Nicotinate D-ribonucleoside|nicotinic acid riboside http://purl.obolibrary.org/obo/CHEBI_27748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27750 biolink:ChemicalEntity ethyl acetate The acetate ester formed between acetic acid and ethanol. cas:141-78-6|gmelin:26306|hmdb:HMDB0031217|kegg.compound:C00849|kegg.compound:C01883|kegg.drug:D02319|knapsack:C00001308|pdb-ccd:EEE|pubmed:11684179|pubmed:15497757|pubmed:21764274|pubmed:21797203|pubmed:23078109|pubmed:23089728|pubmed:23108979|pubmed:23351147|pubmed:23614288|reaxys:506104|umbbd.compound:c0036|wikipedia.en:Ethyl_acetate Graph 1-acetoxyethane|AcOEt|Acetyl ester|CH3-CO-O-CH3|ETHYL ACETATE|Essigester|Essigsaeureethylester|EtOAc|Ethyl acetate|Ethylacetat|Ethylazetat|acetic acid ethyl ester|acetic acid, ethyl ester|acetic ester|acetoxyethane|ethyl acetate|ethyl acetic ester|ethyl ethanoate|vinegar naphtha ETHYL ACETATE|Ethyl acetate|ethyl acetate 1-acetoxyethane|AcOEt|Acetyl ester|CH3-CO-O-CH3|ETHYL ACETATE|Essigester|Essigsaeureethylester|EtOAc|Ethyl acetate|Ethylacetat|Ethylazetat|acetic acid ethyl ester|acetic acid, ethyl ester|acetic ester|acetoxyethane|ethyl acetate|ethyl acetic ester|ethyl ethanoate|vinegar naphtha http://purl.obolibrary.org/obo/CHEBI_27750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27754 biolink:ChemicalEntity methacrylyl-CoA An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of methacrylic acid. cas:6008-91-9|drugbank:DB01675|kegg.compound:C03460|metacyc.compound:METHACRYLYL-COA|pdb-ccd:2MC|pubmed:10989419|pubmed:11580916|reaxys:78213 Graph 2-Methylprop-2-enoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|Methacrylyl-CoA|Methacrylyl-coenzyme A|Methylacrylyl-CoA|S-methacryloyl-CoA|S-methacryloyl-coenzyme-A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate} 2-Methylprop-2-enoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylprop-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}|Methacrylyl-CoA|Methacrylyl-coenzyme A|Methylacrylyl-CoA|S-methacryloyl-CoA|S-methacryloyl-coenzyme-A http://purl.obolibrary.org/obo/CHEBI_27754 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27757 biolink:ChemicalEntity 4-chlorobiphenyl A monochlorobiphenyl carrying a chloro substituent at position 4. cas:2051-62-9|gmelin:131583|kegg.compound:C06584|pubmed:23137097|pubmed:23250224|pubmed:24007621|reaxys:774966|umbbd.compound:c0177 Graph 1-Chloro-4-phenyl benzene|4-Chlorbiphenyl|4-Chlorobiphenyl|4-Monochloro-biphenyl|4-chloro-1,1'-biphenyl|4-chlorodiphenyl|p-chlorobiphenyl|p-chlorodiphenyl 4-chloro-1,1'-biphenyl 1-Chloro-4-phenyl benzene|4-Chlorbiphenyl|4-Chlorobiphenyl|4-Monochloro-biphenyl|4-chloro-1,1'-biphenyl|4-chlorodiphenyl|p-chlorobiphenyl|p-chlorodiphenyl http://purl.obolibrary.org/obo/CHEBI_27757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27760 biolink:ChemicalEntity L-selenocystathionine An optically active form of selenocystathionine in which both amino acid residues have L-configuration. kegg.compound:C05699|pubmed:20387001|reaxys:2371675 Graph (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]selanyl}butanoic acid|L,L-selenocystathionine (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]selanyl}butanoic acid (2S)-2-amino-4-{[(2R)-2-amino-2-carboxyethyl]selanyl}butanoic acid|L,L-selenocystathionine http://purl.obolibrary.org/obo/CHEBI_27760 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27761 biolink:ChemicalEntity (S)-prunasin agr:IND43728879|beilstein:91508|cas:99-18-3|cas:99-19-4|foodb.food:FDB013582|hmdb:HMDB0034981|kegg.compound:C00844|kegg.compound:C04273|knapsack:C00001454|metacyc.compound:CPD-20541|pubmed:10854744|pubmed:32688921 Graph (2S)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(2S)-sambunigrin|(S)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(S)-Mandelonitrile beta-D-glucoside|(S)-O-beta-D-glucopyranosylmandelonitrile|(S)-mandelonitrile beta-D-glucoside|(S)-sambunigrin|L-prunasin|sambunigrin (2S)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile (2S)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(2S)-sambunigrin|(S)-(beta-D-glucopyranosyloxy)(phenyl)acetonitrile|(S)-Mandelonitrile beta-D-glucoside|(S)-O-beta-D-glucopyranosylmandelonitrile|(S)-mandelonitrile beta-D-glucoside|(S)-sambunigrin|L-prunasin|sambunigrin http://purl.obolibrary.org/obo/CHEBI_27761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27762 biolink:ChemicalEntity 3-hydroxypropanoyl-CoA kegg.compound:C05668 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxypropanoyl coenzymeA|3-Hydroxypropanoyl-CoA|3-Hydroxypropionyl coenzyme A|3-Hydroxypropionyl-CoA|beta-Hydroxypropionyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(3-hydroxypropanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxypropanoyl coenzymeA|3-Hydroxypropanoyl-CoA|3-Hydroxypropionyl coenzyme A|3-Hydroxypropionyl-CoA|beta-Hydroxypropionyl-CoA http://purl.obolibrary.org/obo/CHEBI_27762 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27767 biolink:ChemicalEntity 3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone A dimethoxyflavone that is the 3,7-di-O-methyl derivative of quercetagetin. kegg.compound:C04581|knapsack:C00004685|lipidmaps:LMPK12112991|metacyc.compound:CPD-10527|reaxys:1440997 Graph 2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-3,7-dimethoxy-4H-chromen-4-one|3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone|3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone|3,7-dimethylquercetagetin|tomentin 2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-3,7-dimethoxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-3,7-dimethoxy-4H-chromen-4-one|3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone|3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone|3,7-dimethylquercetagetin|tomentin http://purl.obolibrary.org/obo/CHEBI_27767 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27773 biolink:ChemicalEntity cis-3-enoyl-CoA A 3-enoyl-CoA in which the β C=C double bond has cis stereochemistry. kegg.compound:C05057 Graph cis-3-Enoyl-CoA cis-3-Enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27773 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27775 biolink:ChemicalEntity P(1),P(3)-bis(5'-adenosyl) triphosphate A diadenosyl triphosphate having the two 5'-adenosyl residues attached at the P1- and P3-positions. beilstein:603878|cas:56432-02-1|cas:5959-90-0|kegg.compound:C06197|pdb-ccd:BA3 Graph 5'Ap3A|A(5')p3(5')A|Adenosine 5'-triphosphate 5'-adenosine|Adenosine(3)triphosphate adenosine|Ap3A|ApppA|Diadenosine triphosphate|P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate|P1,P3-Bis(5'-adenosyl) triphosphate|adenosine(5')triphospho(5')adenosine P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate 5'Ap3A|A(5')p3(5')A|Adenosine 5'-triphosphate 5'-adenosine|Adenosine(3)triphosphate adenosine|Ap3A|ApppA|Diadenosine triphosphate|P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate|P1,P3-Bis(5'-adenosyl) triphosphate|adenosine(5')triphospho(5')adenosine http://purl.obolibrary.org/obo/CHEBI_27775 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27777 biolink:ChemicalEntity acetohydroxamic acid A member of the class of acetohydroxamic acids that is acetamide in which one of the amino hydrogens has been replaced by a hydroxy group. beilstein:1739019|cas:546-88-3|drugbank:DB00551|drugcentral:58|kegg.compound:C06808|kegg.drug:D00220|pdb-ccd:HAE|wikipedia.en:Acetohydroxamic_Acid Graph ACETOHYDROXAMIC ACID|AHA|Acethydroxamsaeure|Acethydroxamsaure|Acetic acid, oxime|Acetohydroxamic acid|Acetylhydroxamic acid|Cetohyroxamic acid|Lithostat|Methylhydroxamic acid|N-Acetyl hydroxyacetamide|N-Acetylhydroxylamine|N-Hydroxyacetamide|N-hydroxyacetamide|acetohydroxamic acid|acide acetohydroxamique|acido acetohidroxamico|acidum acetohydroxamicum N-hydroxyacetamide ACETOHYDROXAMIC ACID|AHA|Acethydroxamsaeure|Acethydroxamsaure|Acetic acid, oxime|Acetohydroxamic acid|Acetylhydroxamic acid|Cetohyroxamic acid|Lithostat|Methylhydroxamic acid|N-Acetyl hydroxyacetamide|N-Acetylhydroxylamine|N-Hydroxyacetamide|N-hydroxyacetamide|acetohydroxamic acid|acide acetohydroxamique|acido acetohidroxamico|acidum acetohydroxamicum http://purl.obolibrary.org/obo/CHEBI_27777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27779 biolink:ChemicalEntity griseofulvin An oxaspiro compound produced by Penicillium griseofulvum. It is used by mouth as an antifungal drug for infections involving the scalp, hair, nails and skin that do not respond to topical treatment. cas:126-07-8|drugbank:DB00400|drugcentral:1331|kegg.compound:C06686|kegg.drug:D00209|knapsack:C00002398|lincs.smallmolecule:LSM-5259|lipidmaps:LMPK13060001|metacyc.compound:CPD-17786|patent:US3069328|patent:US3069329|ppdb:1807|pubmed:14407521|pubmed:15078340|pubmed:16922553|pubmed:23111828|pubmed:25476923|pubmed:3277037|reaxys:95226|vsdb:1807|wikipedia.en:Griseofulvin Graph (+)-griseofulvin|(2S,6'R)-7-chloro-2',4,6-trimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione|Curling factor|Fulcin|Fulvicin|Grifulvin|Grisactin|Griseofulvin|Grisovin|Grysio|Lamoryl|Likuden|Poncyl|Spirofulvin|Sporostatin|amudane|griseofulvin|griseofulvina|griseofulvine|griseofulvinum (2S,6'R)-7-chloro-2',4,6-trimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione (+)-griseofulvin|(2S,6'R)-7-chloro-2',4,6-trimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione|Curling factor|Fulcin|Fulvicin|Grifulvin|Grisactin|Griseofulvin|Grisovin|Grysio|Lamoryl|Likuden|Poncyl|Spirofulvin|Sporostatin|amudane|griseofulvin|griseofulvina|griseofulvine|griseofulvinum http://purl.obolibrary.org/obo/CHEBI_27779 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27780 biolink:ChemicalEntity detergent A surfactant (or a mixture containing one or more surfactants) having cleaning properties in dilute solutions. kegg.compound:C01689 Graph Detergents|detergent detergent Detergents|detergent http://purl.obolibrary.org/obo/CHEBI_27780 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27784 biolink:ChemicalEntity gentamycin C1a cas:26098-04-4|drugbank:DB04729|kegg.compound:C00908 Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside|Gentamicin C1a|Gentamycin C12|O-3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6)-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4))-2-deoxy-D-streptamine (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside|Gentamicin C1a|Gentamycin C12|O-3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6)-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4))-2-deoxy-D-streptamine http://purl.obolibrary.org/obo/CHEBI_27784 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27786 biolink:ChemicalEntity hydroxocobalamin cas:13422-51-0|chemspider:28534326|drugbank:DB00200|foodb.food:FDB003166|gmelin:5723|hmdb:HMDB0002308|kegg.compound:C08230|kegg.drug:D01027|knapsack:C00050467|metacyc.compound:CPD0-1256|pubmed:11830394|pubmed:15815367|pubmed:20352539|pubmed:31000316|pubmed:31864779|pubmed:32718732|pubmed:32815652|pubmed:33005568|pubmed:33224611|pubmed:33246585|pubmed:33283331|pubmed:33444605|pubmed:33692053|pubmed:33754111|pubmed:33912838|pubmed:34023033|pubmed:34176677|pubmed:7802338|pubmed:8012169|pubmed:8440794|pubmed:8857117|pubmed:9102519|wikipedia.en:Hydroxocobalamin Graph AlphaRedisol|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-hydroxocobamide|Cyanokit|Hydroxycobalamin|OH-Cbl|hidroxocobalamina|hydroxocobalamin|hydroxocobalamine|hydroxocobalaminum|vitamin B-12b Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-hydroxocobamide AlphaRedisol|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-hydroxocobamide|Cyanokit|Hydroxycobalamin|OH-Cbl|hidroxocobalamina|hydroxocobalamin|hydroxocobalamine|hydroxocobalaminum|vitamin B-12b http://purl.obolibrary.org/obo/CHEBI_27786 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27787 biolink:ChemicalEntity 15-cis-phytoene beilstein:1717506|kegg.compound:C05421|knapsack:C00000905|lipidmaps:LMPR01070255|wikipedia.en:Phytoene Graph (6E,10E,14E,16Z,18E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene|15-cis-7,8,11,12,7',8',11',12'-octahydro-psi,psi-carotene|15-cis-phytoene|cis-phytoene 15-cis-7,8,11,12,7',8',11',12'-octahydro-psi,psi-carotene (6E,10E,14E,16Z,18E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene|15-cis-7,8,11,12,7',8',11',12'-octahydro-psi,psi-carotene|15-cis-phytoene|cis-phytoene http://purl.obolibrary.org/obo/CHEBI_27787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27789 biolink:ChemicalEntity 1,2-dichloroethane A member of the class of chloroethanes substituted by two chloro groups at positions 1 and 2. cas:107-06-2|drugbank:DB03733|gmelin:49272|hmdb:HMDB0029571|kegg.compound:C06752|metacyc.compound:12-DICHLOROETHANE|pdb-ccd:DCE|ppdb:2774|pubmed:17564600|pubmed:18579268|pubmed:24228488|pubmed:24329990|pubmed:24441515|pubmed:31520740|pubmed:32830330|pubmed:33047531|reaxys:605264|umbbd.compound:c0001|wikipedia.en:1,2-Dichloroethane Graph 1,2-DCE|1,2-DICHLOROETHANE|1,2-Dichloraethan|1,2-Dichloroethane|1,2-dichloroethane|Aethylenchlorid|Aethylendichlorid|DCE|Dutch liquid|EDC|Ethylene dichloride|Glycol dichloride|alpha,beta-dichloroethane|ethane dichloride|ethylene chloride 1,2-DICHLOROETHANE|1,2-Dichloroethane|1,2-dichloroethane 1,2-DCE|1,2-DICHLOROETHANE|1,2-Dichloraethan|1,2-Dichloroethane|1,2-dichloroethane|Aethylenchlorid|Aethylendichlorid|DCE|Dutch liquid|EDC|Ethylene dichloride|Glycol dichloride|alpha,beta-dichloroethane|ethane dichloride|ethylene chloride http://purl.obolibrary.org/obo/CHEBI_27789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27791 biolink:ChemicalEntity P(1),P(4)-bis(uridin-5'-yl) tetraphosphate A pyrimidine ribonucleoside 5'-tetraphosphate compound having 5'-uridinyl residues at the P1- and P4-positions. beilstein:10232670|cas:59985-21-6|drugcentral:4900|kegg.compound:C06198 Graph Diquafosol|P1,P4-Bis(5'-uridyl) tetrahydrogen tetraphosphate Diquafosol|P1,P4-Bis(5'-uridyl) tetrahydrogen tetraphosphate http://purl.obolibrary.org/obo/CHEBI_27791 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27794 biolink:ChemicalEntity isoferulic acid A ferulic acid consisting of trans-cinnamic acid bearing methoxy and hydroxy substituents at positions 4 and 3 respectively on the phenyl ring. cas:537-73-5|drugbank:DB07109|hmdb:HMDB0000955|kegg.compound:C10470|knapsack:C00002752|pdb-ccd:4FE|pubmed:18314290|pubmed:21937734|pubmed:21941899|pubmed:22770225|reaxys:2212760 Graph (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid|3-Hydroxy-4-methoxycinnamic acid|Hesperetic acid (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid (2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid|3-Hydroxy-4-methoxycinnamic acid|Hesperetic acid http://purl.obolibrary.org/obo/CHEBI_27794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27795 biolink:ChemicalEntity beta-erythroidine An organic heterotetracyclic indole alkaloid isolated from the seeds and other parts of Erythrina species. It differs from the α isomer in having the double bond of the dihydropyranone ring located β,γ- to the lactone carbonyl group instead of α,β-. cas:466-81-9|kegg.compound:C06532|knapsack:C00001854|patent:US2373952|patent:US2385266|patent:US2407713|pubmed:15437298|pubmed:16550620|pubmed:16898793|pubmed:21018227|reaxys:36194 Graph (+)-beta-erythroidine|(4bS,6R)-6-methoxy-1,4,6,10,12,13-hexahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one|12,13-didehydro-13,14-dihydro-alpha-erythroidine (4bS,6R)-6-methoxy-1,4,6,10,12,13-hexahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one (+)-beta-erythroidine|(4bS,6R)-6-methoxy-1,4,6,10,12,13-hexahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one|12,13-didehydro-13,14-dihydro-alpha-erythroidine http://purl.obolibrary.org/obo/CHEBI_27795 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27796 biolink:ChemicalEntity trimethobenzamide The amide obtained by formal condensation of 3,4,5-trihydroxybenzoic acid with 4-[2-(N,N-dimethylamino)ethoxy]benzylamine. It is used to prevent nausea and vomitting in humans. beilstein:2186451|cas:138-56-7|drugbank:DB00662|drugcentral:2754|kegg.compound:C07178|kegg.drug:D08643|lincs.smallmolecule:LSM-2750|wikipedia.en:Trimethobenzamide Graph N-[[4-(2-dimethylaminoethoxy)phenyl]methyl]-3,4,5-trimethoxybenzamide|N-{4-[2-(dimethylamino)ethoxy]benzyl}-3,4,5-trimethoxybenzamide|trimethobenzamide|trimethobenzamidum|trimetobenzamida N-{4-[2-(dimethylamino)ethoxy]benzyl}-3,4,5-trimethoxybenzamide N-[[4-(2-dimethylaminoethoxy)phenyl]methyl]-3,4,5-trimethoxybenzamide|N-{4-[2-(dimethylamino)ethoxy]benzyl}-3,4,5-trimethoxybenzamide|trimethobenzamide|trimethobenzamidum|trimetobenzamida http://purl.obolibrary.org/obo/CHEBI_27796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27798 biolink:ChemicalEntity nitrobenzene A nitroarene consisting of benzene carrying a single nitro substituent. An industrial chemical used widely in the production of aniline. cas:98-95-3|gmelin:50357|hmdb:HMDB0041950|kegg.compound:C06813|metacyc.compound:BENZENE-NO2|pdb-ccd:NBZ|pubmed:11304127|pubmed:12595155|reaxys:507540|umbbd.compound:c0313|wikipedia.en:Nitrobenzene Graph NITROBENZENE|Nitrobenzene|Nitrobenzol|nitrobenzene|oil of mirbane NITROBENZENE|Nitrobenzene|nitrobenzene NITROBENZENE|Nitrobenzene|Nitrobenzol|nitrobenzene|oil of mirbane http://purl.obolibrary.org/obo/CHEBI_27798 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27802 biolink:ChemicalEntity 2,3-dihydroxybenzenesulfonic acid A dihydroxybenzenesulfonic acid in which the hydroxy groups are located at positions 2 and 3. kegg.compound:C06336|metacyc.compound:3-SULFOCATECHOL|pubmed:22770225|reaxys:3271483 Graph 2,3-Dihydroxybenzenesulfonate|2,3-dihydroxybenzenesulfonic acid|3-Sulfocatechol 2,3-dihydroxybenzenesulfonic acid 2,3-Dihydroxybenzenesulfonate|2,3-dihydroxybenzenesulfonic acid|3-Sulfocatechol http://purl.obolibrary.org/obo/CHEBI_27802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27803 biolink:ChemicalEntity cis-2-enoyl-CoA A 2-enoyl-CoA in which the double bond between positions 2 and 3 of the S-acyl group has cis- geometry. kegg.compound:C01122|metacyc.compound:CIS-D2-ENOYL-COA|metacyc.compound:Cis-2-enoyl-CoAs Graph (Z)-2-enoyl-CoA|2,3-cis-enoyl CoA|Z-2,3-dehydroacyl-CoA|cis-2,3-dehydroacyl-CoA|cis-2-enoyl-CoA (Z)-2-enoyl-CoA|2,3-cis-enoyl CoA|Z-2,3-dehydroacyl-CoA|cis-2,3-dehydroacyl-CoA|cis-2-enoyl-CoA http://purl.obolibrary.org/obo/CHEBI_27803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27804 biolink:ChemicalEntity cyclohexanecarboxylate A monocarboxylic acid anion that is the conjugate base of cyclohexanecarboxylic acid. cas:3198-23-0|gmelin:325917|reaxys:3904573 Graph cyclohexane-1-carboxylate|cyclohexanecarboxylate|cyclohexanecarboxylic acid, ion(1-) cyclohexanecarboxylate cyclohexane-1-carboxylate|cyclohexanecarboxylate|cyclohexanecarboxylic acid, ion(1-) http://purl.obolibrary.org/obo/CHEBI_27804 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27808 biolink:ChemicalEntity heroin A morphinane alkaloid that is morphine bearing two acetyl substituents on the O-3 and O-6 positions. As with other opioids, heroin is used as both an analgesic and a recreational drug. Frequent and regular administration is associated with tolerance and physical dependence, which may develop into addiction. Its use includes treatment for acute pain, such as in severe physical trauma, myocardial infarction, post-surgical pain, and chronic pain, including end-stage cancer and other terminal illnesses. cas:561-27-3|drugbank:DB01452|drugcentral:4412|kegg.compound:C06534|kegg.drug:D07286|pubmed:10454516|pubmed:11441925|pubmed:11448454|pubmed:11557911|pubmed:12965116|pubmed:14534521|pubmed:15212982|pubmed:15213301|pubmed:15550572|pubmed:15772255|pubmed:15843500|pubmed:16076083|pubmed:16333714|pubmed:20331562|pubmed:20649590|pubmed:20735218|pubmed:20810225|pubmed:20855171|pubmed:21235340|pubmed:21309955|pubmed:21362452|pubmed:21452028|pubmed:21527184|pubmed:21568984|pubmed:21608377|pubmed:21734607|pubmed:21740578|pubmed:2352148|pubmed:8858977|pubmed:8893832|pubmed:9918543|reaxys:99261|wikipedia.en:Heroin Graph (5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol diacetate (ester)|17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diyl diacetate|3,6-Diacetylmorphine|7,8-Dihydro-4,5-alpha-epoxy-17-methylmorphinan-3,6-alpha-diol diacetate|Diacetylmorphine|Diamorphine|Heroin|O,O'-Diacetylmorphine 17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diyl diacetate (5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol diacetate (ester)|17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-3,6alpha-diyl diacetate|3,6-Diacetylmorphine|7,8-Dihydro-4,5-alpha-epoxy-17-methylmorphinan-3,6-alpha-diol diacetate|Diacetylmorphine|Diamorphine|Heroin|O,O'-Diacetylmorphine http://purl.obolibrary.org/obo/CHEBI_27808 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27809 biolink:ChemicalEntity L-4-hydroxyglutamic semialdehyde A glutamic semialdehyde that is L-glutamic 5-semialdehyde substituted by a hydroxy group at position 4. beilstein:1706756|kegg.compound:C05938 Graph (2S,4R)-2-amino-4-hydroxy-5-oxopentanoic acid|(4R)-4-hydroxy-5-oxo-L-norvaline|4-amino-3,4-dideoxy-D-erythro-penturonic acid (2S,4R)-2-amino-4-hydroxy-5-oxopentanoic acid (2S,4R)-2-amino-4-hydroxy-5-oxopentanoic acid|(4R)-4-hydroxy-5-oxo-L-norvaline|4-amino-3,4-dideoxy-D-erythro-penturonic acid http://purl.obolibrary.org/obo/CHEBI_27809 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2781 biolink:ChemicalEntity apocynin An aromatic ketone that is 1-phenylethanone substituted by a hydroxy group at position 4 and a methoxy group at position 3. cas:498-02-2|kegg.compound:C11380|knapsack:C00002689|pdb-ccd:I75|pubmed:21848266|pubmed:21954959|pubmed:24870309|reaxys:637373|wikipedia.en:Apocynin Graph 1-(4-Hydroxy-3-methoxyphenyl)ethanone|1-(4-hydroxy-3-methoxyphenyl)ethan-1-one|4'-hydroxy-3'-methoxyacetophenone|4-Acetyl-2-methoxyphenol|4-Hydroxy-3-methoxyphenyl methyl ketone|Acetoguaiacon|Acetoguaiacone|Acetovanillone|Apocynin 1-(4-hydroxy-3-methoxyphenyl)ethan-1-one 1-(4-Hydroxy-3-methoxyphenyl)ethanone|1-(4-hydroxy-3-methoxyphenyl)ethan-1-one|4'-hydroxy-3'-methoxyacetophenone|4-Acetyl-2-methoxyphenol|4-Hydroxy-3-methoxyphenyl methyl ketone|Acetoguaiacon|Acetoguaiacone|Acetovanillone|Apocynin http://purl.obolibrary.org/obo/CHEBI_2781 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27810 biolink:ChemicalEntity resorcinol A benzenediol that is benzene dihydroxylated at positions 1 and 3. cas:108-46-3|drugcentral:3524|gmelin:26734|hmdb:HMDB0032037|kegg.compound:C01751|kegg.drug:D00133|knapsack:C00002671|metacyc.compound:CPD-623|pdb-ccd:RCO|pubmed:11792395|pubmed:23352755|pubmed:24269627|pubmed:29079364|pubmed:3263257|reaxys:906905|umbbd.compound:c0265|wikipedia.en:Resorcinol Graph 1,3-Benzenediol|1,3-Dihydroxybenzene|1,3-Dihydroxybenzol|RESORCINOL|Resorcin|Resorcinol|Resorzin|benzene-1,3-diol|m-Hydroquinone|m-hydroxyphenol|resorcinol benzene-1,3-diol 1,3-Benzenediol|1,3-Dihydroxybenzene|1,3-Dihydroxybenzol|RESORCINOL|Resorcin|Resorcinol|Resorzin|benzene-1,3-diol|m-Hydroquinone|m-hydroxyphenol|resorcinol http://purl.obolibrary.org/obo/CHEBI_27810 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27811 biolink:ChemicalEntity undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine An undecaprenyldiphospho-N-acetylmuramoyl peptide in which the peptide moiety is L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine. pubmed:15228543 Graph N-acetylmuramoyl-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine-diphosphoundecaprenyl-N-acetylglucosamine|Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine N-acetylmuramoyl-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine-diphosphoundecaprenyl-N-acetylglucosamine|Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_27811 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27812 biolink:ChemicalEntity Se-methyl-L-selenocysteine An L-α-amino acid compound having methylselanylmethyl as the side-chain. beilstein:2636762|cas:2574-71-2|cas:26046-90-2|kegg.compound:C05689 Graph (2R)-2-amino-3-methylselanylpropanoic acid|L-methylselenocysteine|Methylselenocysteine|Se-Methyl-L-selenocysteine|Se-Methyl-selenocysteine|Se-methyl-seleno-L-cysteine|Se-methylselenocysteine|Selenium methyl cysteine|Selenium-methylselenocystine|Selenohomocysteine|Selenomethylselenocysteine|methyl-L-selenocysteine (2R)-2-amino-3-methylselanylpropanoic acid (2R)-2-amino-3-methylselanylpropanoic acid|L-methylselenocysteine|Methylselenocysteine|Se-Methyl-L-selenocysteine|Se-Methyl-selenocysteine|Se-methyl-seleno-L-cysteine|Se-methylselenocysteine|Selenium methyl cysteine|Selenium-methylselenocystine|Selenohomocysteine|Selenomethylselenocysteine|methyl-L-selenocysteine http://purl.obolibrary.org/obo/CHEBI_27812 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27814 biolink:ChemicalEntity 12-dehydro-leukotriene B4 A long-chain fatty acid consisting of leukotriene B4 having a 12-keto group in place of the 12-hydroxy group. cas:136696-10-1|kegg.compound:C05949|lipidmaps:LMFA03020024|pubmed:8394361|pubmed:8632343|reaxys:7253020 Graph (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoeicosa-6,8,10,14-tetraenoic acid|(5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid|12-Keto-LTB4|12-Keto-leukotriene B4|12-Oxo-ltb4|12-Oxoleukotriene B4|12-oxo-LTB4|5(S)-hydroxy-12-oxo-6(Z),8(E),10(E),14(Z)-eicosatetraenoic acid|5-Hydroxy-12-oxo-delta5,8,11,14-eicosapolyenoic acid|5S-hydroxy-12-keto-6Z,8E,10E,14Z-eicosatetraenoic acid (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid (5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoeicosa-6,8,10,14-tetraenoic acid|(5S,6Z,8E,10E,14Z)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid|12-Keto-LTB4|12-Keto-leukotriene B4|12-Oxo-ltb4|12-Oxoleukotriene B4|12-oxo-LTB4|5(S)-hydroxy-12-oxo-6(Z),8(E),10(E),14(Z)-eicosatetraenoic acid|5-Hydroxy-12-oxo-delta5,8,11,14-eicosapolyenoic acid|5S-hydroxy-12-keto-6Z,8E,10E,14Z-eicosatetraenoic acid http://purl.obolibrary.org/obo/CHEBI_27814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27820 biolink:ChemicalEntity prostaglandin A2 cas:13345-50-1|kegg.compound:C05953|lipidmaps:LMFA03010035 Graph (+)-Prostaglandin A(sup 2)|(15S)-PGA2|(15S)-Prostaglandin A2|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oic acid|5,6-cis-PGA2|Medullin|PGA2|Prostaglandin A2 (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oic acid (+)-Prostaglandin A(sup 2)|(15S)-PGA2|(15S)-Prostaglandin A2|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,10,13-trien-1-oic acid|5,6-cis-PGA2|Medullin|PGA2|Prostaglandin A2 http://purl.obolibrary.org/obo/CHEBI_27820 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27821 biolink:ChemicalEntity (S)-methylmalonaldehydic acid A 2-methyl-3-oxopropanoic acid that has S-configuration. beilstein:4364493|kegg.compound:C06002 Graph (2S)-2-methyl-3-oxopropanoic acid|(S)-Methylmalonate semialdehyde (2S)-2-methyl-3-oxopropanoic acid (2S)-2-methyl-3-oxopropanoic acid|(S)-Methylmalonate semialdehyde http://purl.obolibrary.org/obo/CHEBI_27821 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27822 biolink:ChemicalEntity 2-aminobenzimidazole A member of the class of benzimidazoles that is benzimidazole in which the hydrogen at position 2 is replaced by an amino group. cas:934-32-7|kegg.compound:C10901|pdb-ccd:AX7|pubmed:22076761|pubmed:22488868|pubmed:22958065|pubmed:24098350|reaxys:116525 Graph 1H-benzimidazol-2-amine|2-Aminobenzimidazole|2-Iminobenzimidazoline|2-aminobenzimidazole|Benzimidazol-2-ylamine 1H-benzimidazol-2-amine 1H-benzimidazol-2-amine|2-Aminobenzimidazole|2-Iminobenzimidazoline|2-aminobenzimidazole|Benzimidazol-2-ylamine http://purl.obolibrary.org/obo/CHEBI_27822 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27823 biolink:ChemicalEntity (5-hydroxyindol-3-yl)acetic acid A member of the class of indole-3-acetic acids that is indole-3-acetic acid substituted by a hydroxy group at C-5. cas:54-16-0|hmdb:HMDB0000763|kegg.compound:C05635|knapsack:C00000104|metacyc.compound:5-HYDROXYINDOLE_ACETATE|pubmed:11063613|pubmed:11113939|pubmed:22770225|reaxys:168797|wikipedia.en:5-Hydroxyindoleacetic_acid Graph (5-hydroxy-1H-indol-3-yl)acetic acid|5-HIAA|5-Hydroxy-1H-indole-3-acetic acid|5-Hydroxyindol-3-ylacetic acid|5-Hydroxyindole-3-acetic acid|5-Hydroxyindoleacetic acid (5-hydroxy-1H-indol-3-yl)acetic acid (5-hydroxy-1H-indol-3-yl)acetic acid|5-HIAA|5-Hydroxy-1H-indole-3-acetic acid|5-Hydroxyindol-3-ylacetic acid|5-Hydroxyindole-3-acetic acid|5-Hydroxyindoleacetic acid http://purl.obolibrary.org/obo/CHEBI_27823 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27825 biolink:ChemicalEntity 3',5-dihydroxy-3,4',7-trimethoxyflavone A trimethoxyflavone that is quercetin in which the hydroxy groups at positions 3, 4' and 7 have been replaced by methoxy groups. kegg.compound:C04444|knapsack:C00004647 Graph 3',5-Dihydroxy-3,4',7-trimethoxyflavone|3,7,4'-O-trimethylquercetin|3,7,4'-tri-O-methylquercetin|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-chromen-4-one 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-chromen-4-one 3',5-Dihydroxy-3,4',7-trimethoxyflavone|3,7,4'-O-trimethylquercetin|3,7,4'-tri-O-methylquercetin|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-chromen-4-one http://purl.obolibrary.org/obo/CHEBI_27825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27826 biolink:ChemicalEntity (S)-4-hydroxymandelonitrile beta-D-glucoside A β-D-glucoside consisting of (S)-prunasin carrying a hydroxy substituent at position 4 on the phenyl ring. cas:499-20-7|kegg.compound:C05143|knapsack:C00001442|pubmed:12114576|pubmed:16660850|pubmed:16663720|pubmed:16666964|pubmed:16667820|pubmed:17126881|pubmed:17706731|pubmed:18003897|pubmed:21541942|pubmed:21707058|pubmed:237909|reaxys:92611 Graph (2S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(S)-4-Hydroxymandelonitrile beta-D-glucoside|(alphaS)-alpha-(beta-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile|Dhurrin|dhurrin (2S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile (2S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile|(S)-4-Hydroxymandelonitrile beta-D-glucoside|(alphaS)-alpha-(beta-D-glucopyranosyloxy)-4-hydroxybenzeneacetonitrile|Dhurrin|dhurrin http://purl.obolibrary.org/obo/CHEBI_27826 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27827 biolink:ChemicalEntity paraoxon An aryl dialkyl phosphate where both the alkyl groups are ethyl and the aryl group is 4-nitrophenyl. cas:311-45-5|drugcentral:4683|gmelin:51821|kegg.compound:C06606|pubmed:24149933|pubmed:24220671|pubmed:24357355|pubmed:24384224|pubmed:24413757|pubmed:24486155|pubmed:24598740|reaxys:1915526|umbbd.compound:c0088|wikipedia.en:Paraoxon Graph O,O-diethyl O-p-nitrophenyl phosphate|Paraoxon|diethyl 4-nitrophenyl phosphate|diethyl p-nitrophenyl phosphate|diethyl paraoxon|ethyl paraoxon|p-nitrophenyl diethyl phosphate|paraoxon|phosphacol|phosphoric acid diethyl 4-nitrophenyl ester diethyl 4-nitrophenyl phosphate O,O-diethyl O-p-nitrophenyl phosphate|Paraoxon|diethyl 4-nitrophenyl phosphate|diethyl p-nitrophenyl phosphate|diethyl paraoxon|ethyl paraoxon|p-nitrophenyl diethyl phosphate|paraoxon|phosphacol|phosphoric acid diethyl 4-nitrophenyl ester http://purl.obolibrary.org/obo/CHEBI_27827 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27834 biolink:ChemicalEntity pentostatin A member of the class of coformycins that is coformycin in which the hydroxy group at position 2' is replaced with a hydrogen. It is a drug used for the treatment of hairy cell leukaemia. cas:53910-25-1|drugbank:DB00552|drugcentral:2098|hmdb:HMDB0014692|kegg.compound:C02267|kegg.drug:D00155|patent:US20040181052|pdb-ccd:DCF|pubmed:10877055|pubmed:14748654|pubmed:16321875|pubmed:18602399|pubmed:23361035|pubmed:28057947|pubmed:29032276|pubmed:29051060|pubmed:29056419|pubmed:29196889|pubmed:29269797|pubmed:29460654|pubmed:30454654|pubmed:30820940|pubmed:30825499|pubmed:31336367|pubmed:31566032|pubmed:31576294|pubmed:31643500|pubmed:32539314|pubmed:33437844|pubmed:33476709|pubmed:34227372|pubmed:34563676|pubmed:34851227|pubmed:34984865|pubmed:35933011|pubmed:36115868|pubmed:9622483|wikipedia.en:Pentostatin Graph (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol|2'-deoxycoformycin|CI 825|CI-825|CI825|Nipent|PD 81565|PD-81565|PD-ADI|PD81565|YK-176|co-vidarabine|deoxycoformycin|pentostatin|pentostatina|pentostatine|pentostatinum (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol (8R)-3-(2-deoxy-beta-D-erythro-pentofuranosyl)-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol|2'-deoxycoformycin|CI 825|CI-825|CI825|Nipent|PD 81565|PD-81565|PD-ADI|PD81565|YK-176|co-vidarabine|deoxycoformycin|pentostatin|pentostatina|pentostatine|pentostatinum http://purl.obolibrary.org/obo/CHEBI_27834 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27843 biolink:ChemicalEntity cyanidin cation An anthocyanidin cation that is flavylium substituted at positions 3, 3', 4', 5 and 7 by hydroxy groups. beilstein:1690254|cas:13306-05-3|kegg.compound:C05905|knapsack:C00006614|lipidmaps:LMPK12010002|metacyc.compound:CPD-591|pubmed:23123597|pubmed:23360684|pubmed:23375153|pubmed:23389674|reaxys:1690254|wikipedia.en:Cyanidin Graph 2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopyrylium|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromenium|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromenylium|3,3',4',5,7-pentahydroxyflavylium|3,5,7,3',4'-Pentahydroxyflavylium|Cyanidin|Cyanidine|Cyanidol 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromenium 2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopyrylium|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromenium|2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromenylium|3,3',4',5,7-pentahydroxyflavylium|3,5,7,3',4'-Pentahydroxyflavylium|Cyanidin|Cyanidine|Cyanidol http://purl.obolibrary.org/obo/CHEBI_27843 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27845 biolink:ChemicalEntity ditrans,polycis-polyprenyl diphosphate A polyprenol diphosphate that contains two double bonds in trans-configuration and an unspecified chain-length with double bonds in cis-configuration. hmdb:HMDB0060469|kegg.compound:C05859|pubmed:10908715|pubmed:11722180|pubmed:12591616|pubmed:1995611|pubmed:24664694|pubmed:2645280|pubmed:31178134|pubmed:31661879|pubmed:3178234|pubmed:32245241|pubmed:34034154|pubmed:34275143|pubmed:34290587|pubmed:35343646|pubmed:35371326|pubmed:37356182|pubmed:37916302|pubmed:38256083 Graph alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbut-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dehydrodolichol diphosphate|dehydrodolichyl diphosphate|di-trans,poly-cis-polyprenyl diphosphate|ditrans,polycis-polyprenyl diphosphate alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbut-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl] alpha-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-omega-[(2Z)-4-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2-methylbut-2-en-1-yl]poly[(2Z)-2-methylbut-2-ene-1,4-diyl]|dehydrodolichol diphosphate|dehydrodolichyl diphosphate|di-trans,poly-cis-polyprenyl diphosphate|ditrans,polycis-polyprenyl diphosphate http://purl.obolibrary.org/obo/CHEBI_27845 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27847 biolink:ChemicalEntity 3-iodo-L-tyrosine The monoiodotyrosine that is L-tyrosine carrying an iodo-substituent at position C-3 of the benzyl group. cas:70-78-0|drugbank:DB01758|gmelin:2110934|hmdb:HMDB0000021|kegg.compound:C02515|metacyc.compound:CPD-12288|pdb-ccd:IYR|pubmed:12585904|pubmed:15206581|pubmed:19278648|pubmed:21290538|pubmed:8812261|reaxys:2941266|wikipedia.en:3-Iodotyrosine Graph (2S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid|3-IODO-TYROSINE|3-Iodo-L-tyrosine|3-iodo-L-tyrosine|MIT 3-Iodo-L-tyrosine|3-iodo-L-tyrosine (2S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid|3-IODO-TYROSINE|3-Iodo-L-tyrosine|3-iodo-L-tyrosine|MIT http://purl.obolibrary.org/obo/CHEBI_27847 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27848 biolink:ChemicalEntity alpha-L-rhamnoside kegg.compound:C02757 Graph 6-deoxy-alpha-L-mannopyranoside|alpha-L-Rhamnoside|alpha-L-rhamnosides 6-deoxy-alpha-L-mannopyranoside 6-deoxy-alpha-L-mannopyranoside|alpha-L-Rhamnoside|alpha-L-rhamnosides http://purl.obolibrary.org/obo/CHEBI_27848 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27849 biolink:ChemicalEntity toluene-4-sulfonic acid An arenesulfonic acid that is benzenesulfonic acid in which the hydrogen at position 4 is replaced by a methyl group. beilstein:472690|cas:104-15-4|drugbank:DB03120|gmelin:3279|kegg.compound:C06677|pdb-ccd:TSU Graph 4-methylbenzenesulfonic acid|4-toluenesulfonic acid|PARA-TOLUENE SULFONATE|Toluen-4-sulfonsaeure|Toluene-4-sulfonate|Tosylate|p-methylbenzenesulfonic acid|p-methylphenylsulfonic acid|p-toluenesulfonic acid|p-toluenesulphonic acid|p-tolylsulfonic acid|toluene-4-sulfonic acid|tosic acid|tosylic acid 4-methylbenzenesulfonic acid 4-methylbenzenesulfonic acid|4-toluenesulfonic acid|PARA-TOLUENE SULFONATE|Toluen-4-sulfonsaeure|Toluene-4-sulfonate|Tosylate|p-methylbenzenesulfonic acid|p-methylphenylsulfonic acid|p-toluenesulfonic acid|p-toluenesulphonic acid|p-tolylsulfonic acid|toluene-4-sulfonic acid|tosic acid|tosylic acid http://purl.obolibrary.org/obo/CHEBI_27849 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27851 biolink:ChemicalEntity keto-neuraminic acid The open-chain form of neuraminic acid. reaxys:1714200 Graph (4S,5R,6R,7S,8R)-5-amino-4,6,7,8,9-pentahydroxy-2-oxononanoic acid (4S,5R,6R,7S,8R)-5-amino-4,6,7,8,9-pentahydroxy-2-oxononanoic acid (4S,5R,6R,7S,8R)-5-amino-4,6,7,8,9-pentahydroxy-2-oxononanoic acid http://purl.obolibrary.org/obo/CHEBI_27851 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27852 biolink:ChemicalEntity 3,4-dihydroxymandelaldehyde A hydroxyaldehyde consisting of phenylacetaldehyde having three hydroxy substituents located at the α-, 3- and 4-positions. It is a metabolite of noradrenaline. cas:13023-73-9|foodb.food:FDB023855|hmdb:HMDB0006242|kegg.compound:C05577|pubmed:10424772|pubmed:11532332|pubmed:12729575|pubmed:14697885|pubmed:17379813|pubmed:18783367|pubmed:2817346|pubmed:30191330|pubmed:31793911|pubmed:31841007|pubmed:32552668|pubmed:34503991|pubmed:34506109|pubmed:34609854|pubmed:8813375|pubmed:9237550|pubmed:9518674|pubmed:9878889|reaxys:2092210 Graph (3,4-dihydroxyphenyl)(hydroxy)acetaldehyde|2-(3,4-dihydroxyphenyl)-2-hydroxyacetaldehyde|3,4-Dihydroxyphenylglycolaldehyde|3,4-dihydroxymandelaldehyde|3,4-dihydroxymandelic aldehyde|3,4-dihydroxyphenylglycolic aldehyde|DHMAL|DHPGALD|DOPEGAL|alpha,3,4-trihydroxybenzeneacetaldehyde|alpha,3,4-trihydroxyphenylacetaldehyde (3,4-dihydroxyphenyl)(hydroxy)acetaldehyde (3,4-dihydroxyphenyl)(hydroxy)acetaldehyde|2-(3,4-dihydroxyphenyl)-2-hydroxyacetaldehyde|3,4-Dihydroxyphenylglycolaldehyde|3,4-dihydroxymandelaldehyde|3,4-dihydroxymandelic aldehyde|3,4-dihydroxyphenylglycolic aldehyde|DHMAL|DHPGALD|DOPEGAL|alpha,3,4-trihydroxybenzeneacetaldehyde|alpha,3,4-trihydroxyphenylacetaldehyde http://purl.obolibrary.org/obo/CHEBI_27852 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:278547 biolink:ChemicalEntity sodium azide The sodium salt of hydrogen azide (hydrazoic acid). cas:26628-22-8|metacyc.compound:CPD-23697|pesticides:sodium_azide|pubmed:25916484|pubmed:28712037|pubmed:28849152|pubmed:29947902|pubmed:30664159|pubmed:31088611|pubmed:31821925|pubmed:32437849|pubmed:32844280|pubmed:33400299|wikipedia.en:Sodium_azide Graph Azoture de sodium|Hydrazoic acid, sodium salt|NaN3|Natriumazid|hydrazoic acid sodium salt Azoture de sodium|Hydrazoic acid, sodium salt|NaN3|Natriumazid|hydrazoic acid sodium salt http://purl.obolibrary.org/obo/CHEBI_278547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27855 biolink:ChemicalEntity L-erythro-3-methylmalyl-CoA A hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of L-erythro-3-methylmalic acid. pubmed:18065535 Graph L-erythro-3-methylmalyl-coenzyme A|beta-Methylmalyl-CoA L-erythro-3-methylmalyl-coenzyme A|beta-Methylmalyl-CoA http://purl.obolibrary.org/obo/CHEBI_27855 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27856 biolink:ChemicalEntity acetamide A member of the class of acetamides that results from the formal condensation of acetic acid with ammonia. beilstein:1071207|cas:60-35-5|drugbank:DB02736|gmelin:1500|kegg.compound:C06244|lincs.smallmolecule:LSM-37224|pdb-ccd:ACM|ppdb:1641|umbbd.compound:c0658 Graph ACETAMIDE|Acetamid|Acetamide|Azetamid|CH3CONH2|Essigsaeureamid|Ethanamid|acetamide|acetic acid amide|ethanamide|methanecarboxamide ACETAMIDE|Acetamide|acetamide ACETAMIDE|Acetamid|Acetamide|Azetamid|CH3CONH2|Essigsaeureamid|Ethanamid|acetamide|acetic acid amide|ethanamide|methanecarboxamide http://purl.obolibrary.org/obo/CHEBI_27856 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27858 biolink:ChemicalEntity precorrin-6Y The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which six methyl groups have been introduced into the tetrapyrrole framework, together with ring contraction and reduction. beilstein:4901795|cas:139663-55-1|kegg.compound:C06319 Graph 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R,18R,19R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|3-[(1R,2S,3S,7S,11S,17R,18R,19R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-octamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 6B|Precorrin 6Y 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R,18R,19R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[(1R,2S,3S,7S,11S,17R,18R,19R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-pentamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|3-[(1R,2S,3S,7S,11S,17R,18R,19R)-2,7,12,18-tetrakis(carboxymethyl)-1,2,7,11,17-octamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 6B|Precorrin 6Y http://purl.obolibrary.org/obo/CHEBI_27858 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27859 biolink:ChemicalEntity S-methyl-5-thio-alpha-D-ribose 1-phosphate kegg.compound:C04188 Graph 5-S-methyl-1-O-phosphono-5-thio-alpha-D-ribofuranose|5-S-methyl-5-thio-alpha-D-ribofuranose 1-(dihydrogen phosphate)|S-Methyl-5-thio-5-deoxy-D-ribose 1-phosphate|S-Methyl-5-thio-D-ribose 1-phosphate|S-Methyl-5-thio-alpha-D-ribose 1-phosphate 5-S-methyl-5-thio-alpha-D-ribofuranose 1-(dihydrogen phosphate) 5-S-methyl-1-O-phosphono-5-thio-alpha-D-ribofuranose|5-S-methyl-5-thio-alpha-D-ribofuranose 1-(dihydrogen phosphate)|S-Methyl-5-thio-5-deoxy-D-ribose 1-phosphate|S-Methyl-5-thio-D-ribose 1-phosphate|S-Methyl-5-thio-alpha-D-ribose 1-phosphate http://purl.obolibrary.org/obo/CHEBI_27859 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27865 biolink:ChemicalEntity fucosterol A 3β-sterol consisting of stigmastan-3β-ol with double bonds at positions 5 and 24(28). cas:17605-67-3|kegg.compound:C08817|knapsack:C00003653|lipidmaps:LMST01040146|pubmed:14560919 Graph (24E)-24-n-propylidenecholesterol|(24E)-stigmasta-5,24(28)-dien-3beta-ol|(3beta,24E)-stigmasta-5,24(28)-dien-3-ol|(3beta,24E)-stigmasta-5,24(28)-dien-ol|(E)-stigmasta-5,24(28)-dien-3beta-ol|24E-ethylidene-cholest-5-en-3beta-ol|Fucosterol|fucosterin|trans-24-ethylidenecholesterol (24E)-stigmasta-5,24(28)-dien-3beta-ol (24E)-24-n-propylidenecholesterol|(24E)-stigmasta-5,24(28)-dien-3beta-ol|(3beta,24E)-stigmasta-5,24(28)-dien-3-ol|(3beta,24E)-stigmasta-5,24(28)-dien-ol|(E)-stigmasta-5,24(28)-dien-3beta-ol|24E-ethylidene-cholest-5-en-3beta-ol|Fucosterol|fucosterin|trans-24-ethylidenecholesterol http://purl.obolibrary.org/obo/CHEBI_27865 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27867 biolink:ChemicalEntity antheraxanthin An epoxycarotenol that is β-carotene-3,3'-diol in which one of the one of the endocyclic double bonds has been oxidised to the corresponding epoxide. It is a neutral yellow plant pigment found in Euglenophyta. cas:640-03-9|hmdb:HMDB0035831|kegg.compound:C08579|knapsack:C00003760|lipidmaps:LMPR01070262|metacyc.compound:CPD1F-131|pubmed:18942838|pubmed:23820691|pubmed:24039824|pubmed:24334196|reaxys:101042 Graph (3R,3'S,5'R,6'S)-5',6'-dihydro-5',6'-epoxy-beta,beta-carotene-3,3'-diol|5,6-epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol|Antheraxanthin|all-trans-antheraxanthin (3R,3'S,5'R,6'S)-5',6'-dihydro-5',6'-epoxy-beta,beta-carotene-3,3'-diol (3R,3'S,5'R,6'S)-5',6'-dihydro-5',6'-epoxy-beta,beta-carotene-3,3'-diol|5,6-epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol|Antheraxanthin|all-trans-antheraxanthin http://purl.obolibrary.org/obo/CHEBI_27867 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27868 biolink:ChemicalEntity 3-oxolauroyl-CoA An oxo-fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 3-oxolauroic acid. hmdb:HMDB0003937|kegg.compound:C05263 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxododecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxododecanoyl-CoA|3-ketododecanoyl-CoA|3-ketododecanoyl-coenzyme A|3-ketolauroyl-CoA|3-ketolauroyl-coenzyme A|3-oxododecanoyl-coenzyme A|3-oxolauroyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxododecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxododecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxododecanoyl-CoA|3-ketododecanoyl-CoA|3-ketododecanoyl-coenzyme A|3-ketolauroyl-CoA|3-ketolauroyl-coenzyme A|3-oxododecanoyl-coenzyme A|3-oxolauroyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27868 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27869 biolink:ChemicalEntity chloroacetic acid A chlorocarboxylic acid that is acetic acid carrying a 2-chloro substituent. cas:79-11-8|hmdb:HMDB0031331|kegg.compound:C06755|kegg.drug:D07677|lipidmaps:LMFA01090068|metacyc.compound:CHLOROACETIC-ACID|pdb-ccd:R3W|pesticides:monochloroacetic%20acid|pubmed:12359395|pubmed:15033542|pubmed:16647117|pubmed:17490874|pubmed:23103613|pubmed:25451595|reaxys:605438 Graph 2-chloro-acetic acid|2-chloro-ethanoic acid|2-chloroacetic acid|Acide chloracetique|Acide chloroacetique|Acide monochloracetique|CAA|Chloroacetic acid|Chloroethanoic acid|Monochloressigsaeure|alpha-chloro-acetic acid|chloracetic acid|chloroacetic acid|monochloroacetic acid|monochloroethanoic acid Chloroacetic acid|chloroacetic acid 2-chloro-acetic acid|2-chloro-ethanoic acid|2-chloroacetic acid|Acide chloracetique|Acide chloroacetique|Acide monochloracetique|CAA|Chloroacetic acid|Chloroethanoic acid|Monochloressigsaeure|alpha-chloro-acetic acid|chloracetic acid|chloroacetic acid|monochloroacetic acid|monochloroethanoic acid http://purl.obolibrary.org/obo/CHEBI_27869 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27870 biolink:ChemicalEntity biocytin A monocarboxylic acid amide that results from the formal condensation of the carboxylic acid group of biotin with the N6-amino group of L-lysine. cas:576-19-2|kegg.compound:C05552|patent:US2710298|pubmed:1384763|pubmed:9211279|reaxys:97197|resid:AA0117 Graph (3aS-(3aalpha,4beta,6aalpha))-N(6)-(5-(hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)-L-lysine|Biocytin|N(6)-D-biotinyl-L-lysine|N(6)-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}-L-lysine|N(epsilon)-biotinyl-L-lysine|N-biotinyl-L-lysine|N6-D-Biotinyl-L-lysine|biotinyl-L-lysine|epsilon-N-Biotinyl-L-lysine|epsilon-N-biotinyllysine N(6)-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}-L-lysine (3aS-(3aalpha,4beta,6aalpha))-N(6)-(5-(hexahydro-2-oxo-1H-thieno(3,4-d)imidazol-4-yl)-1-oxopentyl)-L-lysine|Biocytin|N(6)-D-biotinyl-L-lysine|N(6)-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}-L-lysine|N(epsilon)-biotinyl-L-lysine|N-biotinyl-L-lysine|N6-D-Biotinyl-L-lysine|biotinyl-L-lysine|epsilon-N-Biotinyl-L-lysine|epsilon-N-biotinyllysine http://purl.obolibrary.org/obo/CHEBI_27870 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27871 biolink:ChemicalEntity chloroacetaldehyde Acetaldehyde substituted at C-2 by chlorine. beilstein:1071226|cas:107-20-0|kegg.compound:C06754|umbbd.compound:c0003 Graph 2-Chloro-1-ethanal|2-Chloroethanal|Chloroacetaldehyde|Chloroaldehyde|Monochloroacetaldehyde|chloroacetaldehyde Chloroacetaldehyde|chloroacetaldehyde 2-Chloro-1-ethanal|2-Chloroethanal|Chloroacetaldehyde|Chloroaldehyde|Monochloroacetaldehyde|chloroacetaldehyde http://purl.obolibrary.org/obo/CHEBI_27871 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27877 biolink:ChemicalEntity N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanine An N-acetyl-β-D-glycosaminyl glycopeptide consisting of an N-acetyl-β-D-glycosaminyl-(1→4)-N-acetylmuramoyl moiety attached to the amino terminus of the tetrapeptide L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanine via an amide linkage. kegg.compound:C04904 Graph N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysyl-D-alanine|beta-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-Glu-6-carboxy-L-Lys-D-Ala N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysyl-D-alanine|beta-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-Glu-6-carboxy-L-Lys-D-Ala http://purl.obolibrary.org/obo/CHEBI_27877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2788 biolink:ChemicalEntity apraclonidine An imidazoline that is 2-amino 4,5-dihydro-1H-imidazoline in which one of the exocyclic amino hydrogens has been replaced by a 4-amino-2,6-dichlorophenyl group. beilstein:5436106|cas:66711-21-5|drugbank:DB00964|drugcentral:229|kegg.compound:C07668|kegg.drug:D07461|patent:US4517199|pubmed:17204928|pubmed:17572343|pubmed:17580803|pubmed:17824139|pubmed:18454417|pubmed:18645436|pubmed:18769292|pubmed:19169332|pubmed:19253181|pubmed:19393510|pubmed:19525731|pubmed:19606173|pubmed:19927485|pubmed:20182200|pubmed:20399934|pubmed:21384091|pubmed:21386103|pubmed:21406599|pubmed:21566530|pubmed:21576682|pubmed:23808550|pubmed:24651238|pubmed:25318185|pubmed:25709394|pubmed:25748642|pubmed:25768246|pubmed:25859142|pubmed:26057409|pubmed:26381100|pubmed:26832333|pubmed:27239603|pubmed:27773627|pubmed:27841849|pubmed:27928279|pubmed:27984360|pubmed:27990376|pubmed:28017248|pubmed:28231380|pubmed:7891985|pubmed:9856229|wikipedia.en:Apraclonidine Graph 2,6-dichloro-N(1)-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,4-diamine|4-Aminoclonidine|apraclonidina|apraclonidine|apraclonidinum 2,6-dichloro-N(1)-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,4-diamine 2,6-dichloro-N(1)-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,4-diamine|4-Aminoclonidine|apraclonidina|apraclonidine|apraclonidinum http://purl.obolibrary.org/obo/CHEBI_2788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27881 biolink:ChemicalEntity resveratrol A stilbenol that is stilbene in which the phenyl groups are substituted at positions 3, 5, and 4' by hydroxy groups. beilstein:1912433|cas:501-36-0|drugbank:DB02709|kegg.compound:C03582|lincs.smallmolecule:LSM-2557|pubmed:12939617|pubmed:16461283 Graph 3,4',5-Trihydroxystilbene|5-[2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol|Resveratrol 5-[2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol 3,4',5-Trihydroxystilbene|5-[2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol|Resveratrol http://purl.obolibrary.org/obo/CHEBI_27881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27882 biolink:ChemicalEntity (S)-colchicine A colchicine that has (S)-configuration. It is a secondary metabolite, has anti-inflammatory properties and is used to treat gout, crystal-induced joint inflammation, familial Mediterranean fever, and many other conditions. beilstein:2228813|cas:64-86-8|chemspider:5933|drugbank:DB01394|drugcentral:726|kegg.compound:C07592|kegg.drug:D00570|knapsack:C00002327|lincs.smallmolecule:LSM-5199|metacyc.compound:CPD-9785|pdb-ccd:LOC|pubmed:16188942|pubmed:17619668|pubmed:18787557|pubmed:24530796|pubmed:28832953|pubmed:28912485|pubmed:28959419|pubmed:30565859|pubmed:32025680|pubmed:32426001|pubmed:32511763|pubmed:32837853|pubmed:32865380|pubmed:33100196|pubmed:33166069|wikipedia.en:Colchicine Graph (-)-colchicine|(S)-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl)acetamide|7alphaH-colchicine|Colchicin|Colchicine|Colchisol|Colcin|Colcrys|Colsaloid|Condylon|Goutnil|Kolkicin|Mitigare|N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide|colchicina|colchicinum N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide (-)-colchicine|(S)-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl)acetamide|7alphaH-colchicine|Colchicin|Colchicine|Colchisol|Colcin|Colcrys|Colsaloid|Condylon|Goutnil|Kolkicin|Mitigare|N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide|colchicina|colchicinum http://purl.obolibrary.org/obo/CHEBI_27882 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27884 biolink:ChemicalEntity D-fructofuranose 2-phosphate beilstein:1650826 Graph D-Fructofuranose 2-phosphate|D-Fructose 2-phosphate D-Fructofuranose 2-phosphate|D-Fructose 2-phosphate http://purl.obolibrary.org/obo/CHEBI_27884 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27887 biolink:ChemicalEntity 6-phospho-beta-D-galactoside kegg.compound:C03847 Graph 6-Phospho-beta-D-galactoside|6-phospho-beta-D-galactosides 6-Phospho-beta-D-galactoside|6-phospho-beta-D-galactosides http://purl.obolibrary.org/obo/CHEBI_27887 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27889 biolink:ChemicalEntity lead(0) cas:7439-92-1|kegg.compound:C06696|wikipedia.en:Lead Graph Lead|Pb|Pb(0)|Pbn|lead|lead metal|lead(0) Lead|lead Lead|Pb|Pb(0)|Pbn|lead|lead metal|lead(0) http://purl.obolibrary.org/obo/CHEBI_27889 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27891 biolink:ChemicalEntity S-sulfo-L-cysteine An S-substituted L-cysteine where the S-substituent is specified as a sulfo group. cas:1637-71-4|kegg.compound:C05824|pdb-ccd:CSU|pubmed:20179139|pubmed:23392866|pubmed:23430915|pubmed:24285094|pubmed:962465|reaxys:1726832 Graph 3-(sulfosulfanyl)-L-alanine|Cysteine-S-sulfate|Cysteine-S-sulfonate|Cysteinyl-S-sulfonate|Cysteinyl-S-sulfonic acid|L-Cysteine hydrogen sulfate|L-cysteine S-sulfate|S-Sulfo-L-cysteine|S-Sulfocysteine|S-Sulphocysteine|S-sulfocysteine|S-sulpho-L-cysteine 3-(sulfosulfanyl)-L-alanine 3-(sulfosulfanyl)-L-alanine|Cysteine-S-sulfate|Cysteine-S-sulfonate|Cysteinyl-S-sulfonate|Cysteinyl-S-sulfonic acid|L-Cysteine hydrogen sulfate|L-cysteine S-sulfate|S-Sulfo-L-cysteine|S-Sulfocysteine|S-Sulphocysteine|S-sulfocysteine|S-sulpho-L-cysteine http://purl.obolibrary.org/obo/CHEBI_27891 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27897 biolink:ChemicalEntity tryptophan An α-amino acid that is alanine bearing an indol-3-yl substituent at position 3. cas:54-12-6|gmelin:4532|kegg.compound:C00806|knapsack:C00001396|lincs.smallmolecule:LSM-36836|pubmed:17439666|pubmed:22264337|reaxys:86196|wikipedia.en:Tryptophan Graph 2-amino-3-(1H-indol-3-yl)propanoic acid|Htrp|Trp|Tryptophan|W|alpha-Amino-beta-(3-indolyl)-propionic acid|alpha-amino-beta-3-indolepropionic acid|beta-3-indolylalanine|triptofano|tryptophan|tryptophane Tryptophan|tryptophan 2-amino-3-(1H-indol-3-yl)propanoic acid|Htrp|Trp|Tryptophan|W|alpha-Amino-beta-(3-indolyl)-propionic acid|alpha-amino-beta-3-indolepropionic acid|beta-3-indolylalanine|triptofano|tryptophan|tryptophane http://purl.obolibrary.org/obo/CHEBI_27897 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27899 biolink:ChemicalEntity cisplatin A diamminedichloroplatinum compound in which the two ammine ligands and two chloro ligands are oriented in a cis planar configuration around the central platinum ion. An anticancer drug that interacts with, and forms cross-links between, DNA and proteins, it is used as a neoplasm inhibitor to treat solid tumours, primarily of the testis and ovary. Commonly but incorrectly described as an alkylating agent due to its mechanism of action (but it lacks alkyl groups). cas:15663-27-1|drugbank:DB00515|gmelin:2519|hmdb:HMDB0014656|kegg.compound:C06911|kegg.drug:D00275|metacyc.compound:CPD0-1392|molbase:25|patent:DE2318020|patent:DE2329485|pubmed:10883661|pubmed:12537968|pubmed:12831510|pubmed:12935404|pubmed:16327988|pubmed:18472761|pubmed:1855275|pubmed:23554447|pubmed:23604226|pubmed:23651576|pubmed:28494534|reaxys:11324567|wikipedia.en:Cisplatin Graph (SP-4-2)-diamminedichloridoplatinum|(SP-4-2)-diamminedichloroplatinum|Briplatin|CDDP|Cismaplat|Cisplatin|Lederplatin|Neoplatin|Peyrone's chloride|Peyrone's salt|Platamine|Platinex|Platinol|Randa|[PtCl2(NH3)2]|cis-DDP|cis-Diamminedichloroplatinum(II)|cis-[PtCl2(NH3)2]|cis-diamminedichloridoplatinum(II)|cis-diamminedichloroplatinum|cis-diamminedichloroplatinum(II)|cis-diammineplatinum(II) dichloride|cis-dichlorodiammineplatinum(II)|cis-platin|cisplatin|cisplatine|cisplatino|cisplatinum (SP-4-2)-diamminedichloridoplatinum|(SP-4-2)-diamminedichloroplatinum|cis-diamminedichloridoplatinum(II)|cis-diamminedichloroplatinum(II) (SP-4-2)-diamminedichloridoplatinum|(SP-4-2)-diamminedichloroplatinum|Briplatin|CDDP|Cismaplat|Cisplatin|Lederplatin|Neoplatin|Peyrone's chloride|Peyrone's salt|Platamine|Platinex|Platinol|Randa|[PtCl2(NH3)2]|cis-DDP|cis-Diamminedichloroplatinum(II)|cis-[PtCl2(NH3)2]|cis-diamminedichloridoplatinum(II)|cis-diamminedichloroplatinum|cis-diamminedichloroplatinum(II)|cis-diammineplatinum(II) dichloride|cis-dichlorodiammineplatinum(II)|cis-platin|cisplatin|cisplatine|cisplatino|cisplatinum http://purl.obolibrary.org/obo/CHEBI_27899 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27902 biolink:ChemicalEntity tetracycline A broad-spectrum polyketide antibiotic produced by the Streptomyces genus of actinobacteria. cas:60-54-8|drugbank:DB00759|drugcentral:2611|gmelin:1103368|kegg.compound:C06570|kegg.drug:D00201|metacyc.compound:CPD0-1414|patent:US2699054|patent:US2712517|patent:US2886595|patent:US3005023|patent:US3019173|patent:US3301899|pdb-ccd:TAC|pubmed:11061623|pubmed:11550419|pubmed:11744940|pubmed:12934399|pubmed:14585720|pubmed:15825421|pubmed:15913752|pubmed:16443056|pubmed:1650428|pubmed:16749547|pubmed:17251127|pubmed:17260506|pubmed:18326855|pubmed:18406588|pubmed:19032078|pubmed:19112759|pubmed:19136803|pubmed:25286144|pubmed:26876942|reaxys:2230417|vsdb:1739|wikipedia.en:Tetracycline Graph (4S,4aS,5aS,12aS)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide|(4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|Abramycin|Achromycin|Anhydrotetracycline|Deschlorobiomycin|Liquamycin|TETRACYCLINE|Tetracyclin|Tetracycline|Tetrazyklin|Tsiklomitsin|tetracycline|tetracyclinum (4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide (4S,4aS,5aS,12aS)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide|(4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide|Abramycin|Achromycin|Anhydrotetracycline|Deschlorobiomycin|Liquamycin|TETRACYCLINE|Tetracyclin|Tetracycline|Tetrazyklin|Tsiklomitsin|tetracycline|tetracyclinum http://purl.obolibrary.org/obo/CHEBI_27902 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27903 biolink:ChemicalEntity (2,4,5-trichlorophenoxy)acetic acid A chlorophenoxyacetic acid that is phenoxyacetic acid in which the ring hydrogens at postions 2, 4 and 5 are substituted by chlorines. cas:93-76-5|gmelin:434052|kegg.compound:C07100|lincs.smallmolecule:LSM-24946|metacyc.compound:CPD-10896|pesticides:2,4,5-t|ppdb:1532|pubmed:23085749|pubmed:23167922|reaxys:2055620|wikipedia.en:2,4,5-Trichlorophenoxyacetic_acid Graph (2,4,5-Trichlorphenoxy)essigsaeure|(2,4,5-trichlorophenoxy)acetic acid|2,4,5-T|2,4,5-Trichlorophenoxyacetic acid|2,4,5-Trichlorphenoxyessigsaeure|Esteron 245|Trioxone (2,4,5-trichlorophenoxy)acetic acid (2,4,5-Trichlorphenoxy)essigsaeure|(2,4,5-trichlorophenoxy)acetic acid|2,4,5-T|2,4,5-Trichlorophenoxyacetic acid|2,4,5-Trichlorphenoxyessigsaeure|Esteron 245|Trioxone http://purl.obolibrary.org/obo/CHEBI_27903 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27904 biolink:ChemicalEntity D-erythrose The D-enantiomer of erythrose. cas:583-50-6|hmdb:HMDB0002649|kegg.compound:C01796|knapsack:C00007412|pubmed:16901854|pubmed:22841585|pubmed:23501397|pubmed:6229527|pubmed:6238947|reaxys:5805561|wikipedia.en:Erythrose Graph (2R,3R)-2,3,4-trihydroxybutanal|D-Erythrose|D-erythro-tetrose|D-erythrose (2R,3R)-2,3,4-trihydroxybutanal|D-Erythrose|D-erythro-tetrose|D-erythrose (2R,3R)-2,3,4-trihydroxybutanal|D-Erythrose|D-erythro-tetrose|D-erythrose http://purl.obolibrary.org/obo/CHEBI_27904 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27905 biolink:ChemicalEntity phenyl hydrogen sulfate An aryl sulfate that is phenol bearing an O-sulfo substituent. cas:937-34-8|hmdb:HMDB0060015|kegg.compound:C02180|pubmed:12119069|pubmed:22770225|pubmed:22827565|pubmed:25041144|reaxys:2047161 Graph Phenol sulfate|phenyl hydrogen sulfate|phenylsulfate phenyl hydrogen sulfate Phenol sulfate|phenyl hydrogen sulfate|phenylsulfate http://purl.obolibrary.org/obo/CHEBI_27905 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27907 biolink:ChemicalEntity alpha-L-rhamnopyranose An L-rhamnopyranose having α-configuration at the anomeric centre. glygen:G38999IM|glytoucan:G38999IM|kegg.compound:C02476|knapsack:C00001129|pdb-ccd:RAM|pubmed:19443021|pubmed:23795894|pubmed:23836132|pubmed:25568069|pubmed:27091615|pubmed:31537530|pubmed:36988069|pubmed:7521740|reaxys:1680354 Graph 6-deoxy-alpha-L-mannopyranose|alpha-6-Deoxy-L-mannose|alpha-L-Mannomethylose|alpha-L-Rha|alpha-L-Rhamnose|alpha-L-Rhap|alpha-L-mannopyranose, 6-deoxy-|alpha-L-rhamnopyranose|alpha-L-rhamnose 6-deoxy-alpha-L-mannopyranose|alpha-L-rhamnopyranose 6-deoxy-alpha-L-mannopyranose|alpha-6-Deoxy-L-mannose|alpha-L-Mannomethylose|alpha-L-Rha|alpha-L-Rhamnose|alpha-L-Rhap|alpha-L-mannopyranose, 6-deoxy-|alpha-L-rhamnopyranose|alpha-L-rhamnose http://purl.obolibrary.org/obo/CHEBI_27907 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27909 biolink:ChemicalEntity paraldehyde A trioxane that is 1,3,5-trioxane substituted by methyl groups at positions 2, 4 and 6. cas:123-63-7|drugcentral:2058|gmelin:26743|hmdb:HMDB0032456|kegg.compound:C07834|kegg.drug:D00705|pubmed:13226912|pubmed:13265663|pubmed:13340987|pubmed:17364860|pubmed:23118657|reaxys:80142|wikipedia.en:Paraldehyde Graph 1,3,5-trimethyl-2,4,6-trioxane|2,4,6-trimethyl-1,3,5-trioxane|2,4,6-trimethyl-s-trioxane|Paral|Paraldehyd|Paraldehyde|acetaldehyde trimer|paraacetaldehyde|paracetaldehyde 2,4,6-trimethyl-1,3,5-trioxane 1,3,5-trimethyl-2,4,6-trioxane|2,4,6-trimethyl-1,3,5-trioxane|2,4,6-trimethyl-s-trioxane|Paral|Paraldehyd|Paraldehyde|acetaldehyde trimer|paraacetaldehyde|paracetaldehyde http://purl.obolibrary.org/obo/CHEBI_27909 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27910 biolink:ChemicalEntity 7-dehydrodesmosterol A 3β-sterol having the structure of desmosterol with an extra double bond at C-7—C-8. beilstein:2569831|cas:1715-86-2|kegg.compound:C05107|lipidmaps:LMST01010121 Graph (3beta)-cholesta-5,7,24-trien-3-ol|24-dehydroprovitamin D3|7-Dehydrodesmosterol|7-dehydrodesmosterol|Cholesta-5,7,24-triene-3beta-ol|cholesta-5,7,24-trien-3beta-ol (3beta)-cholesta-5,7,24-trien-3-ol (3beta)-cholesta-5,7,24-trien-3-ol|24-dehydroprovitamin D3|7-Dehydrodesmosterol|7-dehydrodesmosterol|Cholesta-5,7,24-triene-3beta-ol|cholesta-5,7,24-trien-3beta-ol http://purl.obolibrary.org/obo/CHEBI_27910 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27911 biolink:ChemicalEntity N(8)-acetylspermidine An acetylspermidine that is 1,8-diamino-4-azaoctane in which one of the hydrogens of the amino group attached to C-8 is replaced by an acetyl group. cas:13431-24-8|kegg.compound:C01029|metacyc.compound:CPD-3462|pubmed:12093478|pubmed:6473353|pubmed:894508|reaxys:1769094 Graph N(8)-monoacetylspermidine|N-{4-[(3-aminopropyl)amino]butyl}acetamide|N8-Acetylspermidine N-{4-[(3-aminopropyl)amino]butyl}acetamide N(8)-monoacetylspermidine|N-{4-[(3-aminopropyl)amino]butyl}acetamide|N8-Acetylspermidine http://purl.obolibrary.org/obo/CHEBI_27911 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27913 biolink:ChemicalEntity L-erythrulose beilstein:1721314|cas:533-50-6|gmelin:278483|kegg.compound:C02045 Graph (3S)-1,3,4-trihydroxybutan-2-one|L-Erythrulose|L-erythrulose|L-glycero-Tetrulose|L-glycero-tetrulose (3S)-1,3,4-trihydroxybutan-2-one|L-Erythrulose|L-erythrulose|L-glycero-Tetrulose|L-glycero-tetrulose (3S)-1,3,4-trihydroxybutan-2-one|L-Erythrulose|L-erythrulose|L-glycero-Tetrulose|L-glycero-tetrulose http://purl.obolibrary.org/obo/CHEBI_27913 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27914 biolink:ChemicalEntity hydrogenobyrinic acid a,c-diamide beilstein:5227717|kegg.compound:C06503 Graph Hydrogenobyrinate a,c diamide|Hydrogenobyrinate diamide|Hydrogenobyrinic acid a,c diamide|Hydrogenobyrinic acid a,c-diamide Hydrogenobyrinate a,c diamide|Hydrogenobyrinate diamide|Hydrogenobyrinic acid a,c diamide|Hydrogenobyrinic acid a,c-diamide http://purl.obolibrary.org/obo/CHEBI_27914 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27922 biolink:ChemicalEntity sorbose A ketohexose often involved in the commercial production of vitamin C. It has been found to occur naturally in grapes. kegg.compound:C01452|kegg.compound:C08356|pubmed:24619085|pubmed:24702787|wikipedia.en:Sorbose Graph Sorbose|xylo-Hexulose Sorbose|xylo-Hexulose http://purl.obolibrary.org/obo/CHEBI_27922 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27923 biolink:ChemicalEntity 2-acyl-sn-glycero-3-phosphoglycerol A glycerophosphoglycerol in which sn-glycerol, acylated at O2, is linked through a phospho group at O3 to O1 of glycerol. Graph 2-O-acyl-sn-glycero-3-phosphoglycerol|2-O-acyl-sn-glycero-3-phosphoglycerols|2-acyl-sn-glycero-3-phosphoglycerols 2-O-acyl-sn-glycero-3-phosphoglycerol|2-O-acyl-sn-glycero-3-phosphoglycerols|2-acyl-sn-glycero-3-phosphoglycerols http://purl.obolibrary.org/obo/CHEBI_27923 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27924 biolink:ChemicalEntity phenylhydrazine A phenylhydrazine that is the monophenyl derivative of hydrazine. cas:100-63-0|gmelin:26849|kegg.compound:C02304|metacyc.compound:PHENYLHYDRAZINE|pdb-ccd:PHZ|pubmed:19627281|pubmed:20585853|pubmed:7144447|reaxys:606080|wikipedia.en:Phenylhydrazine Graph 1-PHENYLHYDRAZINE|Hydrazinobenzene|PhNHNH2|Phenyldiazane|Phenylhydrazin|Phenylhydrazine|hydrazobenzene|monophenylhydrazine|phenylhydrazine Phenylhydrazine|phenylhydrazine 1-PHENYLHYDRAZINE|Hydrazinobenzene|PhNHNH2|Phenyldiazane|Phenylhydrazin|Phenylhydrazine|hydrazobenzene|monophenylhydrazine|phenylhydrazine http://purl.obolibrary.org/obo/CHEBI_27924 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27926 biolink:ChemicalEntity beta-D-xyloside kegg.compound:C02337 Graph beta-D-Xyloside|beta-D-xyloside|beta-D-xylosides beta-D-Xyloside|beta-D-xyloside|beta-D-xylosides http://purl.obolibrary.org/obo/CHEBI_27926 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27928 biolink:ChemicalEntity parathion beilstein:2059093|cas:56-38-2|kegg.compound:C06604|ppdb:506|umbbd.compound:c0084 Graph DNTP|O,O-Diethyl O-p-nitrophenyl phosphorothioate|O,O-diethyl O-(4-nitrophenyl) phosphorothioate|O,O-diethyl O-(4-nitrophenyl) thiophosphate|O,O-diethyl O-(p-nitrophenyl) thiophosphate|Parathion|Thiophos|diethyl p-nitrophenyl thiophosphate|diethyl parathion|ethyl parathion|phosphorothioic acid, O,O-diethyl O-(4-nitrophenyl) ester O,O-diethyl O-(4-nitrophenyl) phosphorothioate DNTP|O,O-Diethyl O-p-nitrophenyl phosphorothioate|O,O-diethyl O-(4-nitrophenyl) phosphorothioate|O,O-diethyl O-(4-nitrophenyl) thiophosphate|O,O-diethyl O-(p-nitrophenyl) thiophosphate|Parathion|Thiophos|diethyl p-nitrophenyl thiophosphate|diethyl parathion|ethyl parathion|phosphorothioic acid, O,O-diethyl O-(4-nitrophenyl) ester http://purl.obolibrary.org/obo/CHEBI_27928 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27931 biolink:ChemicalEntity alpha-maltotriose A maltotriose trisaccharide in which the glucose residue at the reducing end is in the pyranose ring form and has α configuration at the anomeric carbon atom.. beilstein:1275025|drugbank:DB03277|glygen:G96370VA|glytoucan:G96370VA|kegg.compound:C01835|pdb-ccd:MLR Graph Amylotriose|MALTOTRIOSE|Maltotriose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose|alpha-maltotriose alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose Amylotriose|MALTOTRIOSE|Maltotriose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose|alpha-maltotriose http://purl.obolibrary.org/obo/CHEBI_27931 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27933 biolink:ChemicalEntity beta-lactam antibiotic An organonitrogen heterocyclic antibiotic that contains a β-lactam ring. kegg.compound:C03438|pubmed:19254642|pubmed:22594007|wikipedia.en:Beta-lactam_antibiotic Graph beta-Lactam antibiotics|beta-lactam antibiotics beta-Lactam antibiotics|beta-lactam antibiotics http://purl.obolibrary.org/obo/CHEBI_27933 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27937 biolink:ChemicalEntity cob(II)yrinic acid a,c diamide kegg.compound:C06504 Graph Cob(II)yrinate a,c diamide|Cob(II)yrinate diamide|Cob(II)yrinic acid a,c-diamide Cob(II)yrinate a,c diamide|Cob(II)yrinate diamide|Cob(II)yrinic acid a,c-diamide http://purl.obolibrary.org/obo/CHEBI_27937 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27938 biolink:ChemicalEntity beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer A D-galactosyl-N-acetyl-D-glucosaminyl-D-galactosyl-D-glucosylceramide containing β-linkages exclusively. kegg.compound:C06136|kegg.glycan:G00124|lipidmaps:LMSP0503AB00|pubmed:10695716|pubmed:11854201|pubmed:16341241|pubmed:1724444|pubmed:17855742|pubmed:19221437|pubmed:21174147|pubmed:22638862|pubmed:2430018|pubmed:2448252|pubmed:2457654|pubmed:25748038|pubmed:28188832|pubmed:2917140|pubmed:6171919|pubmed:7186222|pubmed:7334007|pubmed:7494493|pubmed:7691279|pubmed:7693874|pubmed:7806377|pubmed:7927723|pubmed:8410057|pubmed:8799726|pubmed:9209156 Graph (Gal)2 (GalNAc)1 (Glc)1 (Cer)1|GA1|Gal-beta1->3GalNAc-beta1->4Gal-beta1->4Glc-beta1->1'Cer|Gal-beta1->3GalNAc-beta1->4LacCer|Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta1-1'Cer|Ganglio-N-tetraosylceramide|Ganglioside GA1|Gg4Cer|GgOse4Cer|N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|a ganglioside GA1 (d18:1(4E))|asialo GM1|asialo GM1 glycolipid|asialo-GM1 ganglioside|beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide (Gal)2 (GalNAc)1 (Glc)1 (Cer)1|GA1|Gal-beta1->3GalNAc-beta1->4Gal-beta1->4Glc-beta1->1'Cer|Gal-beta1->3GalNAc-beta1->4LacCer|Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta1-1'Cer|Ganglio-N-tetraosylceramide|Ganglioside GA1|Gg4Cer|GgOse4Cer|N-[(2S,3R,4E)-1-{[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]alkanamide|a ganglioside GA1 (d18:1(4E))|asialo GM1|asialo GM1 glycolipid|asialo-GM1 ganglioside|beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramides http://purl.obolibrary.org/obo/CHEBI_27938 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27941 biolink:ChemicalEntity pullulan cas:9057-02-7|kegg.compound:C00480|kegg.drug:D05363 Graph Pullulan|pullulan Pullulan|pullulan http://purl.obolibrary.org/obo/CHEBI_27941 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:27945 biolink:ChemicalEntity isoflavanone Isoflavone in which the double bond between positions 2 and 3 has been reduced to a single bond. beilstein:1621056|cas:4737-27-3|kegg.compound:C01927 Graph 2,3-dihydro-3-phenyl-4H-1-benzopyran-4-one|3-phenyl-2,3-dihydro-4H-chromen-4-one|3-phenylchroman-4-one|Isoflavanone 3-phenyl-2,3-dihydro-4H-chromen-4-one 2,3-dihydro-3-phenyl-4H-1-benzopyran-4-one|3-phenyl-2,3-dihydro-4H-chromen-4-one|3-phenylchroman-4-one|Isoflavanone http://purl.obolibrary.org/obo/CHEBI_27945 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27947 biolink:ChemicalEntity D-histidine An optically active form of histidine having D-configuration. cas:351-50-8|gmelin:83043|kegg.compound:C06419|metacyc.compound:CPD-12151|pdb-ccd:DHI|pubmed:15744050|pubmed:24852066|pubmed:80988|reaxys:84089|ymdb:YMDB00794 Graph (2R)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|(R)-alpha-Amino-1H-imidazole-4-propionic acid|D-HISTIDINE|D-Histidin|D-Histidine|D-histidine|DHI (2R)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|D-HISTIDINE|D-Histidine|D-histidine (2R)-2-amino-3-(1H-imidazol-4-yl)propanoic acid|(R)-alpha-Amino-1H-imidazole-4-propionic acid|D-HISTIDINE|D-Histidin|D-Histidine|D-histidine|DHI http://purl.obolibrary.org/obo/CHEBI_27947 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27951 biolink:ChemicalEntity (R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid A 2-oxo monocarboxylic acid that is 2-oxobutanoic acid which is substituted by a phosphonooxy group at position 4 and a hydroxy group at the 3-pro-R position. kegg.compound:C06054 Graph (3R)-3-Hydroxy-2-oxo-4-phosphonooxybutanoate|(3R)-3-hydroxy-2-oxo-4-(phosphonooxy)butanoic acid|2-Oxo-3-hydroxy-4-phosphobutanoate|alpha-Keto-3-hydroxy-4-phosphobutyrate (3R)-3-hydroxy-2-oxo-4-(phosphonooxy)butanoic acid (3R)-3-Hydroxy-2-oxo-4-phosphonooxybutanoate|(3R)-3-hydroxy-2-oxo-4-(phosphonooxy)butanoic acid|2-Oxo-3-hydroxy-4-phosphobutanoate|alpha-Keto-3-hydroxy-4-phosphobutyrate http://purl.obolibrary.org/obo/CHEBI_27951 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27953 biolink:ChemicalEntity physostigmine beilstein:91230|cas:57-47-6|cas:57-64-7|drugbank:DB00981|drugcentral:2159|kegg.compound:C06535|kegg.drug:D00196|knapsack:C00001757|lincs.smallmolecule:LSM-2558 Graph (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate|Antilirium|Eserine|Physostigmine|Physostol (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate|Antilirium|Eserine|Physostigmine|Physostol http://purl.obolibrary.org/obo/CHEBI_27953 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27955 biolink:ChemicalEntity streptamine An amino cyclitol consisting of scyllo-inositol with the hydroxy groups at positions 1 and 3 replaced by unsubstituted amino groups. beilstein:26714|cas:488-52-8|kegg.compound:C01854|reaxys:2802452 Graph (1R,2r,3S,4R,5s,6S)-4,6-diaminocyclohexane-1,2,3,5-tetrol|1,3-diamino-1,3-dideoxy-scyllo-inositol|Streptamine (1R,2r,3S,4R,5s,6S)-4,6-diaminocyclohexane-1,2,3,5-tetrol|1,3-diamino-1,3-dideoxy-scyllo-inositol (1R,2r,3S,4R,5s,6S)-4,6-diaminocyclohexane-1,2,3,5-tetrol|1,3-diamino-1,3-dideoxy-scyllo-inositol|Streptamine http://purl.obolibrary.org/obo/CHEBI_27955 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27956 biolink:ChemicalEntity L-dehydroascorbic acid Dehydroascorbic acid having the L-configuration. cas:490-83-5|gmelin:51038|hmdb:HMDB0001264|kegg.compound:C05422|knapsack:C00007380|pubmed:15013385|pubmed:18813862|pubmed:23543734|pubmed:9506998|reaxys:84277|wikipedia.en:Dehydroascorbic_acid Graph (5R)-5-[(1S)-1,2-dihydroxyethyl]furan-2,3,4(5H)-trione|DHAA|Dehydroascorbic acid|L-Dehydroascorbate|L-Dehydroascorbic acid|L-threo-2,3-hexodiulosonic acid, gamma-lactone|L-threo-hexo-2,3-diulosono-1,4-lactone|dehydro-L-ascorbic acid|dehydroascorbic acid|oxidized ascorbic acid|oxidized vitamin C (5R)-5-[(1S)-1,2-dihydroxyethyl]furan-2,3,4(5H)-trione (5R)-5-[(1S)-1,2-dihydroxyethyl]furan-2,3,4(5H)-trione|DHAA|Dehydroascorbic acid|L-Dehydroascorbate|L-Dehydroascorbic acid|L-threo-2,3-hexodiulosonic acid, gamma-lactone|L-threo-hexo-2,3-diulosono-1,4-lactone|dehydro-L-ascorbic acid|dehydroascorbic acid|oxidized ascorbic acid|oxidized vitamin C http://purl.obolibrary.org/obo/CHEBI_27956 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27957 biolink:ChemicalEntity hydroxyacetone A propanone that is acetone in which one of the methyl hydrogens is replaced by a hydroxy group. cas:116-09-6|hmdb:HMDB0006961|kegg.compound:C05235|knapsack:C00019558|metacyc.compound:ACETOL|pubmed:23363738|reaxys:605368 Graph 1-Hydroxy-2-propanone|1-hydroxy-2-propanone|1-hydroxypropan-2-one|2-Ketopropyl alcohol|2-ketopropyl alcohol|Acetol|Acetone alcohol|Hydroxyacetone|Methylketol|Pyruvic alcohol|Pyruvinalcohol|hydroxyacetone 1-hydroxypropan-2-one 1-Hydroxy-2-propanone|1-hydroxy-2-propanone|1-hydroxypropan-2-one|2-Ketopropyl alcohol|2-ketopropyl alcohol|Acetol|Acetone alcohol|Hydroxyacetone|Methylketol|Pyruvic alcohol|Pyruvinalcohol|hydroxyacetone http://purl.obolibrary.org/obo/CHEBI_27957 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27958 biolink:ChemicalEntity cocaine A tropane alkaloid obtained from leaves of the South American shrub Erythroxylon coca. beilstein:3621912|cas:50-36-2|drugbank:DB00907|drugcentral:723|gmelin:170209|kegg.compound:C01416|kegg.drug:D00110|knapsack:C00002285|metacyc.compound:CPD-9776|pdb-ccd:COC|pubmed:11416615|pubmed:11853120|pubmed:14962054|pubmed:17551070|pubmed:19536276|pubmed:21150772|pubmed:25303034|reaxys:5291037|reaxys:91034|wikipedia.en:Cocaine Graph (-)-cocaine|(1R,2R,3S,5S)-2-(methoxycarbonyl)tropan-3-yl benzoate|2-methyl-3beta-hydroxy-1alphaH,5alphaH-tropane-2beta-carboxylate benzoate (ester)|Benzoylmethylecgonine|COCAINE|Cocain|Cocaina|Cocaine|Kokain|Neurocaine|[1R-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid, methyl ester|beta-Cocain|cocainum|l-Cocain|l-cocaine|methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate|methyl [1R-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate|methyl benzoylecgonine (1R,2R,3S,5S)-2-(methoxycarbonyl)tropan-3-yl benzoate|methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate (-)-cocaine|(1R,2R,3S,5S)-2-(methoxycarbonyl)tropan-3-yl benzoate|2-methyl-3beta-hydroxy-1alphaH,5alphaH-tropane-2beta-carboxylate benzoate (ester)|Benzoylmethylecgonine|COCAINE|Cocain|Cocaina|Cocaine|Kokain|Neurocaine|[1R-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid, methyl ester|beta-Cocain|cocainum|l-Cocain|l-cocaine|methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate|methyl [1R-(exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate|methyl benzoylecgonine http://purl.obolibrary.org/obo/CHEBI_27958 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27961 biolink:ChemicalEntity 1,8-cineole beilstein:105109|beilstein:5239941|cas:470-82-6|drugbank:DB03852|gmelin:131076|kegg.compound:C09844|kegg.drug:D04115|knapsack:C00000136|pdb-ccd:CNL|wikipedia.en:Eucalyptol Graph 1,3,3-TRIMETHYL-2-OXABICYCLO[2.2.2]OCTANE|1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane|1,8-Cineol|1,8-Cineole|1,8-cineole|1,8-epoxy-p-menthane|1,8-oxido-p-menthane|Zineol|cajeputol|cineole|eucalyptol 1,3,3-TRIMETHYL-2-OXABICYCLO[2.2.2]OCTANE|1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane 1,3,3-TRIMETHYL-2-OXABICYCLO[2.2.2]OCTANE|1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane|1,8-Cineol|1,8-Cineole|1,8-cineole|1,8-epoxy-p-menthane|1,8-oxido-p-menthane|Zineol|cajeputol|cineole|eucalyptol http://purl.obolibrary.org/obo/CHEBI_27961 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27963 biolink:ChemicalEntity (Kdo)2-lipid A (E. coli) beilstein:8896076|kegg.compound:C06026|lipidmaps:LMSL02000001 Graph (Kdo)2-lipid A|3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|Di[3-deoxy-D-manno-octulosonyl]-lipid A|KDO2-lipid (A) 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose (Kdo)2-lipid A|3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-2-[(3R)-3-(dodecanoyloxy)tetradecanamido]-4-O-phosphono-3-O-[(3R)-3-(tetradecanoyloxy)tetradecanoyl]-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|Di[3-deoxy-D-manno-octulosonyl]-lipid A|KDO2-lipid (A) http://purl.obolibrary.org/obo/CHEBI_27963 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27964 biolink:ChemicalEntity 5-methyldeoxycytidine 5'-(trihydrogen diphosphate) kegg.compound:C04187 Graph 2'-deoxy-5-methylcytidine 5'-(trihydrogen diphosphate)|5-Methyldeoxycytidine diphosphate|5-methyldeoxycytidine diphosphate 2'-deoxy-5-methylcytidine 5'-(trihydrogen diphosphate) 2'-deoxy-5-methylcytidine 5'-(trihydrogen diphosphate)|5-Methyldeoxycytidine diphosphate|5-methyldeoxycytidine diphosphate http://purl.obolibrary.org/obo/CHEBI_27964 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27967 biolink:ChemicalEntity 11beta-hydroxyandrost-4-ene-3,17-dione cas:382-44-5|kegg.compound:C05284|lipidmaps:LMST02020066 Graph 11-beta-hydroxyandrost-4-ene-3,17-dione|11beta-Hydroxy-4-androstene-3,17-dione|11beta-Hydroxyandrost-4-ene-3,17-dione|11beta-hydroxyandrost-4-ene-3,17-dione|4-Androsten-11beta-ol-3,17-dione|4-androsten-11beta-ol-3,17-dione|Androst-4-ene-3,17-dione-11beta-ol 11beta-Hydroxyandrost-4-ene-3,17-dione|11beta-hydroxyandrost-4-ene-3,17-dione 11-beta-hydroxyandrost-4-ene-3,17-dione|11beta-Hydroxy-4-androstene-3,17-dione|11beta-Hydroxyandrost-4-ene-3,17-dione|11beta-hydroxyandrost-4-ene-3,17-dione|4-Androsten-11beta-ol-3,17-dione|4-androsten-11beta-ol-3,17-dione|Androst-4-ene-3,17-dione-11beta-ol http://purl.obolibrary.org/obo/CHEBI_27967 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27972 biolink:ChemicalEntity 2-deoxy-D-gluc-5-ulosonic acid kegg.compound:C06892 Graph 2-Deoxy-5-keto-D-gluconic acid|2-deoxy-D-threo-hex-5-ulosonic acid|5-dehydro-2-deoxy-D-gluconic acid|DKH 2-deoxy-D-threo-hex-5-ulosonic acid 2-Deoxy-5-keto-D-gluconic acid|2-deoxy-D-threo-hex-5-ulosonic acid|5-dehydro-2-deoxy-D-gluconic acid|DKH http://purl.obolibrary.org/obo/CHEBI_27972 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27973 biolink:ChemicalEntity D-arabino-hex-3-ulose 6-phosphate cas:53010-97-2|kegg.compound:C06019 Graph 6-O-phosphono-D-arabino-hex-3-ulose|A-3-H-6-P|Arabino-3-hexulose-6-phosphate|D-Arabino-3-hexulose, 6-(dihydrogen phosphate)|D-arabino-3-Hexulose 6-phosphate|D-arabino-6-Phospho-hex-3-ulose|D-arabino-hex-3-ulose 6-(dihydrogen phosphate) D-arabino-hex-3-ulose 6-(dihydrogen phosphate) 6-O-phosphono-D-arabino-hex-3-ulose|A-3-H-6-P|Arabino-3-hexulose-6-phosphate|D-Arabino-3-hexulose, 6-(dihydrogen phosphate)|D-arabino-3-Hexulose 6-phosphate|D-arabino-6-Phospho-hex-3-ulose|D-arabino-hex-3-ulose 6-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_27973 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27974 biolink:ChemicalEntity estriol A 3-hydroxy steroid that is estra-1,3,5(10)-trien-3-ol substituted by additional hydroxy groups at positions 16 and 17 (16α,17β-stereoisomer). cas:50-27-1|drugbank:DB04573|drugcentral:3187|hmdb:HMDB0000153|kegg.compound:C05141|kegg.drug:D00185|lincs.smallmolecule:LSM-2368|lipidmaps:LMST02010003|metacyc.compound:ESTRIOL|pdb-ccd:ESL|pubmed:11133265|pubmed:23777262|pubmed:9373313|reaxys:2508172|vsdb:1907|wikipedia.en:Estriol Graph (16alpha,17beta)-estra-1,3,5(10)-triene-3,16,17-triol|1,3,5(10)-Estratriene-3,16-alpha,17beta-triol|16-alpha,17-beta-estriol|16alpha-hydroxyestradiol|3,16alpha,17beta-trihydroxy-Delta(1,3,5)-estratriene|ESTRIOL|Estriel|Estriol|Oestriol|estra-1,3,5(10)-triene-3,16alpha,17beta-triol|oestriol|trihydroxyestrin estra-1,3,5(10)-triene-3,16alpha,17beta-triol (16alpha,17beta)-estra-1,3,5(10)-triene-3,16,17-triol|1,3,5(10)-Estratriene-3,16-alpha,17beta-triol|16-alpha,17-beta-estriol|16alpha-hydroxyestradiol|3,16alpha,17beta-trihydroxy-Delta(1,3,5)-estratriene|ESTRIOL|Estriel|Estriol|Oestriol|estra-1,3,5(10)-triene-3,16alpha,17beta-triol|oestriol|trihydroxyestrin http://purl.obolibrary.org/obo/CHEBI_27974 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27975 biolink:ChemicalEntity L-glyceraldehyde The L-enantiomer of glyceraldehyde. cas:497-09-6|ecmdb:ECMDB20580|kegg.compound:C02426|reaxys:1720475 Graph (2S)-2,3-dihydroxypropanal|(S)-2,3-dihydroxypropanal|L-(-)-glyceraldehyde|L-2,3-Dihydroxypropanal|L-2,3-Dihydroxypropionaldehyde|L-Aldotriose|L-Glyceraldehyde|L-Glycerose|L-glyceraldehyde (2S)-2,3-dihydroxypropanal (2S)-2,3-dihydroxypropanal|(S)-2,3-dihydroxypropanal|L-(-)-glyceraldehyde|L-2,3-Dihydroxypropanal|L-2,3-Dihydroxypropionaldehyde|L-Aldotriose|L-Glyceraldehyde|L-Glycerose|L-glyceraldehyde http://purl.obolibrary.org/obo/CHEBI_27975 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27978 biolink:ChemicalEntity 3,4-dihydroxyphenylacetaldehyde A phenylacetaldehyde in which the 3 and 4 positions of the phenyl group are substituted by hydroxy groups. cas:5707-55-1|foodb.food:FDB023227|hmdb:HMDB0003791|kegg.compound:C04043|knapsack:C00052036|metacyc.compound:34-DIHYDROXYPHENYLACETALDEHYDE|pubmed:12729575|pubmed:14556942|pubmed:17379813|pubmed:19537779|reaxys:1941234|wikipedia.en:3,4-Dihydroxyphenylacetaldehyde Graph (3,4-dihydroxyphenyl)acetaldehyde|2-(3,4-dihydroxyphenyl)ethanal|3,4-Dihydroxyphenylacetaldehyde|3,4-dihydroxyphenylacetaldehyde|DOPAL|Protocatechuatealdehyde (3,4-dihydroxyphenyl)acetaldehyde (3,4-dihydroxyphenyl)acetaldehyde|2-(3,4-dihydroxyphenyl)ethanal|3,4-Dihydroxyphenylacetaldehyde|3,4-dihydroxyphenylacetaldehyde|DOPAL|Protocatechuatealdehyde http://purl.obolibrary.org/obo/CHEBI_27978 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27979 biolink:ChemicalEntity all-cis-icosa-8,11,14-trienoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of all-cis-icosa-8,11,14-trienoic acid. hmdb:HMDB0003947|kegg.compound:C03595|lipidmaps:LMFA07050011|pubmed:3426550 Graph (8Z,11Z,14Z)-Icosatrienoyl-CoA|(8Z,11Z,14Z)-eicosatrienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|8,11,14-Eicosatrienoyl-CoA|8,11,14-Icosatrienoyl-CoA|8Z,11Z,14Z-eicosatrienoyl-CoA|8Z,11Z,14Z-icosatrienoyl-CoA|CoA[20:3(8Z,11Z,14Z)]|all-cis-eicosa-8,11,14-trienoyl-CoA|all-cis-eicosa-8,11,14-trienoyl-coenzyme A|all-cis-icosa-8,11,14-trienoyl-CoA|all-cis-icosa-8,11,14-trienoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (8Z,11Z,14Z)-Icosatrienoyl-CoA|(8Z,11Z,14Z)-eicosatrienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|8,11,14-Eicosatrienoyl-CoA|8,11,14-Icosatrienoyl-CoA|8Z,11Z,14Z-eicosatrienoyl-CoA|8Z,11Z,14Z-icosatrienoyl-CoA|CoA[20:3(8Z,11Z,14Z)]|all-cis-eicosa-8,11,14-trienoyl-CoA|all-cis-eicosa-8,11,14-trienoyl-coenzyme A|all-cis-icosa-8,11,14-trienoyl-CoA|all-cis-icosa-8,11,14-trienoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_27979 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27983 biolink:ChemicalEntity 4,6-diamino-5-formamidopyrimidine A member of the class of aminopyrimidines that is 4,6-diaminopyrimidine bearing an additional formamido substituent at position 5. A DNA lesion formed when DNA exposed to ionising radiation. cas:5122-36-1|hmdb:HMDB0004816|kegg.compound:C06502|pubmed:23685671|reaxys:149617 Graph 4,6-Diamino-5-(formylamino)pyrimidine|4,6-Diamino-5-N-formamidopyrimidine|4,6-Diamino-5-formamidopyrimidine|4,6-Diamino-5-pyrimidinylformamide|FAPY|FAPy-adenine|Fapyade|N-(4,6-diaminopyrimidin-5-yl)formamide N-(4,6-diaminopyrimidin-5-yl)formamide 4,6-Diamino-5-(formylamino)pyrimidine|4,6-Diamino-5-N-formamidopyrimidine|4,6-Diamino-5-formamidopyrimidine|4,6-Diamino-5-pyrimidinylformamide|FAPY|FAPy-adenine|Fapyade|N-(4,6-diaminopyrimidin-5-yl)formamide http://purl.obolibrary.org/obo/CHEBI_27983 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27991 biolink:ChemicalEntity benzonitrile A nitrile that is hydrogen cyanide in which the hydrogen has been replaced by a phenyl group. beilstein:506893|cas:100-47-0|gmelin:2653|kegg.compound:C09814|metacyc.compound:CPD-15582|pubmed:24129580|umbbd.compound:c0367|wikipedia.en:Benzonitrile Graph Benzonitrile|C6H5-CN|Cyanobenzene|Phenyl cyanide|benzenenitrile|benzoic acid nitrile|benzonitrile|phenyl cyanide Benzonitrile|Phenyl cyanide|benzonitrile|phenyl cyanide Benzonitrile|C6H5-CN|Cyanobenzene|Phenyl cyanide|benzenenitrile|benzoic acid nitrile|benzonitrile|phenyl cyanide http://purl.obolibrary.org/obo/CHEBI_27991 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27993 biolink:ChemicalEntity 1,2-di-O-sinapoyl-beta-D-glucose An O-acyl carbohydrate that is β-D-glucose carrying sinapoyl groups at the 1- and 2-positions. kegg.compound:C04275|reaxys:6993672 Graph 1,2-Bis-O-sinapoyl-beta-D-glucoside|1,2-bis-O-sinapoyl-beta-D-glucoside|1,2-di-O-sinapoyl beta-D-glucose|1-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-2-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-beta-D-glucopyranose|sinapoyl 2-O-sinapoyl-beta-D-glucoside 1-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-2-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-beta-D-glucopyranose 1,2-Bis-O-sinapoyl-beta-D-glucoside|1,2-bis-O-sinapoyl-beta-D-glucoside|1,2-di-O-sinapoyl beta-D-glucose|1-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-2-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-beta-D-glucopyranose|sinapoyl 2-O-sinapoyl-beta-D-glucoside http://purl.obolibrary.org/obo/CHEBI_27993 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27994 biolink:ChemicalEntity luteolin 7-O-beta-D-glucoside A glycosyloxyflavone that is luteolin substituted by a β-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. cas:5373-11-5|hmdb:HMDB0035588|kegg.compound:C03951|knapsack:C00004266|lipidmaps:LMPK12110642|metacyc.compound:LUTEOLIN-7-O-BETA-D-GLUCOSIDE|patent:CN101474196|patent:US2011207684|pubmed:20127879|pubmed:22741463|pubmed:23019878|pubmed:7875536|reaxys:66982|wikipedia.en:Cynaroside Graph 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|2-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-4H-1-benzopyran-4-one|7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(3,4-dihydroxyphenyl)-4H-chromen-4-one|7-Glucoluteolin|7-Glucosylluteolin|7-O-beta-D-Glucosyl-5,7,3',4'-tetrahydroxyflavone|Cinaroside|Cynaroside|Luteolin 7-O-beta-D-glucoside|Luteolin 7-O-glucopyranoside|Luteolin 7-O-glucoside|Luteolin 7-glucoside|Luteolin 7-monoglucoside|Luteolin-7-glucoside|Luteoloside 7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(3,4-dihydroxyphenyl)-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|2-(3,4-dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-4H-1-benzopyran-4-one|7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(3,4-dihydroxyphenyl)-4H-chromen-4-one|7-Glucoluteolin|7-Glucosylluteolin|7-O-beta-D-Glucosyl-5,7,3',4'-tetrahydroxyflavone|Cinaroside|Cynaroside|Luteolin 7-O-beta-D-glucoside|Luteolin 7-O-glucopyranoside|Luteolin 7-O-glucoside|Luteolin 7-glucoside|Luteolin 7-monoglucoside|Luteolin-7-glucoside|Luteoloside http://purl.obolibrary.org/obo/CHEBI_27994 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27996 biolink:ChemicalEntity (R)-4-hydroxymandelate kegg.compound:C05343 Graph (2R)-hydroxy(4-hydroxyphenyl)acetate (2R)-hydroxy(4-hydroxyphenyl)acetate (2R)-hydroxy(4-hydroxyphenyl)acetate http://purl.obolibrary.org/obo/CHEBI_27996 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27997 biolink:ChemicalEntity elaidic acid A 9-octadecenoic acid and the trans-isomer of oleic acid. cas:112-79-8|gmelin:171874|hmdb:HMDB0000573|kegg.compound:C01712|lipidmaps:LMFA01030073|pdb-ccd:ELA|pubmed:10342226|pubmed:23601386|pubmed:24800387|pubmed:8018112|pubmed:881948|reaxys:1726543|wikipedia.en:Elaidic_acid Graph (9E)-Octadecenoic acid|(9E)-octadec-9-enoic acid|(E)-Oleic acid|9-OCTADECENOIC ACID|9-Octadecenoic acid, (E)-|9-trans-Octadecenoic acid|Acide elaidique|D9-trans-Octadecenoic acid|Elaidic acid|Elaidinsaeure|Elaidinsaure|trans-9-Octadecenoic acid|trans-D9-Octadecenoic acid|trans-Delta(9)-octadecenoic acid|trans-Elaidic acid|trans-Oleic acid (9E)-octadec-9-enoic acid (9E)-Octadecenoic acid|(9E)-octadec-9-enoic acid|(E)-Oleic acid|9-OCTADECENOIC ACID|9-Octadecenoic acid, (E)-|9-trans-Octadecenoic acid|Acide elaidique|D9-trans-Octadecenoic acid|Elaidic acid|Elaidinsaeure|Elaidinsaure|trans-9-Octadecenoic acid|trans-D9-Octadecenoic acid|trans-Delta(9)-octadecenoic acid|trans-Elaidic acid|trans-Oleic acid http://purl.obolibrary.org/obo/CHEBI_27997 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27998 biolink:ChemicalEntity tungsten cas:7440-33-7|gmelin:16317|kegg.compound:C00753|pdb-ccd:W|webelements:W Graph 74W|Tungsten|W|Wolfram|tungsten|tungsten atom|tungstene|tungsteno|volframio|wolfram|wolframio|wolframium Tungsten|tungsten|wolfram 74W|Tungsten|W|Wolfram|tungsten|tungsten atom|tungstene|tungsteno|volframio|wolfram|wolframio|wolframium http://purl.obolibrary.org/obo/CHEBI_27998 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:27999 biolink:ChemicalEntity tolbutamide An N-sulfonylurea that consists of 1-butylurea having a tosyl group attached at the 3-position. cas:64-77-7|drugbank:DB01124|drugcentral:2696|kegg.compound:C07148|kegg.drug:D00380|lincs.smallmolecule:LSM-3907|patent:DE1066575|patent:GB808071|patent:US2968158|pubmed:11835228|pubmed:11840346|pubmed:11911494|pubmed:12042355|pubmed:12355256|pubmed:15207658|pubmed:15317941|pubmed:15620874|pubmed:15655519|pubmed:16290322|pubmed:16426753|pubmed:19059420|pubmed:20880646|pubmed:21178111|pubmed:21193530|pubmed:21471135|pubmed:21535124|pubmed:21712613|pubmed:21757329|pubmed:21827497|pubmed:21831467|pubmed:22028182|pubmed:22079696|reaxys:1984428|wikipedia.en:Tolbutamide Graph 1-Butyl-3-(p-methylphenylsulfonyl)urea|1-Butyl-3-(p-tolylsulfonyl)urea|1-Butyl-3-tosylurea|1-p-Toluenesulfonyl-3-butylurea|3-(p-Tolyl-4-sulfonyl)-1-butylurea|N-(4-Methylbenzenesulfonyl)-N'-butylurea|N-(4-Methylphenylsulfonyl)-N'-butylurea|N-(Sulfonyl-p-methylbenzene)-N'-N-butylurea|N-(p-Methylbenzenesulfonyl)-N'-butylurea|N-Butyl-N'-(4-methylphenylsulfonyl)urea|N-Butyl-N'-(p-tolylsulfonyl)urea|N-Butyl-N'-p-toluenesulfonylurea|N-[(butylamino)carbonyl]-4-methylbenzenesulfonamide|N-n-Butyl-N'-tosylurea|Orinase (TN)|Tolbutamide|Tolylsulfonylbutylurea|tolbutamida|tolbutamide|tolbutamidum N-[(butylamino)carbonyl]-4-methylbenzenesulfonamide 1-Butyl-3-(p-methylphenylsulfonyl)urea|1-Butyl-3-(p-tolylsulfonyl)urea|1-Butyl-3-tosylurea|1-p-Toluenesulfonyl-3-butylurea|3-(p-Tolyl-4-sulfonyl)-1-butylurea|N-(4-Methylbenzenesulfonyl)-N'-butylurea|N-(4-Methylphenylsulfonyl)-N'-butylurea|N-(Sulfonyl-p-methylbenzene)-N'-N-butylurea|N-(p-Methylbenzenesulfonyl)-N'-butylurea|N-Butyl-N'-(4-methylphenylsulfonyl)urea|N-Butyl-N'-(p-tolylsulfonyl)urea|N-Butyl-N'-p-toluenesulfonylurea|N-[(butylamino)carbonyl]-4-methylbenzenesulfonamide|N-n-Butyl-N'-tosylurea|Orinase (TN)|Tolbutamide|Tolylsulfonylbutylurea|tolbutamida|tolbutamide|tolbutamidum http://purl.obolibrary.org/obo/CHEBI_27999 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28 biolink:ChemicalEntity (R)-linalool The (R)-enantiomer of linalool. beilstein:4290982|cas:126-91-0|kegg.compound:C11388|knapsack:C00003047|lipidmaps:LMPR0102010013|pubmed:18579302|reaxys:1721487 Graph (-)-3,7-dimethyl-1,6-octadien-3-ol|(-)-Linalool|(3R)-3,7-dimethyl-1,6-octadien-3-ol|(3R)-3,7-dimethylocta-1,6-dien-3-ol|(3R)-Linalool|(R)-(-)-Linalool|(R)-3,7-dimethyl-1,6-octadien-3-ol|(R)-linalool (3R)-3,7-dimethylocta-1,6-dien-3-ol (-)-3,7-dimethyl-1,6-octadien-3-ol|(-)-Linalool|(3R)-3,7-dimethyl-1,6-octadien-3-ol|(3R)-3,7-dimethylocta-1,6-dien-3-ol|(3R)-Linalool|(R)-(-)-Linalool|(R)-3,7-dimethyl-1,6-octadien-3-ol|(R)-linalool http://purl.obolibrary.org/obo/CHEBI_28 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28000 biolink:ChemicalEntity N-acetyl-D-hexosaminide kegg.compound:C03879 Graph N-Acetyl-beta-D-hexosaminide|N-acetyl-D-hexosaminides N-Acetyl-beta-D-hexosaminide|N-acetyl-D-hexosaminides http://purl.obolibrary.org/obo/CHEBI_28000 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28001 biolink:ChemicalEntity vancomycin A complex glycopeptide from Streptomyces orientalis. It inhibits a specific step in the synthesis of the peptidoglycan layer in the Gram-positive bacteria Staphylococcus aureus and Clostridium difficile. cas:1404-90-6|drugbank:DB00512|drugcentral:2807|kegg.compound:C06689|kegg.drug:D00212|knapsack:C00016052|metacyc.compound:CPD-12245|patent:US3067099|pdb-ccd:VAN|pubmed:11028184|pubmed:11408222|pubmed:11688538|pubmed:11864951|pubmed:11886013|pubmed:11980329|pubmed:12019070|pubmed:12541895|pubmed:12852813|pubmed:13370625|pubmed:13521912|pubmed:14605050|pubmed:14702667|pubmed:15047516|pubmed:15081082|pubmed:15465645|pubmed:15590714|pubmed:15792257|pubmed:16183423|pubmed:16184232|pubmed:16420976|pubmed:16596002|pubmed:16720708|pubmed:17027219|pubmed:17184835|pubmed:17299012|pubmed:17594206|pubmed:18030187|pubmed:18159039|pubmed:18162343|pubmed:18260149|pubmed:18361944|pubmed:18462092|pubmed:18582342|pubmed:18817166|pubmed:18983037|pubmed:19107100|pubmed:19830166|pubmed:20956604|pubmed:21109901|pubmed:21458937|pubmed:21466775|pubmed:21664803|pubmed:21719238|pubmed:21951032|pubmed:22011388|pubmed:22015328|pubmed:22027450|pubmed:22124537|reaxys:3132|wikipedia.en:Vancomycin Graph (1S,2R,18R,22S,25R,28R,40S)-22-(2-amino-2-oxoethyl)-48-[2-O-(3-amino-2,3,6-trideoxy-3-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyloxy]-5,15-dichloro-2,18,32,35,37-pentahydroxy-19-[(N-methyl-D-leucyl)amino]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.2(3,6).2(14,17).1(8,12).1(29,33).0(10,25).0(34,39)]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid|(2.2Sp,3.5Sa,2.6Sp)-O(4.2),C(3.4):C(5.4),O(4.6):C(3.5),C(2.7)-tricyclo[N-methyl-D-leucyl-3-chloro-(R)-beta-hydroxy-D-tyrosyl-L-asparaginyl-D-2-(4-{[2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl]oxy}phenyl)glycyl-D-2-(4-hydroxyphenyl)glycyl-3-chloro-(R)-beta-hydroxy-L-tyrosyl-L-2-(3,5-dihydroxyphenyl)glycine]|(3S,6R,7R,11R,23S,26S,30aS,36R,38aR)-44-[2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyloxy]-3-(carbamoylmethyl)-10,19-dichloro-2,3,4,5,6,7,23,25,26,36,37,38,38a-tetradecahydro-7,22,28,30,32-pentahydroxy-6-(N-methyl-D-leucyl)-2,5,24,38,39-pentaoxo-1H,22H-23,36-(epiminomethano)-8,11:18,21-dietheno-13,16:31,35-di(metheno)[1,6,9]oxadiazacyclohexadecino[4,5-m][10,2,16]benzoxadiazacyclotetracosine-26-carboxylic acid|VANCOMYCIN|Vancocin|Vancomycin|vancomicin|vancomicina|vancomycin|vancomycine|vancomycinum (3S,6R,7R,11R,23S,26S,30aS,36R,38aR)-44-[2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyloxy]-3-(carbamoylmethyl)-10,19-dichloro-2,3,4,5,6,7,23,25,26,36,37,38,38a-tetradecahydro-7,22,28,30,32-pentahydroxy-6-(N-methyl-D-leucyl)-2,5,24,38,39-pentaoxo-1H,22H-23,36-(epiminomethano)-8,11:18,21-dietheno-13,16:31,35-di(metheno)[1,6,9]oxadiazacyclohexadecino[4,5-m][10,2,16]benzoxadiazacyclotetracosine-26-carboxylic acid (1S,2R,18R,22S,25R,28R,40S)-22-(2-amino-2-oxoethyl)-48-[2-O-(3-amino-2,3,6-trideoxy-3-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyloxy]-5,15-dichloro-2,18,32,35,37-pentahydroxy-19-[(N-methyl-D-leucyl)amino]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.2(3,6).2(14,17).1(8,12).1(29,33).0(10,25).0(34,39)]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid|(2.2Sp,3.5Sa,2.6Sp)-O(4.2),C(3.4):C(5.4),O(4.6):C(3.5),C(2.7)-tricyclo[N-methyl-D-leucyl-3-chloro-(R)-beta-hydroxy-D-tyrosyl-L-asparaginyl-D-2-(4-{[2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl]oxy}phenyl)glycyl-D-2-(4-hydroxyphenyl)glycyl-3-chloro-(R)-beta-hydroxy-L-tyrosyl-L-2-(3,5-dihydroxyphenyl)glycine]|(3S,6R,7R,11R,23S,26S,30aS,36R,38aR)-44-[2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyloxy]-3-(carbamoylmethyl)-10,19-dichloro-2,3,4,5,6,7,23,25,26,36,37,38,38a-tetradecahydro-7,22,28,30,32-pentahydroxy-6-(N-methyl-D-leucyl)-2,5,24,38,39-pentaoxo-1H,22H-23,36-(epiminomethano)-8,11:18,21-dietheno-13,16:31,35-di(metheno)[1,6,9]oxadiazacyclohexadecino[4,5-m][10,2,16]benzoxadiazacyclotetracosine-26-carboxylic acid|VANCOMYCIN|Vancocin|Vancomycin|vancomicin|vancomicina|vancomycin|vancomycine|vancomycinum http://purl.obolibrary.org/obo/CHEBI_28001 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28002 biolink:ChemicalEntity (3Z,6Z)-dodecadienoyl-CoA A medium-chain unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of cis,cis-dodeca-3,6-dienoic acid. hmdb:HMDB0003952|kegg.compound:C05280 Graph (3Z,6Z)-dodecadienoyl-CoA(4-)cis,cis-dodeca-3,6-dienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3Z,6Z)-dodeca-3,6-dienoyl]sulfanyl}ethyl)amino]-3-hydroxy-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|cis,cis-3,6-Dodecadienoyl-CoA|cis,cis-3,6-dodecadienoyl-coenzyme A|cis,cis-dodeca-3,6-dienoyl-CoA|cis,cis-dodeca-3,6-dienoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3Z,6Z)-dodeca-3,6-dienoyl]sulfanyl}ethyl)amino]-3-hydroxy-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (3Z,6Z)-dodecadienoyl-CoA(4-)cis,cis-dodeca-3,6-dienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(3Z,6Z)-dodeca-3,6-dienoyl]sulfanyl}ethyl)amino]-3-hydroxy-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|cis,cis-3,6-Dodecadienoyl-CoA|cis,cis-3,6-dodecadienoyl-coenzyme A|cis,cis-dodeca-3,6-dienoyl-CoA|cis,cis-dodeca-3,6-dienoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28002 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28009 biolink:ChemicalEntity N-acetyl-beta-D-glucosamine An N-acetyl-D-glucosamine having β-configuration at the anomeric centre. cas:7512-17-6|drugcentral:4615|glygen:G49108TO|glytoucan:G49108TO|gmelin:721281|hmdb:HMDB0000803|kegg.compound:C03878|pdb-ccd:NAG|pdb:2FIK|pdb:2Q86|pubmed:15692805|pubmed:16537470|pubmed:17991151|pubmed:18295796|pubmed:19443021|pubmed:25568069|pubmed:31537530|pubmed:32568414|pubmed:7521740|reaxys:1247660 Graph 2-(acetylamino)-2-deoxy-beta-D-glucopyranose|2-Acetamido-2-deoxy-D-glucose|2-Acetylamino-2-deoxy-D-glucose|2-acetamido-2-deoxy-beta-D-glucopyranose|2-acetamido-2-deoxyhexopyranose|Acetylglucosamine|GlcNAc-beta|N-Acetyl-D-glucosamine|N-Acetyl-beta-D-glucosamine|N-acetyl-beta-D-glucosamine|N-acetylglucosamine|beta-D-glucopyranose, 2-(acetylamino)-2-deoxy-|betaGlcNAc 2-acetamido-2-deoxy-beta-D-glucopyranose|2-acetamido-2-deoxyhexopyranose 2-(acetylamino)-2-deoxy-beta-D-glucopyranose|2-Acetamido-2-deoxy-D-glucose|2-Acetylamino-2-deoxy-D-glucose|2-acetamido-2-deoxy-beta-D-glucopyranose|2-acetamido-2-deoxyhexopyranose|Acetylglucosamine|GlcNAc-beta|N-Acetyl-D-glucosamine|N-Acetyl-beta-D-glucosamine|N-acetyl-beta-D-glucosamine|N-acetylglucosamine|beta-D-glucopyranose, 2-(acetylamino)-2-deoxy-|betaGlcNAc http://purl.obolibrary.org/obo/CHEBI_28009 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28010 biolink:ChemicalEntity 10-formyltetrahydrofolyl polyglutamate macromolecule A macromolecule consisting of 10-formyltetrahydrofolic acid with an arbitrary number of glutamate residues attached as a polypeptide to the single existent one. kegg.compound:C05929 Graph 10-Formyl-THF-polyglutamate|10-Formyltetrahydrofolylpolyglutamate|10-formyltetrahydrofolyl polyglutamate 10-Formyl-THF-polyglutamate|10-Formyltetrahydrofolylpolyglutamate|10-formyltetrahydrofolyl polyglutamate http://purl.obolibrary.org/obo/CHEBI_28010 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28013 biolink:ChemicalEntity beta-D-fructofuranose 1,6-bisphosphate A D-fructofuranose 1,6-bisphosphate with a β-configuration at the anomeric position. cas:488-69-7|drugbank:DB04551|kegg.compound:C05378|pdb-ccd:FBP|reaxys:1690982 Graph 1,6-di-O-phosphono-beta-D-fructofuranose|BETA FRUCTOSE 1,6-DIPHOSPHATE|Fosfructose|beta-D-Fructose 1,6-bisphosphate|beta-D-fructofuranose 1,6-bis(dihydrogen phosphate) beta-D-fructofuranose 1,6-bis(dihydrogen phosphate) 1,6-di-O-phosphono-beta-D-fructofuranose|BETA FRUCTOSE 1,6-DIPHOSPHATE|Fosfructose|beta-D-Fructose 1,6-bisphosphate|beta-D-fructofuranose 1,6-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28013 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28014 biolink:ChemicalEntity D-idose cas:5978-95-0|glytoucan:G97146EI|kegg.compound:C06466 Graph D-Ido|D-Idose|D-ido-Hexose|D-ido-hexose|D-idose D-Idose|D-ido-Hexose|D-ido-hexose|D-idose D-Ido|D-Idose|D-ido-Hexose|D-ido-hexose|D-idose http://purl.obolibrary.org/obo/CHEBI_28014 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28017 biolink:ChemicalEntity starch The most important reserve polysaccharide found in plants. It is a glucan consisting of amylose and amylopectin. cas:9005-25-8|kegg.compound:C00369|kegg.drug:D06507|kegg.glycan:G10545|wikipedia.en:Starch Graph Staerke|Starch|amidon|amylum Staerke|Starch|amidon|amylum http://purl.obolibrary.org/obo/CHEBI_28017 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28018 biolink:ChemicalEntity 3,3',4',5,7-pentahydroxy-8-methoxyflavone A monomethoxyflavone that is the 8-O-methyl derivative of gossypetin . kegg.compound:C04527|knapsack:C00004724|metacyc.compound:33457-PENTAHYDROXY-8-METHOXYFLAVON Graph 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-methoxy-4H-chromen-4-one|3,3',4',5,7-Pentahydroxy-8-methoxyflavone|3,3',4',5,7-pentahydroxy-8-methoxyflavone|8-methoxyquercetin|corniculatusin 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-methoxy-4H-chromen-4-one 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-methoxy-4H-chromen-4-one|3,3',4',5,7-Pentahydroxy-8-methoxyflavone|3,3',4',5,7-pentahydroxy-8-methoxyflavone|8-methoxyquercetin|corniculatusin http://purl.obolibrary.org/obo/CHEBI_28018 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28024 biolink:ChemicalEntity cyanic acid beilstein:1732479|cas:420-05-3|chemspider:525|gmelin:839|kegg.compound:C01417|pdb-ccd:0NM|pubmed:12573832|pubmed:12590561|pubmed:16743625|pubmed:16744204|pubmed:19624192|pubmed:20261791|pubmed:20261792|pubmed:20340793|pubmed:237898|pubmed:4368066|pubmed:6493050 Graph Cyanic acid|Cyansaeure|HOCN|Zyansaeure|[C(N)OH]|acide cyanique|acido cianico|acidum cyanicum|hydrogen nitridooxocarbonate|hydroxidonitridocarbon|nitridooxocarbonic acid hydrogen nitridooxocarbonate|hydroxidonitridocarbon|nitridooxocarbonic acid Cyanic acid|Cyansaeure|HOCN|Zyansaeure|[C(N)OH]|acide cyanique|acido cianico|acidum cyanicum|hydrogen nitridooxocarbonate|hydroxidonitridocarbon|nitridooxocarbonic acid http://purl.obolibrary.org/obo/CHEBI_28024 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28026 biolink:ChemicalEntity plastoquinol-9 A plastoquinol in which an all-E nonaprenyl group is attached to position 5 of 2,3-dimethylhydroquinone. cas:3819-09-8|kegg.compound:C16695|reaxys:11124806 Graph (all-E)-2,3-dimethyl-5-(3,7,11,15,19,23,27,31,35-nonamethyl-2,6,10,14,18,22,26,30,34-hexatricontanonaenyl)-1,4-benzenediol|2,3-dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl]benzene-1,4-diol|plastoquinol|plastoquinol A|plastoquinol-9 2,3-dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl]benzene-1,4-diol (all-E)-2,3-dimethyl-5-(3,7,11,15,19,23,27,31,35-nonamethyl-2,6,10,14,18,22,26,30,34-hexatricontanonaenyl)-1,4-benzenediol|2,3-dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl]benzene-1,4-diol|plastoquinol|plastoquinol A|plastoquinol-9 http://purl.obolibrary.org/obo/CHEBI_28026 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28032 biolink:ChemicalEntity 4'-hydroxyacetophenone A monohydroxyacetophenone carrying a hydroxy substituent at position 4'. cas:99-93-4|kegg.compound:C10700|knapsack:C00002698|metacyc.compound:CPD-10598|pdb-ccd:AC6|pubmed:21848266|pubmed:22484946|pubmed:23014895|pubmed:23252272|pubmed:23738459|reaxys:774355|umbbd.compound:c0694|wikipedia.en:Piceol Graph (4-Hydroxyphenyl)ethan-1-one|(4-hydroxyphenyl)ethan-1-one|1-(4-hydroxyphenyl)ethanone|4'-Hydroxyacetophenone|4'-hydroxyacetophenone|4-Acetylphenol|4-Hydroxyacetophenone|Methyl p-hydroxyphenyl ketone|p-Hydroxyacetophenone|p-Hydroxyphenyl methyl ketone|para-Hydroxyacetophenone 1-(4-hydroxyphenyl)ethanone (4-Hydroxyphenyl)ethan-1-one|(4-hydroxyphenyl)ethan-1-one|1-(4-hydroxyphenyl)ethanone|4'-Hydroxyacetophenone|4'-hydroxyacetophenone|4-Acetylphenol|4-Hydroxyacetophenone|Methyl p-hydroxyphenyl ketone|p-Hydroxyacetophenone|p-Hydroxyphenyl methyl ketone|para-Hydroxyacetophenone http://purl.obolibrary.org/obo/CHEBI_28032 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28034 biolink:ChemicalEntity beta-D-galactoside Any D-galactoside having β-configuration at its anomeric centre. kegg.compound:C00602 Graph a beta-D-galactoside|beta-D-Galactoside|beta-D-galactopyranoside|beta-D-galactosides a beta-D-galactoside|beta-D-Galactoside|beta-D-galactopyranoside|beta-D-galactosides http://purl.obolibrary.org/obo/CHEBI_28034 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28037 biolink:ChemicalEntity N-acetyl-D-galactosamine The D-enantiomer of N-acetylgalactosamine. cas:14215-68-0|cas:1811-31-0|glygen:G27025MB|glytoucan:G27025MB|kegg.compound:C01132|pubmed:1429037|pubmed:15267227|pubmed:15864747|pubmed:17905738|pubmed:21512230|pubmed:25730476|pubmed:26788060|pubmed:26854615|pubmed:2860067|pubmed:7688662|reaxys:1429037 Graph 2-Acetamido-2-deoxy-D-galactose|2-acetamido-2-deoxy-D-galactopyranose|D-GalNAc|GalNAc|N-Acetyl-D-chondrosamine|N-Acetyl-D-galactosamine|N-acetyl-D-galactosamine 2-acetamido-2-deoxy-D-galactopyranose 2-Acetamido-2-deoxy-D-galactose|2-acetamido-2-deoxy-D-galactopyranose|D-GalNAc|GalNAc|N-Acetyl-D-chondrosamine|N-Acetyl-D-galactosamine|N-acetyl-D-galactosamine http://purl.obolibrary.org/obo/CHEBI_28037 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28044 biolink:ChemicalEntity phenylalanine An aromatic amino acid that is alanine in which one of the methyl hydrogens is substituted by a phenyl group. cas:150-30-1|gmelin:50836|kegg.compound:C02057|pubmed:17439666|pubmed:22264337|reaxys:1910407|wikipedia.en:Phenylalanine Graph 2-amino-3-phenylpropanoic acid|DL-Phenylalanine|F|PHE|Phenylalanin|Phenylalanine|alpha-Amino-beta-phenylpropionic acid|fenilalanina|phenylalanine 2-amino-3-phenylpropanoic acid|Phenylalanine|phenylalanine 2-amino-3-phenylpropanoic acid|DL-Phenylalanine|F|PHE|Phenylalanin|Phenylalanine|alpha-Amino-beta-phenylpropionic acid|fenilalanina|phenylalanine http://purl.obolibrary.org/obo/CHEBI_28044 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28045 biolink:ChemicalEntity (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid A 4-oxo monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl group. beilstein:3263762|cas:1130-49-0|kegg.compound:C07159|pubmed:6848481|reaxys:3263762 Graph (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid|2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetic acid|2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetic acid|Otmcpa (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid|2-Oxo-delta(3)-4,5,5-trimethylcyclopentenylacetic acid|2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetic acid|Otmcpa http://purl.obolibrary.org/obo/CHEBI_28045 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28050 biolink:ChemicalEntity homocarnosine A histidine derivative that is histidine in which one of the hydrogens attached to the α-amino group has been replaced by a 4-aminobutanoyl group. reaxys:11612459 Graph N-(4-aminobutanoyl)histidine|N-(4-aminobutyryl)histidine|gamma-Aminobutyryl histidine N-(4-aminobutanoyl)histidine N-(4-aminobutanoyl)histidine|N-(4-aminobutyryl)histidine|gamma-Aminobutyryl histidine http://purl.obolibrary.org/obo/CHEBI_28050 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28052 biolink:ChemicalEntity acetohexamide An N-sulfonylurea that is urea in which a hydrogen attached to one of the nitrogens is replaced by a p-acetylphenylsulfonyl group, while a hydrogen attached to the other nitrogen is replaced by a cyclohexyl group. cas:968-81-0|drugbank:DB00414|drugcentral:57|hmdb:HMDB0014558|kegg.compound:C06806|kegg.drug:D00219|lincs.smallmolecule:LSM-5638|pubmed:13945057|pubmed:2699749|pubmed:8070312|pubmed:910864|reaxys:2225115|wikipedia.en:Acetohexamide Graph 1-((p-Acetylphenyl)sulfonyl)-3-cyclohexylurea|4-Acetyl-N-((cyclohexylamino)carbonyl)benzenesulfonamide|4-acetyl-N-(cyclohexylcarbamoyl)benzene-1-sulfonamide|Dymelor|N-(p-Acetylphenylsulfonyl)-N'-cyclohexylurea|acetohexamida|acetohexamide|acetohexamidum 4-acetyl-N-(cyclohexylcarbamoyl)benzene-1-sulfonamide 1-((p-Acetylphenyl)sulfonyl)-3-cyclohexylurea|4-Acetyl-N-((cyclohexylamino)carbonyl)benzenesulfonamide|4-acetyl-N-(cyclohexylcarbamoyl)benzene-1-sulfonamide|Dymelor|N-(p-Acetylphenylsulfonyl)-N'-cyclohexylurea|acetohexamida|acetohexamide|acetohexamidum http://purl.obolibrary.org/obo/CHEBI_28052 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28053 biolink:ChemicalEntity melibiose A glycosylglucose formed by an α-(1→6)-linkage between D-galactose and D-glucose. cas:585-99-9|glygen:G09165XB|glytoucan:G09165XB|gmelin:887780|hmdb:HMDB0000048|kegg.compound:C05402|kegg.glycan:G01275|knapsack:C00001142|metacyc.compound:MELIBIOSE|pubmed:12797744|pubmed:17006649|pubmed:17724458|pubmed:19846069|pubmed:19913595|pubmed:27577255|pubmed:27794607|pubmed:28453942|pubmed:3290105|pubmed:718021|pubmed:7524207|reaxys:1292781|wikipedia.en:Melibiose Graph (Gal)1 (Glc)1|6-O-(alpha-D-Galactopyranosyl)-D-glucopyranose|6-O-alpha-D-galactopyranosyl-D-glucopyranose|D-Melibiose|D-mellibiose|Gal-alpha(1,6)Glc|Melibiose|alpha-D-Gal-(1->6)-D-Glc|alpha-D-Galp-(1->6)-D-Glcp|alpha-D-galactopyranosyl-(1->6)-D-glucopyranose|alpha-D-galactosyl-(1->6)-D-glucose|melibiose alpha-D-galactopyranosyl-(1->6)-D-glucopyranose (Gal)1 (Glc)1|6-O-(alpha-D-Galactopyranosyl)-D-glucopyranose|6-O-alpha-D-galactopyranosyl-D-glucopyranose|D-Melibiose|D-mellibiose|Gal-alpha(1,6)Glc|Melibiose|alpha-D-Gal-(1->6)-D-Glc|alpha-D-Galp-(1->6)-D-Glcp|alpha-D-galactopyranosyl-(1->6)-D-glucopyranose|alpha-D-galactosyl-(1->6)-D-glucose|melibiose http://purl.obolibrary.org/obo/CHEBI_28053 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28054 biolink:ChemicalEntity o-cresol A cresol that is phenol substituted by a methyl group at position 2. It is a minor urinary metabolite of toluene. cas:95-48-7|gmelin:101619|hmdb:HMDB0002055|kegg.compound:C01542|knapsack:C00030878|pdb-ccd:JZ0|pubmed:15687000|reaxys:506917|umbbd.compound:c0281|wikipedia.en:O-Cresol Graph 1-hydroxy-2-methylbenzene|2-Hydroxytoluene|2-cresol|2-hydroxy-1-methylbenzene|2-hydroxytoluene|2-methylphenol|o-Cresol|o-Kresol|o-Methylphenol|o-cresylic acid|ortho-cresol|orthocresol 2-methylphenol 1-hydroxy-2-methylbenzene|2-Hydroxytoluene|2-cresol|2-hydroxy-1-methylbenzene|2-hydroxytoluene|2-methylphenol|o-Cresol|o-Kresol|o-Methylphenol|o-cresylic acid|ortho-cresol|orthocresol http://purl.obolibrary.org/obo/CHEBI_28054 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28057 biolink:ChemicalEntity amylopectin A polydisperse highly branched polysaccharide derivative composed of chains of D-glucopyranose residues in α(1→4) glycosidic linkage. The chains are joined together by α(1→6) glycosidic linkages. A small number of α(1→3) glycosidic linkages and some 6-phosphate ester groups also may occur. The branches in amylopectin typically contain 24 to 30 glucose residues. cas:9037-22-3|kegg.compound:C00317 Graph Amylopectin Amylopectin http://purl.obolibrary.org/obo/CHEBI_28057 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28058 biolink:ChemicalEntity alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer kegg.compound:C06140|kegg.glycan:G00116|lipidmaps:LMSP0601AT00|pubmed:1371229|pubmed:1567198|pubmed:16341241|pubmed:1724444|pubmed:17855742|pubmed:19726417|pubmed:20100930|pubmed:21167756|pubmed:2303428|pubmed:2448252|pubmed:24841627|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:28188832|pubmed:7534889|pubmed:7553668|pubmed:7654064|pubmed:7691279|pubmed:7693874 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT1b|Ganglioside GT1b|Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|NeuAc(alpha2-3)Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1'Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|NeuAcalpha2->3Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glc1-1Cer|alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|trisialoganglioside GT1b (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT1b|Ganglioside GT1b|Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Neu5Ac-alpha2->3Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|NeuAc(alpha2-3)Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1'Cer|NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|NeuAcalpha2->3Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glc1-1Cer|alpha-Neu5Ac-(2->3)-beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|trisialoganglioside GT1b http://purl.obolibrary.org/obo/CHEBI_28058 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28059 biolink:ChemicalEntity cis-1,2-dithiane-4,5-diol The cyclic form of dithioerythritol. beilstein:1280352|kegg.compound:C06484 Graph (4R,5S)-1,2-dithiane-4,5-diol|4,5-cis-Dihydroxy-1,2-dithiacyclohexane|Cis-1,2-dithiane-4,5-diol|Oxidized dithioerythritol (4R,5S)-1,2-dithiane-4,5-diol (4R,5S)-1,2-dithiane-4,5-diol|4,5-cis-Dihydroxy-1,2-dithiacyclohexane|Cis-1,2-dithiane-4,5-diol|Oxidized dithioerythritol http://purl.obolibrary.org/obo/CHEBI_28059 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28061 biolink:ChemicalEntity alpha-D-galactose D-Galactopyranose having α-configuration at the anomeric centre. cas:26566-61-0|cas:3646-73-9|cas:59-23-4|drugcentral:1271|glygen:G09546QO|glytoucan:G09546QO|gmelin:648638|kegg.compound:C00984|kegg.compound:C01582|kegg.drug:D04291|knapsack:C00001119|pdb-ccd:GLA|pubmed:17991151|pubmed:19443021|pubmed:25568069|pubmed:31537530|pubmed:7521740|pubmed:8154046|reaxys:1281609 Graph ALPHA D-GALACTOSE|Gal-alpha|alpha-D-Gal|alpha-D-Galactose|alpha-D-galactopyranose|alpha-D-galactose alpha-D-galactopyranose ALPHA D-GALACTOSE|Gal-alpha|alpha-D-Gal|alpha-D-Galactose|alpha-D-galactopyranose|alpha-D-galactose http://purl.obolibrary.org/obo/CHEBI_28061 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28063 biolink:ChemicalEntity o-xylene A xylene substituted by methyl groups at positions 1 and 2. cas:95-47-6|chemspider:6967|drugbank:DB03029|foodb.food:FDB005819|gmelin:67796|hmdb:HMDB0059851|kegg.compound:C07212|knapsack:C00056020|metacyc.compound:CPD-1421|pdb-ccd:OXE|pubmed:10598955|pubmed:11357330|pubmed:18656653|pubmed:19167006|pubmed:22960059|pubmed:24246944|pubmed:24421258|pubmed:28621498|pubmed:31911380|pubmed:33465657|pubmed:7399721|pubmed:7691530|reaxys:1815558|umbbd.compound:c0248|wikipedia.en:O-Xylene Graph 1,2-Dimethylbenzol|1,2-dimethylbenzene|1,2-xylene|2-xylene|3,4-xylene|ORTHO-XYLENE|o-Dimethylbenzene|o-Methyltoluene|o-Xylene|o-Xylol|ortho-xylene 1,2-xylene 1,2-Dimethylbenzol|1,2-dimethylbenzene|1,2-xylene|2-xylene|3,4-xylene|ORTHO-XYLENE|o-Dimethylbenzene|o-Methyltoluene|o-Xylene|o-Xylol|ortho-xylene http://purl.obolibrary.org/obo/CHEBI_28063 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28064 biolink:ChemicalEntity cyanidin 3-O-rutinoside A rutinoside consisting of cyanidin having the rutinosyl group at the 3-position. drugcentral:3975|kegg.compound:C08620|knapsack:C00002376|reaxys:1838004|wikipedia.en:Antirrhinin Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|Cyanidin 3-O-rhamnosylglucoside|Cyanidin 3-O-rutinoside|Cyanidin 3-rhamnoglucoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|Cyanidin 3-O-rhamnosylglucoside|Cyanidin 3-O-rutinoside|Cyanidin 3-rhamnoglucoside http://purl.obolibrary.org/obo/CHEBI_28064 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28070 biolink:ChemicalEntity uridine 2'-phosphate A pyrimidine ribonucleoside 2'-monophosphate having uracil as the nucleobase beilstein:50670|cas:131-83-9|kegg.compound:C03031|pdb-ccd:U2P Graph 2'-uridylic acid|Uridine 2'-monophosphate|Uridine 2'-phosphate 2'-uridylic acid 2'-uridylic acid|Uridine 2'-monophosphate|Uridine 2'-phosphate http://purl.obolibrary.org/obo/CHEBI_28070 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28071 biolink:ChemicalEntity (indol-3-ylacetyl)-myo-inositol 3-L-arabinoside kegg.compound:C04611 Graph (1S,2S,3R,4S,5S,6S)-4-(beta-L-arabinopyranosyloxy)-2,3,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate|(indol-3-yl)acetyl-myo-inositol 3-L-arabinoside|Indole-3-ylacetyl-myo-inositol L-arabinoside (1S,2S,3R,4S,5S,6S)-4-(beta-L-arabinopyranosyloxy)-2,3,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate (1S,2S,3R,4S,5S,6S)-4-(beta-L-arabinopyranosyloxy)-2,3,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate|(indol-3-yl)acetyl-myo-inositol 3-L-arabinoside|Indole-3-ylacetyl-myo-inositol L-arabinoside http://purl.obolibrary.org/obo/CHEBI_28071 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28073 biolink:ChemicalEntity chromium atom A chromium group element atom that has atomic number 24. cas:7440-47-3|kegg.compound:C06268|webelements:Cr Graph 24Cr|Chrom|Chromium|Cr|chrome|chromium|cromo Chromium|chromium 24Cr|Chrom|Chromium|Cr|chrome|chromium|cromo http://purl.obolibrary.org/obo/CHEBI_28073 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28077 biolink:ChemicalEntity rifampicin A member of the class of rifamycins that is a a semisynthetic antibiotic derived from Amycolatopsis rifamycinica (previously known as Amycolatopsis mediterranei and Streptomyces mediterranei). cas:13292-46-1|drugbank:DB01045|hmdb:HMDB0015179|kegg.compound:C06688|kegg.drug:D00211|patent:NL6509961|patent:US3342810|pdb-ccd:RFP|pubmed:11600355|pubmed:14665784|pubmed:14670633|pubmed:15331348|pubmed:15383168|pubmed:15705662|pubmed:16159084|pubmed:16515773|pubmed:17828712|pubmed:18332862|pubmed:19386087|pubmed:19458074|pubmed:19723399|pubmed:24718527|pubmed:25720500|pubmed:26725427|pubmed:26819743|pubmed:27082586|pubmed:27143080|pubmed:27182275|pubmed:27242224|pubmed:27470132|pubmed:27569735|pubmed:27617596|pubmed:27640793|pubmed:27755552|pubmed:27795624|pubmed:27883163|pubmed:27965540|pubmed:27993874|pubmed:28081169|pubmed:28118809|pubmed:28181840|pubmed:28184157|pubmed:28207542|pubmed:28262820|reaxys:5723476|wikipedia.en:Rifampicin Graph (7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1(4,7).0(5,28)]triaconta-1(28),1(29),2,4,9,19,21,25,27-nonaen-13-yl acetate|3-(((4-Methyl-1-piperazinyl)imino)methyl)rifamycin SV|RFP|Rifampicin|Rifampin|rifamcin|rifampicin|rifampicina|rifampicinum (7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1(4,7).0(5,28)]triaconta-1(28),1(29),2,4,9,19,21,25,27-nonaen-13-yl acetate (7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1(4,7).0(5,28)]triaconta-1(28),1(29),2,4,9,19,21,25,27-nonaen-13-yl acetate|3-(((4-Methyl-1-piperazinyl)imino)methyl)rifamycin SV|RFP|Rifampicin|Rifampin|rifamcin|rifampicin|rifampicina|rifampicinum http://purl.obolibrary.org/obo/CHEBI_28077 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28079 biolink:ChemicalEntity beta-L-arabinoside kegg.compound:C02761 Graph beta-L-Arabinoside|beta-L-arabinosides beta-L-Arabinoside|beta-L-arabinosides http://purl.obolibrary.org/obo/CHEBI_28079 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28080 biolink:ChemicalEntity (2Z,4E)-2-hydroxymuconate(2-) A hexadienedioate compound having a 2-hydroxy substituent. beilstein:4310322 Graph (2Z,4E)-2-hydroxyhexa-2,4-dienedioate|2-Hydroxymuconate (2Z,4E)-2-hydroxyhexa-2,4-dienedioate (2Z,4E)-2-hydroxyhexa-2,4-dienedioate|2-Hydroxymuconate http://purl.obolibrary.org/obo/CHEBI_28080 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28084 biolink:ChemicalEntity 3-(carbamoyloxymethyl)cephalosporin kegg.compound:C03674 Graph 3-(carbamoyloxymethyl)cephalosporins|3-Carbamoyloxymethylcephem 3-(carbamoyloxymethyl)cephalosporins|3-Carbamoyloxymethylcephem http://purl.obolibrary.org/obo/CHEBI_28084 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28087 biolink:ChemicalEntity glycogen A polydisperse, highly branched glucan composed of chains of D-glucopyranose residues in α(1→4) glycosidic linkage, joined together by α(1→6) glycosidic linkages. A small number of α(1→3) glycosidic linkages and some cumulative α(1→6) links also may occur. The branches in glycogen typically contain 8 to 12 glucose residues. cas:9005-79-2|glygen:G99991IU|glytoucan:G99991IU|hmdb:HMDB0000757|kegg.compound:C00182|metacyc.compound:CPD0-971|wikipedia.en:Glycogen Graph Glycogen|animal starch|liver starch Glycogen|animal starch|liver starch http://purl.obolibrary.org/obo/CHEBI_28087 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28088 biolink:ChemicalEntity genistein A 7-hydroxyisoflavone with additional hydroxy groups at positions 5 and 4'. It is a phytoestrogenic isoflavone with antioxidant properties. cas:446-72-0|chemspider:4444448|drugbank:DB01645|foodb.food:FDB011828|hmdb:HMDB0003217|kegg.compound:C06563|kegg.drug:D11680|knapsack:C00002526|lincs.smallmolecule:LSM-5549|lipidmaps:LMPK12050218|metacyc.compound:CPD-3141|pdb-ccd:GEN|pubmed:10469641|pubmed:10741415|pubmed:10912792|pubmed:11564287|pubmed:12629420|pubmed:14654166|pubmed:15196699|pubmed:15288519|pubmed:15576033|pubmed:15772566|pubmed:15833883|pubmed:15853412|pubmed:16061678|pubmed:16166295|pubmed:17004897|pubmed:17979711|pubmed:18344977|pubmed:18413741|pubmed:18490856|pubmed:18815740|pubmed:19107852|pubmed:19402570|pubmed:20211733|pubmed:22303062|pubmed:24023812|pubmed:24297371|pubmed:24379139|pubmed:25593647|pubmed:26322379|pubmed:28166217|pubmed:28259640|pubmed:34314575|reaxys:263823|wikipedia.en:Genistein Graph 4',5,7-trihydroxyisoflavone|5,7,4'-Trihydroxyisoflavone|5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one|GENISTEIN|Genistein|Prunetol|Sophoricol 5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one 4',5,7-trihydroxyisoflavone|5,7,4'-Trihydroxyisoflavone|5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one|GENISTEIN|Genistein|Prunetol|Sophoricol http://purl.obolibrary.org/obo/CHEBI_28088 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28089 biolink:ChemicalEntity N-hydroxytyrosine An L-tyrosine derivative obtained by replacement of one of the amino hydrogen by a hydroxy group. cas:64448-49-3|hmdb:HMDB0038750|kegg.compound:C03004|reaxys:14265538 Graph (2S)-2-(hydroxyamino)-3-(4-hydroxyphenyl)propanoic acid|N-Hydroxy-L-tyrosine|N-hydroxy-L-tyrosine|hydroxy-L-tyrosine|hydroxytyrosine N-Hydroxy-L-tyrosine|N-hydroxy-L-tyrosine (2S)-2-(hydroxyamino)-3-(4-hydroxyphenyl)propanoic acid|N-Hydroxy-L-tyrosine|N-hydroxy-L-tyrosine|hydroxy-L-tyrosine|hydroxytyrosine http://purl.obolibrary.org/obo/CHEBI_28089 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28093 biolink:ChemicalEntity borneol A bornane monoterpenoid that is 1,7,7-trimethylbicyclo[2.2.1]heptane substituted by a hydroxy group at position 2. beilstein:1903042|cas:507-70-0|gmelin:185292|kegg.compound:C01411|knapsack:C00003028 Graph 1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|Borneo camphor|Borneol|Sumatra camphor|borneol|bornyl alcohol|endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|endo-2-bornanol|endo-2-camphanol|endo-2-hydroxycamphane 1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol 1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|Borneo camphor|Borneol|Sumatra camphor|borneol|bornyl alcohol|endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol|endo-2-bornanol|endo-2-camphanol|endo-2-hydroxycamphane http://purl.obolibrary.org/obo/CHEBI_28093 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28096 biolink:ChemicalEntity S-methyl-5-thio-D-ribulose 1-phosphate kegg.compound:C04582|pdb-ccd:MRU Graph 5-S-METHYL-1-O-PHOSPHONO-5-THIO-D-RIBULOSE|5-S-methyl-1-O-phosphono-5-thio-D-ribulose|5-S-methyl-5-thio-D-erythro-pent-2-ulose 1-(dihydrogen phosphate)|5-S-methyl-5-thio-D-ribulose 1-(dihydrogen phosphate) 5-S-methyl-5-thio-D-erythro-pent-2-ulose 1-(dihydrogen phosphate)|5-S-methyl-5-thio-D-ribulose 1-(dihydrogen phosphate) 5-S-METHYL-1-O-PHOSPHONO-5-THIO-D-RIBULOSE|5-S-methyl-1-O-phosphono-5-thio-D-ribulose|5-S-methyl-5-thio-D-erythro-pent-2-ulose 1-(dihydrogen phosphate)|5-S-methyl-5-thio-D-ribulose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28096 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28097 biolink:ChemicalEntity chlorobenzene The simplest member of the class of monochlorobenzenes, that is benzene in which a single hydrogen has been substituted by a chlorine. cas:108-90-7|gmelin:26704|hmdb:HMDB0041855|kegg.compound:C06990|metacyc.compound:CHLOROBENZENE|pdb-ccd:8CL|pubmed:23360185|pubmed:23957149|pubmed:24341791|reaxys:605632|umbbd.compound:c0105|wikipedia.en:Chlorobenzene Graph Benzene chloride|Chlorobenzene|Monochlorbenzol|Monochlorobenzene|PhCl|Phenyl chloride|chlorobenzene Chlorobenzene|chlorobenzene Benzene chloride|Chlorobenzene|Monochlorbenzol|Monochlorobenzene|PhCl|Phenyl chloride|chlorobenzene http://purl.obolibrary.org/obo/CHEBI_28097 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28098 biolink:ChemicalEntity kanamycin B beilstein:61646|cas:4696-76-8|drugcentral:1520|kegg.compound:C00825|kegg.drug:D07497|knapsack:C00018692|pdb-ccd:9CS Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside|2'-amino-2'-deoxykanamycin|Bekanamycin|Kanamycin B|Nebramycin V|Nebramycin factor 5|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl-(1->6))-2-deoxy-D-streptamine (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside|2'-amino-2'-deoxykanamycin|Bekanamycin|Kanamycin B|Nebramycin V|Nebramycin factor 5|O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl-(1->6))-2-deoxy-D-streptamine http://purl.obolibrary.org/obo/CHEBI_28098 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28099 biolink:ChemicalEntity prostaglandin B2 cas:13367-85-6|drugbank:DB02304|kegg.compound:C05954|lipidmaps:LMFA03010018|pdb-ccd:E2P|reaxys:2153006 Graph (5Z,13E,15R)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oic acid|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oic acid|PGB2|Prostaglandin B2 (5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oic acid (5Z,13E,15R)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oic acid|(5Z,13E,15S)-15-hydroxy-9-oxoprosta-5,8(12),13-trien-1-oic acid|PGB2|Prostaglandin B2 http://purl.obolibrary.org/obo/CHEBI_28099 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28100 biolink:ChemicalEntity (1->3)-alpha-D-glucan An α-D-glucan in which the glucose units are connected by (1→3) linkages. kegg.compound:C02616|kegg.glycan:G10492 Graph (1->3)-alpha-D-glucan|(1->3)-alpha-D-glucopyranan|1,3-alpha-D-Glucan|[alpha-D-Glucosyl-(1,3)]n|[alpha-D-Glucosyl-(1,3)]n+1 (1->3)-alpha-D-glucopyranan (1->3)-alpha-D-glucan|(1->3)-alpha-D-glucopyranan|1,3-alpha-D-Glucan|[alpha-D-Glucosyl-(1,3)]n|[alpha-D-Glucosyl-(1,3)]n+1 http://purl.obolibrary.org/obo/CHEBI_28100 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28101 biolink:ChemicalEntity N(1),N(12)-diacetylspermine beilstein:11213521|kegg.compound:C03413 Graph DASpm|N,N'-[butane-1,4-diylbis(iminopropane-3,1-diyl)]diacetamide|N1,N12-Diacetylspermine N,N'-[butane-1,4-diylbis(iminopropane-3,1-diyl)]diacetamide DASpm|N,N'-[butane-1,4-diylbis(iminopropane-3,1-diyl)]diacetamide|N1,N12-Diacetylspermine http://purl.obolibrary.org/obo/CHEBI_28101 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28102 biolink:ChemicalEntity amylose A glucan composed of unbranched chains of D-glucopyranose residues in α(1→4) glycosidic linkage. The number of repeated glucose subunits (n) is usually in the range of 300 to 3000, but can be many thousands. One of the two components of starch (the other, 70-80%, being amylopectin). Cf. linear maltodextrin, in which the chain length is typically between 3 and 17 glucose units. cas:9005-82-7|hmdb:HMDB0003403|kegg.compound:C00718|kegg.drug:D02329|kegg.glycan:G10495|pubmed:24162153|pubmed:24299760|pubmed:24491702|pubmed:24505384|reaxys:8194785|wikipedia.en:Amylose Graph (1,4-alpha-D-Glucosyl)n|(1,4-alpha-D-Glucosyl)n+1|(1,4-alpha-D-Glucosyl)n-1|(1->4)-alpha-D-glucopyranan|1,4-alpha-D-Glucan|4-{(1,4)-alpha-D-Glucosyl}(n-1)-D-glucose|Amylose|Amylose chain (1->4)-alpha-D-glucopyranan (1,4-alpha-D-Glucosyl)n|(1,4-alpha-D-Glucosyl)n+1|(1,4-alpha-D-Glucosyl)n-1|(1->4)-alpha-D-glucopyranan|1,4-alpha-D-Glucan|4-{(1,4)-alpha-D-Glucosyl}(n-1)-D-glucose|Amylose|Amylose chain http://purl.obolibrary.org/obo/CHEBI_28102 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28107 biolink:ChemicalEntity 2-isopropylmalate(2-) A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxylic acid groups of 2-isopropylmalic acid. metacyc.compound:3-CARBOXY-3-HYDROXY-ISOCAPROATE|pubmed:18682385|pubmed:20008079|pubmed:20824215 Graph 2-hydroxy-2-(propan-2-yl)butanedioate|2-hydroxy-2-isopropylsuccinate|3-carboxy-3-hydroxy-4-methylpentanoate|3-carboxy-3-hydroxyisocaproate|3-hydroxy-4-methyl-3-carboxypentanoate|alpha-isopropylmalate 2-hydroxy-2-(propan-2-yl)butanedioate 2-hydroxy-2-(propan-2-yl)butanedioate|2-hydroxy-2-isopropylsuccinate|3-carboxy-3-hydroxy-4-methylpentanoate|3-carboxy-3-hydroxyisocaproate|3-hydroxy-4-methyl-3-carboxypentanoate|alpha-isopropylmalate http://purl.obolibrary.org/obo/CHEBI_28107 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28112 biolink:ChemicalEntity nickel atom Chemical element (nickel group element atom) with atomic number 28. cas:7440-02-0|gmelin:16229|kegg.compound:C00291|pubmed:12756270|pubmed:14634084|pubmed:14734778|pubmed:15165199|pubmed:19828094|pubmed:20477134|pubmed:22762130|pubmed:23142754|pubmed:23317102|pubmed:23692032|pubmed:23692035|pubmed:23723488|pubmed:23834453|pubmed:23857010|pubmed:23895079|pubmed:23909687|pubmed:9060994|pubmed:9886425|reaxys:4122946|webelements:Ni|wikipedia.en:Nickel Graph 28Ni|Ni|Nickel|Raney alloy|niccolum|nickel|niquel nickel 28Ni|Ni|Nickel|Raney alloy|niccolum|nickel|niquel http://purl.obolibrary.org/obo/CHEBI_28112 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28113 biolink:ChemicalEntity 24,25-dihydrolanosterol A 3β-sterol formed from lanosterol by reduction across the C-24‒C-25 double bond. cas:79-62-9|hmdb:HMDB0006839|kegg.compound:C05109|knapsack:C00023781|lipidmaps:LMST01010087|metacyc.compound:CPD-8606|pubmed:898228|reaxys:2224904 Graph 24,25-Dihydrolanosterol|24,25-dihydrolanosterol|Lanostenol|lanost-8-en-3beta-ol lanost-8-en-3beta-ol 24,25-Dihydrolanosterol|24,25-dihydrolanosterol|Lanostenol|lanost-8-en-3beta-ol http://purl.obolibrary.org/obo/CHEBI_28113 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28115 biolink:ChemicalEntity methylcobalamin cas:13422-55-4|drugbank:DB03614|gmelin:124528|kegg.compound:C06453|kegg.drug:D03246|pdb-ccd:COB Graph CO-METHYLCOBALAMIN|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-methylcobamide|MeCbl|Methylcobalamin|mecobalamin|methylcob(III)alamin|methylcobalamin Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-methylcobamide CO-METHYLCOBALAMIN|Coalpha-[alpha-(5,6-dimethylbenzimidazolyl)]-Cobeta-methylcobamide|MeCbl|Methylcobalamin|mecobalamin|methylcob(III)alamin|methylcobalamin http://purl.obolibrary.org/obo/CHEBI_28115 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28116 biolink:ChemicalEntity 5-guanidino-2-oxopentanoic acid A 2-oxo monocarboxylic acid that is 2-oxopentanoic acid in which one of the methyl hydrogens is substituted by a carbamimidamido group. beilstein:1778170|cas:3715-10-4|kegg.compound:C03771|pdb-ccd:JX7|reaxys:1778170 Graph 2-Oxo-5-guanidino-pentanoate|2-Oxo-5-guanidinopentanoate|2-Oxoarginine|2-oxo-5-guanidinovaleric acid|5-((aminoiminomethyl)amino)-2-oxopentanoic acid|5-Guanidino-2-oxo-pentanoate|5-Guanidino-2-oxopentanoate|5-carbamimidamido-2-oxopentanoic acid|alpha-keto-delta-guanidinopentanoic acid|alpha-keto-delta-guanidinovaleric acid 5-carbamimidamido-2-oxopentanoic acid 2-Oxo-5-guanidino-pentanoate|2-Oxo-5-guanidinopentanoate|2-Oxoarginine|2-oxo-5-guanidinovaleric acid|5-((aminoiminomethyl)amino)-2-oxopentanoic acid|5-Guanidino-2-oxo-pentanoate|5-Guanidino-2-oxopentanoate|5-carbamimidamido-2-oxopentanoic acid|alpha-keto-delta-guanidinopentanoic acid|alpha-keto-delta-guanidinovaleric acid http://purl.obolibrary.org/obo/CHEBI_28116 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28118 biolink:ChemicalEntity muramic acid pubmed:24441017 Graph 2-amino-3-O-D-1-carboxyethyl-2-deoxy-D-glucose|2-amino-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucose|2-amino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucose|3-O-alpha-carboxyethyl-D-glucosamine|Mur|Muraminsaeure|muramic acid 2-amino-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucose 2-amino-3-O-D-1-carboxyethyl-2-deoxy-D-glucose|2-amino-3-O-[(1R)-1-carboxyethyl]-2-deoxy-D-glucose|2-amino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucose|3-O-alpha-carboxyethyl-D-glucosamine|Mur|Muraminsaeure|muramic acid http://purl.obolibrary.org/obo/CHEBI_28118 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28119 biolink:ChemicalEntity 2,3,7,8-tetrachlorodibenzodioxine beilstein:271116|cas:1746-01-6|gmelin:366537|kegg.compound:C07557|lincs.smallmolecule:LSM-37232|wikipedia.en:2,3,7,8-Tetrachlorodibenzo-P-Dioxin Graph 2,3,7,8-Tetrachlorodibenzo-p-dioxin|2,3,7,8-Tetrachlorodibenzodioxin|2,3,7,8-tetrachlorooxanthrene|Dioxin|PCDD 48|TCDD|Tetrachlorodibenzodioxin|dioxine|tetradioxin 2,3,7,8-tetrachlorooxanthrene 2,3,7,8-Tetrachlorodibenzo-p-dioxin|2,3,7,8-Tetrachlorodibenzodioxin|2,3,7,8-tetrachlorooxanthrene|Dioxin|PCDD 48|TCDD|Tetrachlorodibenzodioxin|dioxine|tetradioxin http://purl.obolibrary.org/obo/CHEBI_28119 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28120 biolink:ChemicalEntity L-fructose cas:7776-48-9|kegg.compound:C01719 Graph L-Fru|L-Fructose|L-arabino-Hexulose|L-arabino-hexulose|L-fructose L-Fructose|L-arabino-Hexulose|L-arabino-hexulose|L-fructose L-Fru|L-Fructose|L-arabino-Hexulose|L-arabino-hexulose|L-fructose http://purl.obolibrary.org/obo/CHEBI_28120 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28121 biolink:ChemicalEntity harmine A harmala alkaloid in which the harman skeleton is methoxy-substituted at C-7. cas:442-51-3|drugbank:DB07919|kegg.compound:C06538|knapsack:C00001737|lincs.smallmolecule:LSM-5451|pdb-ccd:HRM|pubmed:11473435|pubmed:22877698|reaxys:178813|wikipedia.en:Harmine Graph 6-Methoxyharman|7-methoxy-1-methyl-9H-beta-carboline|7-methoxy-1-methyl-9H-pyrido[3,4-b]indole|Banisterine|Harmine|Leucoharmine|Telepathine|Yageine|Yajeine 7-methoxy-1-methyl-9H-pyrido[3,4-b]indole 6-Methoxyharman|7-methoxy-1-methyl-9H-beta-carboline|7-methoxy-1-methyl-9H-pyrido[3,4-b]indole|Banisterine|Harmine|Leucoharmine|Telepathine|Yageine|Yajeine http://purl.obolibrary.org/obo/CHEBI_28121 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28122 biolink:ChemicalEntity p-cumic acid A cumic acid that consists of benzoic acid substituted by an isopropyl group at position 4. cas:536-66-3|hmdb:HMDB0035268|kegg.compound:C06578|knapsack:C00036581|patent:CN101843243|pdb-ccd:4IA|pubmed:12560039|pubmed:25042713|pubmed:7385912|pubmed:845117|reaxys:1907514 Graph 4-(1-Methylethyl)benzoic acid|4-(propan-2-yl)benzoic acid|4-Isopropylbenzoic acid|4-propan-2-ylbenzoic acid|Cumic acid|Cuminic acid|p-Isopropylbenzoic acid 4-(propan-2-yl)benzoic acid 4-(1-Methylethyl)benzoic acid|4-(propan-2-yl)benzoic acid|4-Isopropylbenzoic acid|4-propan-2-ylbenzoic acid|Cumic acid|Cuminic acid|p-Isopropylbenzoic acid http://purl.obolibrary.org/obo/CHEBI_28122 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28125 biolink:ChemicalEntity all-cis-docosa-4,7,10,13,16,19-hexaenoic acid A docosahexaenoic acid having six cis-double bonds at positions 4, 7, 10, 13, 16 and 19. cas:6217-54-5|drugbank:DB03756|drugcentral:4289|hmdb:HMDB0002183|kegg.compound:C06429|lipidmaps:LMFA01030185|metacyc.compound:CPD-10244|pdb-ccd:HXA|pubmed:12359365|pubmed:12538082|pubmed:17291553|pubmed:18072818|pubmed:18220672|pubmed:21045096|reaxys:1715505|wikipedia.en:Docosahexaenoic_acid Graph (4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acid|(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid|22:6(n-3)|22:6-4, 7,10,13,16,19|4,7,10,13,16,19-Docosahexaenoic acid|4,7,10,13,16,19-docosahexaenoic acid|DHA|DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID|Doconexent|Docosahexaenoic acid|all-cis-4,7,10,13,16,19-docosahexaenoic acid|all-cis-DHA|cervonic acid|docosa-4,7,10,13,16,19-hexaenoic acid (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid|Docosahexaenoic acid (4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acid|(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid|22:6(n-3)|22:6-4, 7,10,13,16,19|4,7,10,13,16,19-Docosahexaenoic acid|4,7,10,13,16,19-docosahexaenoic acid|DHA|DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID|Doconexent|Docosahexaenoic acid|all-cis-4,7,10,13,16,19-docosahexaenoic acid|all-cis-DHA|cervonic acid|docosa-4,7,10,13,16,19-hexaenoic acid http://purl.obolibrary.org/obo/CHEBI_28125 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28130 biolink:ChemicalEntity 13,14-dihydro-Delta(12)-prostaglandin J2 A member of the class of prostaglandins J that is prosta-5,9,12-trien-1-oic acid carrying oxo and hydsroxy substituents at positions 11 and 15 respectively (the 5Z,12E,15S-stereoisomer). cas:87893-54-7|kegg.compound:C05958|lipidmaps:LMFA03010020 Graph (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oic acid|9-Deoxy-9,10-didehydro-12,13-didehydro-13,14-dihydroprostaglandin D2|9-Deoxy-delta(9), delta(12)-13,14-dihydroprostaglandin D2|9-Deoxy-delta(9,12)-13,14-dihydro PGD2|Dddd-PGD2|d12-PGJ2|delta(12)-PGJ2|delta-12-PGJ2|delta-12-Prostaglandin J2 (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oic acid (5Z,12E,15S)-15-hydroxy-11-oxoprosta-5,9,12-trien-1-oic acid|9-Deoxy-9,10-didehydro-12,13-didehydro-13,14-dihydroprostaglandin D2|9-Deoxy-delta(9), delta(12)-13,14-dihydroprostaglandin D2|9-Deoxy-delta(9,12)-13,14-dihydro PGD2|Dddd-PGD2|d12-PGJ2|delta(12)-PGJ2|delta-12-PGJ2|delta-12-Prostaglandin J2 http://purl.obolibrary.org/obo/CHEBI_28130 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28133 biolink:ChemicalEntity S-alkyl-L-cysteine S-oxide An S-alkyl-L-cysteine in which the sulfur of the thioether moiety has been oxidised to the corresponding sulfoxide. kegg.compound:C03726 Graph S-Alkyl-L-cysteine S-oxide|S-alkyl-L-cysteine S-oxides S-Alkyl-L-cysteine S-oxide|S-alkyl-L-cysteine S-oxides http://purl.obolibrary.org/obo/CHEBI_28133 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28134 biolink:ChemicalEntity ammelide beilstein:607754|cas:645-93-2|gmelin:164827|kegg.compound:C08734|umbbd.compound:c0172 Graph 2,4-Dihydroxy-6-amino-1,3,5-triazine|6-amino-1,3,5-triazine-2,4-diol|Ammelide|ammelide 6-amino-1,3,5-triazine-2,4-diol 2,4-Dihydroxy-6-amino-1,3,5-triazine|6-amino-1,3,5-triazine-2,4-diol|Ammelide|ammelide http://purl.obolibrary.org/obo/CHEBI_28134 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28137 biolink:ChemicalEntity D-glycero-D-manno-heptose 1-phosphate kegg.compound:C07838 Graph 1-O-phosphono-D-glycero-Dmanno-heptopyranose|D-glycero-D-manno-Heptose 1-phosphate|D-glycero-Dmanno-heptopyranose 1-(dihydrogen phosphate) D-glycero-Dmanno-heptopyranose 1-(dihydrogen phosphate) 1-O-phosphono-D-glycero-Dmanno-heptopyranose|D-glycero-D-manno-Heptose 1-phosphate|D-glycero-Dmanno-heptopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28137 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28138 biolink:ChemicalEntity undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine An undecaprenyldiphospho-N-acetylmuramoyl peptide in which the peptide element is L-alanyl-D-γ-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine and in which the muramoyl residue is glucosaminyl-substituted at O-4. kegg.compound:C05898|kegg.glycan:G10555 Graph Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine http://purl.obolibrary.org/obo/CHEBI_28138 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2814 biolink:ChemicalEntity arecoline A tetrahydropyridine that is 1,2,5,6-tetrahydropyridine with a methyl group at position 1, and a methoxycarbonyl group at position 3. An alkaloid found in the areca nut, it acts as an agonist of muscarinic acetylcholine. cas:63-75-2|drugbank:DB04365|hmdb:HMDB0030353|kegg.compound:C10129|knapsack:C00002020|lincs.smallmolecule:LSM-15214|patent:CN101411705|patent:CN102464607|patent:US2506458|pubmed:21809341|pubmed:22493525|pubmed:23525646|pubmed:23895157|reaxys:123045|wikipedia.en:Arecoline Graph arecaidine methyl ester|arecaline|arecholine|arekolin|methyl 1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate|methylarecaiden|methylarecaidin methyl 1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate arecaidine methyl ester|arecaline|arecholine|arekolin|methyl 1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate|methylarecaiden|methylarecaidin http://purl.obolibrary.org/obo/CHEBI_2814 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28140 biolink:ChemicalEntity D-quinovose cas:7658-08-4|kegg.compound:C02522|knapsack:C00001128 Graph 6-Deoxy-D-glucose|6-deoxy-D-glucose|D-Chinovose|D-Epifucose|D-Glucomethylose|D-Qui|D-Quinovose|Isorhamnose|Isorhodeose 6-Deoxy-D-glucose|6-deoxy-D-glucose 6-Deoxy-D-glucose|6-deoxy-D-glucose|D-Chinovose|D-Epifucose|D-Glucomethylose|D-Qui|D-Quinovose|Isorhamnose|Isorhodeose http://purl.obolibrary.org/obo/CHEBI_28140 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28142 biolink:ChemicalEntity chloral hydrate An organochlorine compound that is the hydrate of trichloroacetaldehyde. beilstein:1698497|cas:302-17-0|drugbank:DB01563|drugcentral:586|gmelin:101369|kegg.compound:C06899|kegg.drug:D00265|metacyc.compound:CPD0-1476|ppdb:2987|umbbd.compound:c0011|vsdb:2987 Graph 1,1,1-trichloro-2,2-dihydroxyethane|1,1,1-trichloro-2,2-ethanediol|2,2,2-trichloro-1,1-ethanediol|2,2,2-trichloroethane-1,1-diol|Aquachloral Supprettes|Chloral hydrate|Chloralhydrat|Noctec|Somnote|Trichloracetaldehyd-hydrat|chloral monohydrate|knockout drops|trichloroacetaldehyde hydrate 2,2,2-trichloroethane-1,1-diol 1,1,1-trichloro-2,2-dihydroxyethane|1,1,1-trichloro-2,2-ethanediol|2,2,2-trichloro-1,1-ethanediol|2,2,2-trichloroethane-1,1-diol|Aquachloral Supprettes|Chloral hydrate|Chloralhydrat|Noctec|Somnote|Trichloracetaldehyd-hydrat|chloral monohydrate|knockout drops|trichloroacetaldehyde hydrate http://purl.obolibrary.org/obo/CHEBI_28142 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28143 biolink:ChemicalEntity digitalin cas:752-61-4|drugcentral:3143|kegg.compound:C08862|knapsack:C00003616 Graph 3beta-(6-deoxy-4-O-beta-D-glucopyranosyl-3-O-methyl-beta-D-galactopyranosyloxy)-14,16beta-dihydroxy-5beta-card-20(22)-enolide|Digitalin|Gitoxigenin 3-O-glucosyldigitaloside|Glucostrospeside 3beta-(6-deoxy-4-O-beta-D-glucopyranosyl-3-O-methyl-beta-D-galactopyranosyloxy)-14,16beta-dihydroxy-5beta-card-20(22)-enolide 3beta-(6-deoxy-4-O-beta-D-glucopyranosyl-3-O-methyl-beta-D-galactopyranosyloxy)-14,16beta-dihydroxy-5beta-card-20(22)-enolide|Digitalin|Gitoxigenin 3-O-glucosyldigitaloside|Glucostrospeside http://purl.obolibrary.org/obo/CHEBI_28143 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28145 biolink:ChemicalEntity dibenzofuran A mancude organic heterotricyclic parent that consists of a furan ring flanked by two benzene rings ortho-fused across the 2,3- and 4,5-positions. cas:132-64-9|gmelin:67825|kegg.compound:C07729|pubmed:12009135|pubmed:20686914|pubmed:21554085|reaxys:121100|umbbd.compound:c0039|wikipedia.en:Dibenzofuran Graph DBF|Dibenzofuran|Diphenylene oxide|dibenzo[b,d]furan|dibenzofuran dibenzo[b,d]furan DBF|Dibenzofuran|Diphenylene oxide|dibenzo[b,d]furan|dibenzofuran http://purl.obolibrary.org/obo/CHEBI_28145 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28146 biolink:ChemicalEntity L-xylonate Graph (2S,3R,4S)-2,3,4,5-tetrahydroxypentanoate|L-xylonate (2S,3R,4S)-2,3,4,5-tetrahydroxypentanoate (2S,3R,4S)-2,3,4,5-tetrahydroxypentanoate|L-xylonate http://purl.obolibrary.org/obo/CHEBI_28146 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28147 biolink:ChemicalEntity N(2')-acetylgentamycin C1a kegg.compound:C03524 Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-acetamido-6-amino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside|N(2')-acetylgentamycin C1a|N2'-Acetylgentamicin C1a (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-acetamido-6-amino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-acetamido-6-amino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranoside|N(2')-acetylgentamycin C1a|N2'-Acetylgentamicin C1a http://purl.obolibrary.org/obo/CHEBI_28147 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28148 biolink:ChemicalEntity sodium stibogluconate A D-gluconate adduct of indefinite composition containing between 30 and 34% of antimony(V), calculated with reference to dried and methanol-free substance. It is used as a treatment for leishmaniasis. cas:16037-91-5|drugbank:DB05630|kegg.compound:C07638|kegg.drug:D00582 Graph Antimony (V) derivative of sodium gluconate|Antimony sodium gluconate|Myostibin|Pentostam|Sodium stibogluconate|Stibanate|Stibanose|Stibatin|Stibinol|estibogluconato sodico|natrii stibogluconas|sodium stibogluconate|stibogluconate de sodium|trisodium 1-{[3-carboxylato-5-(1,2-dihydroxyethyl)-1-hydroxy-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]hept-1-yl]oxy}-5-(1,2-dihydroxyethyl)-1-oxido-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]heptane-3-carboxylate nonahydrate|trisodium 1-{[3-carboxylato-5-(1,2-dihydroxyethyl)-1-hydroxy-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]hept-1-yl]oxy}-5-(1,2-dihydroxyethyl)-1-oxido-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]heptane-3-carboxylate--water (1/9) trisodium 1-{[3-carboxylato-5-(1,2-dihydroxyethyl)-1-hydroxy-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]hept-1-yl]oxy}-5-(1,2-dihydroxyethyl)-1-oxido-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]heptane-3-carboxylate--water (1/9) Antimony (V) derivative of sodium gluconate|Antimony sodium gluconate|Myostibin|Pentostam|Sodium stibogluconate|Stibanate|Stibanose|Stibatin|Stibinol|estibogluconato sodico|natrii stibogluconas|sodium stibogluconate|stibogluconate de sodium|trisodium 1-{[3-carboxylato-5-(1,2-dihydroxyethyl)-1-hydroxy-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]hept-1-yl]oxy}-5-(1,2-dihydroxyethyl)-1-oxido-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]heptane-3-carboxylate nonahydrate|trisodium 1-{[3-carboxylato-5-(1,2-dihydroxyethyl)-1-hydroxy-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]hept-1-yl]oxy}-5-(1,2-dihydroxyethyl)-1-oxido-2,6,7-trioxa-1lambda(5)-stibabicyclo[2.2.1]heptane-3-carboxylate--water (1/9) http://purl.obolibrary.org/obo/CHEBI_28148 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28151 biolink:ChemicalEntity 5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate beilstein:8594375|kegg.compound:C06089|knapsack:C00000880|lipidmaps:LMPR0104030001 Graph (-)-Copalyl diphosphate|3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate|5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate|5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl trihydrogen diphosphate|ent-Copalyl diphosphate 3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate|5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl trihydrogen diphosphate (-)-Copalyl diphosphate|3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate|5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate|5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl trihydrogen diphosphate|ent-Copalyl diphosphate http://purl.obolibrary.org/obo/CHEBI_28151 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28157 biolink:ChemicalEntity pinocembrin A dihydroxyflavanone in which the two hydroxy groups are located at positions 5 and 7. A natural product found in Piper sarmentosum and Cryptocarya chartacea. cas:480-39-7|hmdb:HMDB0030808|kegg.compound:C09827|knapsack:C00000992|lincs.smallmolecule:LSM-4126|lipidmaps:LMPK12140214|metacyc.compound:CPD-6991|pubmed:21973101|pubmed:22050318|pubmed:23179089|pubmed:23212747|pubmed:23594163|pubmed:23611777|pubmed:23669639|pubmed:23697399|pubmed:23725831|pubmed:23725838|pubmed:23847074|reaxys:88951|wikipedia.en:Pinocembrin Graph (2S)-5,7-dihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one|(2S)-pinocembrin|(S)-2,3-Dihydro-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-one|(S)-5,7-dihydroxyflavanone|(S)-pinocembrin|5,7-Dihydroxyflavanone|Dihydrochrysin|Galangin flavanone (2S)-5,7-dihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one (2S)-5,7-dihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one|(2S)-pinocembrin|(S)-2,3-Dihydro-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-one|(S)-5,7-dihydroxyflavanone|(S)-pinocembrin|5,7-Dihydroxyflavanone|Dihydrochrysin|Galangin flavanone http://purl.obolibrary.org/obo/CHEBI_28157 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28158 biolink:ChemicalEntity 6-oxoprostaglandin F1alpha A prostaglandin Fα that is prostaglandin F1α bearing a keto substituent at the 6-position. cas:58962-34-8|kegg.compound:C05961|lipidmaps:LMFA03010001|pubmed:11034952|pubmed:11481608|pubmed:11510754|pubmed:11529335|pubmed:11798014|pubmed:12535846|pubmed:12912853|pubmed:14735492|pubmed:15108967|pubmed:15550787|pubmed:15684771|pubmed:15883739|pubmed:18942642|pubmed:6107345|pubmed:6132981|pubmed:7864124|pubmed:9013819|reaxys:2821925 Graph (13E,15S)-9alpha,11alpha,15-trihydroxy-6-oxoprost-13-en-1-oic acid|6-Keto-PGF1a|6-Keto-PGF1alpha|6-Keto-prostaglandin F1a|6-Keto-prostaglandin F1alpha|6-Ketoprostaglandin F1alpha|6-Oxo-PGF1alpha|6-Oxoprostaglandin F1alpha|6-oxo-PGF1alpha|6-oxo-prostaglandin F1alpha (13E,15S)-9alpha,11alpha,15-trihydroxy-6-oxoprost-13-en-1-oic acid (13E,15S)-9alpha,11alpha,15-trihydroxy-6-oxoprost-13-en-1-oic acid|6-Keto-PGF1a|6-Keto-PGF1alpha|6-Keto-prostaglandin F1a|6-Keto-prostaglandin F1alpha|6-Ketoprostaglandin F1alpha|6-Oxo-PGF1alpha|6-Oxoprostaglandin F1alpha|6-oxo-PGF1alpha|6-oxo-prostaglandin F1alpha http://purl.obolibrary.org/obo/CHEBI_28158 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28159 biolink:ChemicalEntity D-asparagine An optically active form of asparagine having D-configuration. cas:2058-58-4|drugbank:DB03943|gmelin:101784|hmdb:HMDB0033780|kegg.compound:C01905|metacyc.compound:CPD-3633|patent:CN101333175|pdb-ccd:DSG|pubmed:767332|reaxys:1723526|ymdb:YMDB00849 Graph (2R)-2,4-diamino-4-oxobutanoic acid|(2R)-2-amino-3-carbamoylpropanoic acid|(R)-2-amino-3-carbamoylpropanoic acid|D-2-aminosuccinamic acid|D-Asparagin|D-Asparagine|D-asparagine|D-aspartic acid beta-amide|DSG D-Asparagine|D-asparagine (2R)-2,4-diamino-4-oxobutanoic acid|(2R)-2-amino-3-carbamoylpropanoic acid|(R)-2-amino-3-carbamoylpropanoic acid|D-2-aminosuccinamic acid|D-Asparagin|D-Asparagine|D-asparagine|D-aspartic acid beta-amide|DSG http://purl.obolibrary.org/obo/CHEBI_28159 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28161 biolink:ChemicalEntity beta-D-xylose D-Xylopyranose in which the anomeric configuration is β. glygen:G16579HJ|glytoucan:G16579HJ|kegg.compound:C02096|kegg.glycan:G00154|pubmed:32568414 Graph beta-D-Xylose|beta-D-xylopyranose|beta-D-xylose beta-D-xylopyranose beta-D-Xylose|beta-D-xylopyranose|beta-D-xylose http://purl.obolibrary.org/obo/CHEBI_28161 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28163 biolink:ChemicalEntity iron(III) hydroxamate A complex between iron(III) and three hydroxamic acid groups, used for iron transport. kegg.compound:C06227 Graph Fe(III) hydroxamate|Fe(III) hydroxamates|Fe(III)hydroxamate|Fe(III)hydroxamic acid|iron(III) hydroxamates Fe(III) hydroxamate|Fe(III) hydroxamates|Fe(III)hydroxamate|Fe(III)hydroxamic acid|iron(III) hydroxamates http://purl.obolibrary.org/obo/CHEBI_28163 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28164 biolink:ChemicalEntity cholesterol beta-epoxide 5,6β-epoxy-5β-cholestan-3β-ol beilstein:89509|cas:4025-59-6|lipidmaps:LMST01010010 Graph (3-beta,5-beta,6-beta)-5,6-Epoxycholestan-3-ol|5,6-beta-epoxy-5-beta-cholestan-3-beta-ol|5,6beta-Epoxy-5beta-cholestan-3beta-ol|5,6beta-epoxy-cholesterol|5,beta6beta-epoxy-cholestan-3beta-ol|5beta,6beta-Epoxycholestan-3beta-ol|Cholesterol-5beta,6beta-epoxide 5,beta6beta-epoxy-cholestan-3beta-ol (3-beta,5-beta,6-beta)-5,6-Epoxycholestan-3-ol|5,6-beta-epoxy-5-beta-cholestan-3-beta-ol|5,6beta-Epoxy-5beta-cholestan-3beta-ol|5,6beta-epoxy-cholesterol|5,beta6beta-epoxy-cholestan-3beta-ol|5beta,6beta-Epoxycholestan-3beta-ol|Cholesterol-5beta,6beta-epoxide http://purl.obolibrary.org/obo/CHEBI_28164 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28168 biolink:ChemicalEntity 6-oxocyclohex-1-ene-1-carbonyl-CoA A 3-oxoacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 6-oxocyclohex-1-ene-1-carboxylic acid. kegg.compound:C09821 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(6-oxocyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|6-Ketoxycyclohex-1-ene-1-carboxyl-CoA|6-ketocyclohex-1-ene-1-carbonyl-coenzyme A|6-oxocyclohex-1-ene-1-carbonyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(6-oxocyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(6-oxocyclohex-1-ene-1-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|6-Ketoxycyclohex-1-ene-1-carboxyl-CoA|6-ketocyclohex-1-ene-1-carbonyl-coenzyme A|6-oxocyclohex-1-ene-1-carbonyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28168 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28171 biolink:ChemicalEntity 5-hydroxytryptophan A tryptophan derivative that is tryptophan substituted by a hydroxy group at position 5. cas:114-03-4|cas:56-69-9|kegg.compound:C01017|knapsack:C00001371|pubmed:14563478|pubmed:15617538|reaxys:88199|wikipedia.en:5-Hydroxytryptophan Graph (+-)-5-hydroxytryptophan|2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-HTP|5-Hydroxytryptophan|5-hydroxy-DL-tryptophan|5-hydroxytryptophan|5-hydroxytryptophan DL-form|DL-5-HTP|DL-5-hydroxytryptophan 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-Hydroxytryptophan|5-hydroxytryptophan (+-)-5-hydroxytryptophan|2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid|5-HTP|5-Hydroxytryptophan|5-hydroxy-DL-tryptophan|5-hydroxytryptophan|5-hydroxytryptophan DL-form|DL-5-HTP|DL-5-hydroxytryptophan http://purl.obolibrary.org/obo/CHEBI_28171 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28172 biolink:ChemicalEntity harmaline A harmala alkaloid in which the harman skeleton is methoxy-substituted at C-7 and has been reduced across the 3,4 bond. cas:304-21-2|kegg.compound:C06536|knapsack:C00001735|reaxys:207310 Graph 3,4-Dihydroharmine|7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline|7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole|Armalin|Dihydroharmine|Harmaline|Harmalol methyl ether|Harmidine|O-Methylharmalol|harmalin 7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole 3,4-Dihydroharmine|7-methoxy-1-methyl-4,9-dihydro-3H-beta-carboline|7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole|Armalin|Dihydroharmine|Harmaline|Harmalol methyl ether|Harmidine|O-Methylharmalol|harmalin http://purl.obolibrary.org/obo/CHEBI_28172 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28175 biolink:ChemicalEntity beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer A sialotetraosylceramide consisting of a branched hexasaccharide made up from two sialyl residues, two galactose residues, one N-acetylglucosamine residue and a glucose residue at the reducing end attached to the ceramide portion via a β-linkage. cas:19553-76-5|kegg.compound:C06141|kegg.glycan:G00115|lipidmaps:LMSP0601AQ00|pubmed:10949532|pubmed:1371229|pubmed:1567198|pubmed:16341241|pubmed:1724444|pubmed:17855742|pubmed:19221437|pubmed:19726417|pubmed:2303428|pubmed:2448252|pubmed:24841627|pubmed:25748038|pubmed:25867522|pubmed:26050638|pubmed:27485170|pubmed:27938|pubmed:28188832|pubmed:28416698|pubmed:6204642|pubmed:7534889|pubmed:7691279|pubmed:7693874|pubmed:8857725|reaxys:10056853 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD1b|Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glcbeta1-1Cer|II(3)(Neuaca2-8NeuAc)Gg4Cer|II(3)Neu5Ac2GgOse4Cer|beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|disialo GD1b|disialoganglioside GD1b|ganglioside GD1b (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)2 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD1b|Gal(beta1-3)GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)Gal-beta1->4Glc-beta1->1'Cer|Gal-beta1->3GalNAc-beta1->4(Neu5Ac-alpha2->8Neu5Ac-alpha2->3)LacCer|Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1Cer|Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glcbeta1-1Cer|II(3)(Neuaca2-8NeuAc)Gg4Cer|II(3)Neu5Ac2GgOse4Cer|beta-Galp-(1->3)-beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|disialo GD1b|disialoganglioside GD1b|ganglioside GD1b http://purl.obolibrary.org/obo/CHEBI_28175 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28177 biolink:ChemicalEntity theophylline A dimethylxanthine having the two methyl groups located at positions 1 and 3. It is structurally similar to caffeine and is found in green and black tea. cas:58-55-9|drugbank:DB00277|drugcentral:2620|gmelin:51226|hmdb:HMDB0001889|kegg.compound:C07130|kegg.drug:D00371|knapsack:C00001510|metacyc.compound:CPD-12479|pdb-ccd:TEP|pubmed:10796631|pubmed:10836323|pubmed:10893702|pubmed:10921764|pubmed:11126990|pubmed:11170036|pubmed:11200776|pubmed:11261527|pubmed:11408152|pubmed:11826912|pubmed:11848250|pubmed:11941393|pubmed:11949272|pubmed:11950649|pubmed:12531775|pubmed:12836095|pubmed:14517178|pubmed:14713563|pubmed:14988770|pubmed:15005370|pubmed:15042504|pubmed:15202575|pubmed:15317832|pubmed:15356646|pubmed:15483348|pubmed:15739418|pubmed:15829161|pubmed:15902964|pubmed:15908149|pubmed:16083514|pubmed:16651698|pubmed:16930490|pubmed:17130682|pubmed:17207928|pubmed:18307508|pubmed:18800032|pubmed:19559058|pubmed:19727789|pubmed:19845735|pubmed:19888960|pubmed:21467671|pubmed:21796703|pubmed:21834615|pubmed:22377744|pubmed:22541679|pubmed:22541837|pubmed:22702215|pubmed:22770225|pubmed:22771369|pubmed:22836872|pubmed:22909172|pubmed:22915350|pubmed:22981724|pubmed:7302609|pubmed:7389811|pubmed:7656958|pubmed:7767539|pubmed:8730732|pubmed:8960878|pubmed:9256615|reaxys:13463|vsdb:1801|wikipedia.en:Theophylline Graph 1,3-Dimethylxanthine|1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|1,3-dimethyl-7H-purine-2,6-dione|Elixophyllin|Respbid|THEOPHYLLINE|Theo-Dur|Theolair|Theophyllin|Theophylline|Uniphyl|theophylline|theophylline anhydrous 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione 1,3-Dimethylxanthine|1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|1,3-dimethyl-7H-purine-2,6-dione|Elixophyllin|Respbid|THEOPHYLLINE|Theo-Dur|Theolair|Theophyllin|Theophylline|Uniphyl|theophylline|theophylline anhydrous http://purl.obolibrary.org/obo/CHEBI_28177 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28179 biolink:ChemicalEntity benzamide An aromatic amide that consists of benzene bearing a single carboxamido substituent. The parent of the class of benzamides. cas:55-21-0|hmdb:HMDB0004461|kegg.compound:C09815|pubmed:20133863|reaxys:385876|umbbd.compound:c0368|wikipedia.en:Benzamide Graph Benzamide|Benzenecarboxamide|Benzoic acid amide|Benzoylamide|PhC(=O)NH2|PhC(O)NH2|Phenylcarboxamide|Phenylcarboxyamide|benzamide Benzamide|benzamide Benzamide|Benzenecarboxamide|Benzoic acid amide|Benzoylamide|PhC(=O)NH2|PhC(O)NH2|Phenylcarboxamide|Phenylcarboxyamide|benzamide http://purl.obolibrary.org/obo/CHEBI_28179 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28181 biolink:ChemicalEntity 2',3'-cyclic GMP A 2',3'-cyclic purine nucleotide in which guanosine is used as the parent nucleoside. cas:634-02-6|kegg.compound:C06194|metacyc.compound:CPD-3709|reaxys:59789 Graph 2',3'-Cyclic GMP|2-amino-9-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxidotetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-1,9-dihydro-6H-purin-6-one|O(2'),O(3')-hydroxyphosphoryl-guanosine|cyclic guanosine 2',3'-monophosphate|guanosine 2',3'-cyclic monophosphate|guanosine 2',3'-cyclic phosphate|guanosine cyclic 2',3'-(hydrogen phosphate)|guanosine cyclic-2',3'-monophosphate 2-amino-9-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxidotetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-1,9-dihydro-6H-purin-6-one 2',3'-Cyclic GMP|2-amino-9-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxidotetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-1,9-dihydro-6H-purin-6-one|O(2'),O(3')-hydroxyphosphoryl-guanosine|cyclic guanosine 2',3'-monophosphate|guanosine 2',3'-cyclic monophosphate|guanosine 2',3'-cyclic phosphate|guanosine cyclic 2',3'-(hydrogen phosphate)|guanosine cyclic-2',3'-monophosphate http://purl.obolibrary.org/obo/CHEBI_28181 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28185 biolink:ChemicalEntity kanamycin C beilstein:61645|cas:2280-32-2|kegg.compound:C01823|knapsack:C00018690|metacyc.compound:CPD-4823|pdb-ccd:KNC Graph (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2-amino-2-deoxy-alpha-D-glucopyranoside|Kanamycin C (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2-amino-2-deoxy-alpha-D-glucopyranoside (1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2-amino-2-deoxy-alpha-D-glucopyranoside|Kanamycin C http://purl.obolibrary.org/obo/CHEBI_28185 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28189 biolink:ChemicalEntity isomaltose A glycosylglucose consisting of two D-glucopyranose units connected by an α-(1→6)-linkage. hmdb:HMDB0002923|kegg.compound:C00252|kegg.glycan:G01318|knapsack:C00018660|pubmed:10649708|pubmed:12420145|pubmed:15856492|pubmed:17439666|pubmed:18551581|pubmed:18551697|pubmed:18552181|pubmed:18553698|pubmed:19508914|pubmed:2279245|pubmed:2526680|pubmed:3480987|pubmed:7573970|pubmed:8003622|pubmed:8179179|pubmed:8890914|pubmed:9987646|reaxys:1292775|wikipedia.en:Isomaltose Graph (Glc)2|6-O-alpha-D-glucopyranosyl-D-glucopyranose|Brachiose|Hunterioside|Isomaltose|alpha-D-Glc-(1->6)-D-Glc|alpha-D-Glcp-(1->6)-D-Glcp|alpha-D-glucopyranosyl-(1->6)-D-glucopyranose|alpha-D-glucosyl-(1->6)-D-glucose|isomaltose alpha-D-glucopyranosyl-(1->6)-D-glucopyranose (Glc)2|6-O-alpha-D-glucopyranosyl-D-glucopyranose|Brachiose|Hunterioside|Isomaltose|alpha-D-Glc-(1->6)-D-Glc|alpha-D-Glcp-(1->6)-D-Glcp|alpha-D-glucopyranosyl-(1->6)-D-glucopyranose|alpha-D-glucosyl-(1->6)-D-glucose|isomaltose http://purl.obolibrary.org/obo/CHEBI_28189 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28191 biolink:ChemicalEntity 6-alpha-maltosylglucose A glucotriose consisting of two α-D-glucopyranose residues and a D-glucopyranose residue joined in sequence by (1→4) and (1→6) glycosidic bonds. glygen:G07348OG|glytoucan:G07348OG|hmdb:HMDB0039707|kegg.compound:C03367|kegg.glycan:G00389 Graph (3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol|(3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol|Glc(a1-4)Glc(a1-6)Glc|alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->6)-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose Glc(a1-4)Glc(a1-6)Glc|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose (3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol|(3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrol|Glc(a1-4)Glc(a1-6)Glc|alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->6)-D-gluco-hexopyranose|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->6)-D-glucopyranose http://purl.obolibrary.org/obo/CHEBI_28191 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28193 biolink:ChemicalEntity lupanine The δ-lactam obtained by formal oxidation at the 2-position of sparteine. The major alkaloid from the seeds of Lupinus exaltatus, L. mexicanus and L. rotundiflorus, it is among the most important of the tetracyclic quinolizidine alkaloids. cas:550-90-3|kegg.compound:C10772|knapsack:C00002225|metacyc.compound:CPD-8917|pubmed:11045450|pubmed:11714325|pubmed:17269069|pubmed:17402058|pubmed:19467626|pubmed:20580181|pubmed:7810174|pubmed:930514|pubmed:9751462|reaxys:86318 Graph (+)-2-oxosparteine|(+)-Lupanine|(7alpha,7aalpha,14alpha,14abeta)-dodecahydro-7,14-methano-2H,11H-dipyridol[1,2-a:1',2'-e][1,5]diazocin-11-one|2-oxosparteine|Lupanine|d-lupanine|lupanine|spartein-2-one spartein-2-one (+)-2-oxosparteine|(+)-Lupanine|(7alpha,7aalpha,14alpha,14abeta)-dodecahydro-7,14-methano-2H,11H-dipyridol[1,2-a:1',2'-e][1,5]diazocin-11-one|2-oxosparteine|Lupanine|d-lupanine|lupanine|spartein-2-one http://purl.obolibrary.org/obo/CHEBI_28193 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28195 biolink:ChemicalEntity 3alpha-hydroxy-5beta-androstan-17-one An androstanoid that is 5β-androstane substituted by an α-hydroxy group at position 3 and an oxo group at position 17. It is a metabolite of testosterone in mammals. cas:53-42-9|drugbank:DB02854|hmdb:HMDB0000490|kegg.compound:C04373|lipidmaps:LMST02020059|pdb-ccd:AE2|pubmed:1146492|pubmed:301822|pubmed:663966|reaxys:2217625|wikipedia.en:Etiocholanolone Graph (3alpha,5beta)-3-hydroxyandrostan-17-one|3-alpha-hydroxy-5-beta-androstan-17-one|3alpha-Hydroxy-5beta-androstan-17-one|3alpha-Hydroxyetiocholan-17-one|3alpha-etiocholanolone|3alpha-hydroxy-5beta-androstan-17-one|5-isoandrosterone|5beta-androstan-3alpha-ol-17-one|5beta-androsterone|AETIOCHOLANOLONE|Etiocholan-3alpha-ol-17-one|Etiocholanolone 3alpha-Hydroxy-5beta-androstan-17-one|3alpha-hydroxy-5beta-androstan-17-one (3alpha,5beta)-3-hydroxyandrostan-17-one|3-alpha-hydroxy-5-beta-androstan-17-one|3alpha-Hydroxy-5beta-androstan-17-one|3alpha-Hydroxyetiocholan-17-one|3alpha-etiocholanolone|3alpha-hydroxy-5beta-androstan-17-one|5-isoandrosterone|5beta-androstan-3alpha-ol-17-one|5beta-androsterone|AETIOCHOLANOLONE|Etiocholan-3alpha-ol-17-one|Etiocholanolone http://purl.obolibrary.org/obo/CHEBI_28195 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28197 biolink:ChemicalEntity daidzein A member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone substituted by an additional hydroxy group at position 4'. cas:486-66-8|hmdb:HMDB0003312|kegg.compound:C10208|knapsack:C00009380|lincs.smallmolecule:LSM-2935|lipidmaps:LMPK12050038|metacyc.compound:DAIDZEIN|pubmed:11193416|pubmed:16802696|pubmed:23267126|pubmed:23337939|pubmed:23342971|pubmed:23439294|pubmed:9544566|reaxys:231523|wikipedia.en:Daidzein Graph 4',7-dihydroxyisoflavone|7,4'-dihydroxyisoflavone|7-Hydroxy-3-(4-hydroxyphenyl)-4-benzopyrone|7-hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one|Daidzein|daidzeol|isoaurostatin 7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one 4',7-dihydroxyisoflavone|7,4'-dihydroxyisoflavone|7-Hydroxy-3-(4-hydroxyphenyl)-4-benzopyrone|7-hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one|Daidzein|daidzeol|isoaurostatin http://purl.obolibrary.org/obo/CHEBI_28197 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28199 biolink:ChemicalEntity ferrienterobactin(3-) Iron (Fe3+) siderophore cas:61481-53-6|gmelin:2494246|gmelin:885856|kegg.compound:C06230|metacyc.compound:FERRIC-ENTEROBACTIN-COMPLEX|pubmed:12655062|pubmed:16819888|pubmed:21842211|pubmed:23905838|pubmed:24981231|pubmed:28956921|pubmed:30135989|pubmed:31413254|pubmed:32098871|pubmed:9852016 Graph Fe(III)-enterobactin|Fe-enterobactin|FeEnt|[Fe(ent)](3-)|ferric enterobactin|ferric-enterobactin|ferrienterobactin|ferrienterochelin|{N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato](6-)}ferrate(3-)|{N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato]}ferrate(3-) {N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato](6-)}ferrate(3-)|{N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato]}ferrate(3-) Fe(III)-enterobactin|Fe-enterobactin|FeEnt|[Fe(ent)](3-)|ferric enterobactin|ferric-enterobactin|ferrienterobactin|ferrienterochelin|{N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato](6-)}ferrate(3-)|{N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[2,3-di(hydroxy-kappaO)benzamidato]}ferrate(3-) http://purl.obolibrary.org/obo/CHEBI_28199 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28201 biolink:ChemicalEntity rotenone A member of the class of rotenones that consists of 1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6aH)-one substituted at position 2 by a prop-1-en-2-yl group and at positions 8 and 9 by methoxy groups (the 2R,6aS,12aS-isomer). A non-systemic insecticide, it is the principal insecticidal constituent of derris (the dried rhizome and root of Derris elliptica). bpdb:587|cas:83-79-4|drugbank:DB11457|foodb.food:FDB012837|hmdb:HMDB0034436|kegg.compound:C07593|knapsack:C00002568|lincs.smallmolecule:LSM-5260|lipidmaps:LMPK12060007|patent:CN102007944|patent:CN102090406|pdb-ccd:970|pubmed:14976342|pubmed:15043430|pubmed:15790535|pubmed:17077549|pubmed:19013527|pubmed:32972993|pubmed:33402167|pubmed:33901458|pubmed:33961406|reaxys:99070|vsdb:587|wikipedia.en:Rotenone Graph (-)-cis-rotenone|(-)-rotenone|(12aS,6aS,2R)-8,9-dimethoxy-2-(1-methylvinyl)-1,2-dihydrochromano[3,4-b]furano [2,3-h]chroman-6-one|(2R,6aS,12aS)-8,9-dimethoxy-2-(prop-1-en-2-yl)-1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6aH)-one|5'beta-rotenone|Derris|Rotenone|[2R-(2alpha,6aalpha,12aalpha)]-1,2,12,12a-tetrahydro-8,9-dimethoxy-2-(1-methylethenyl)[1]benzopyrano[3,4-b]furo[2,3-H][1]benzopyran-6(6aH)-one|barbasco|canex|dactinol|noxfire|paraderil|tubatoxin (2R,6aS,12aS)-8,9-dimethoxy-2-(prop-1-en-2-yl)-1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6aH)-one (-)-cis-rotenone|(-)-rotenone|(12aS,6aS,2R)-8,9-dimethoxy-2-(1-methylvinyl)-1,2-dihydrochromano[3,4-b]furano [2,3-h]chroman-6-one|(2R,6aS,12aS)-8,9-dimethoxy-2-(prop-1-en-2-yl)-1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6aH)-one|5'beta-rotenone|Derris|Rotenone|[2R-(2alpha,6aalpha,12aalpha)]-1,2,12,12a-tetrahydro-8,9-dimethoxy-2-(1-methylethenyl)[1]benzopyrano[3,4-b]furo[2,3-H][1]benzopyran-6(6aH)-one|barbasco|canex|dactinol|noxfire|paraderil|tubatoxin http://purl.obolibrary.org/obo/CHEBI_28201 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28203 biolink:ChemicalEntity N-acetyl-D-phenylalanine beilstein:2213852|cas:10172-89-1|kegg.compound:C05620 Graph N-Acetyl-D-phenylalanine|N-acetyl-D-phenylalanine N-Acetyl-D-phenylalanine|N-acetyl-D-phenylalanine N-Acetyl-D-phenylalanine|N-acetyl-D-phenylalanine http://purl.obolibrary.org/obo/CHEBI_28203 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28205 biolink:ChemicalEntity phaseic acid cas:24394-14-7|kegg.compound:C09707|knapsack:C00003170|pubmed:10456320|pubmed:12081536|pubmed:14663585|pubmed:15381416|pubmed:15971290|pubmed:16661176|pubmed:16662852|pubmed:16663536|pubmed:16663564|pubmed:16665009|pubmed:16666353|pubmed:19888743|pubmed:5373535|pubmed:5373536 Graph (-)-Phaseic acid|(2Z,4E)-5-[(1R,5R,8S)-8-hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]oct-8-yl]-3-methylpenta-2,4-dienoic acid|(7E,9Z)-(1R,5R,6S)-5,16-epoxy-6-hydroxy-3-oxo-5,6-dihydro-11-apo-beta-caroten-11-oic acid|Phaseic acid (2Z,4E)-5-[(1R,5R,8S)-8-hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]oct-8-yl]-3-methylpenta-2,4-dienoic acid|(7E,9Z)-(1R,5R,6S)-5,16-epoxy-6-hydroxy-3-oxo-5,6-dihydro-11-apo-beta-caroten-11-oic acid (-)-Phaseic acid|(2Z,4E)-5-[(1R,5R,8S)-8-hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]oct-8-yl]-3-methylpenta-2,4-dienoic acid|(7E,9Z)-(1R,5R,6S)-5,16-epoxy-6-hydroxy-3-oxo-5,6-dihydro-11-apo-beta-caroten-11-oic acid|Phaseic acid http://purl.obolibrary.org/obo/CHEBI_28205 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28206 biolink:ChemicalEntity 2'-hydroxyisoflavones Any hydroxyisoflavone which has a hydroxy group at the 2-position of the phenyl substituent. kegg.compound:C02921|metacyc.compound:2-Hydroxyisoflavones Graph 2'-Hydroxyisoflavone|a 2'-hydroxyisoflavone 2'-Hydroxyisoflavone|a 2'-hydroxyisoflavone http://purl.obolibrary.org/obo/CHEBI_28206 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28207 biolink:ChemicalEntity D-galactosamine 1-phosphate cas:26401-96-7|kegg.compound:C03783|pubmed:20400541|pubmed:2350539|reaxys:15596240 Graph 2-amino-2-deoxy-1-O-phosphono-D-galactopyranose|D-Galactosamine 1-phosphate|Galn-1-P 2-amino-2-deoxy-1-O-phosphono-D-galactopyranose|D-Galactosamine 1-phosphate|Galn-1-P http://purl.obolibrary.org/obo/CHEBI_28207 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28209 biolink:ChemicalEntity 5(S)-HETE A HETE having a (5S)-hydroxy group and (6E)-, (8Z)-, (11Z)- and (14Z)-double bonds. cas:70608-72-9|hmdb:HMDB0011134|kegg.compound:C04805|knapsack:C00000423|lipidmaps:LMFA03060002|pubmed:10987416|pubmed:3460103|pubmed:3592413|reaxys:4691533|wikipedia.en:5-Hydroxyeicosatetraenoic_acid Graph (5S,6E,8Z,11Z,14Z)-5-hydroxyeicosa-6,8,11,14-tetraenoic acid|(5S,6E,8Z,11Z,14Z)-5-hydroxyicosa-6,8,11,14-tetraenoic acid|(6E,8Z,11Z,14Z)-(5S)-5-Hydroxyicosa-6,8,11,14-tetraenoic acid|(S)-(E,Z,Z,Z)-5-hydroxyeicosa-6,8,11,14-tetraenoic acid|5(S)-HETE|5(S)-hydroxy-6(E),8(Z),11(Z),14(Z)-eicosatetraenoic acid|5(S)-hydroxyeicosatetraenoic acid|5-Hydroxyeicosatetraenoate|5S-HETE|6,8,11,14-Eicosatetraenoic acid, 5-hydroxy-, (S-(E,Z,Z,Z))- (5S,6E,8Z,11Z,14Z)-5-hydroxyicosa-6,8,11,14-tetraenoic acid (5S,6E,8Z,11Z,14Z)-5-hydroxyeicosa-6,8,11,14-tetraenoic acid|(5S,6E,8Z,11Z,14Z)-5-hydroxyicosa-6,8,11,14-tetraenoic acid|(6E,8Z,11Z,14Z)-(5S)-5-Hydroxyicosa-6,8,11,14-tetraenoic acid|(S)-(E,Z,Z,Z)-5-hydroxyeicosa-6,8,11,14-tetraenoic acid|5(S)-HETE|5(S)-hydroxy-6(E),8(Z),11(Z),14(Z)-eicosatetraenoic acid|5(S)-hydroxyeicosatetraenoic acid|5-Hydroxyeicosatetraenoate|5S-HETE|6,8,11,14-Eicosatetraenoic acid, 5-hydroxy-, (S-(E,Z,Z,Z))- http://purl.obolibrary.org/obo/CHEBI_28209 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28217 biolink:ChemicalEntity acrylonitrile A nitrile that is hydrogen cyanide in which the hydrogen has been replaced by an ethenyl group. cas:107-13-1|kegg.compound:C01998|pdb-ccd:6AC|ppdb:2545|pubmed:12075111|pubmed:23043843|pubmed:24248151|pubmed:28782019|pubmed:28965700|pubmed:29217572|pubmed:29713581|pubmed:8330351|pubmed:9598299|reaxys:605310|umbbd.compound:c0148 Graph 2-propenenitrile|Acrylnitril|Acrylonitrile|Acrylsaeurenitril|Propenenitrile|Vinyl cyanide|acrylonitrile|cyanure de vinyle|nitrile acrylique Acrylonitrile|acrylonitrile 2-propenenitrile|Acrylnitril|Acrylonitrile|Acrylsaeurenitril|Propenenitrile|Vinyl cyanide|acrylonitrile|cyanure de vinyle|nitrile acrylique http://purl.obolibrary.org/obo/CHEBI_28217 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28220 biolink:ChemicalEntity 1-(6-hydroxy-3-pyridyl)-4-(methylamino)butan-1-one A dihydroxypyridine that is pseudooxynicotine in which the hydrogens at positions 2 and 6 on the pyridine ring are substituted by hydroxy groups. kegg.compound:C15986|metacyc.compound:CPD-113|reaxys:394128|umbbd.compound:c0469 Graph 1-(2,6-dihydroxypyridin-3-yl)-4-(methylamino)butan-1-one 1-(2,6-dihydroxypyridin-3-yl)-4-(methylamino)butan-1-one 1-(2,6-dihydroxypyridin-3-yl)-4-(methylamino)butan-1-one http://purl.obolibrary.org/obo/CHEBI_28220 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28222 biolink:ChemicalEntity 1,2,4-trichlorobenzene A trichlorobenzene with chloro substituents at positions 1, 2 and 4. cas:120-82-1|gmelin:261300|kegg.compound:C06594|metacyc.compound:124-TCB|pubmed:16271379|reaxys:956819|umbbd.compound:c0465|wikipedia.en:1,2,4-Trichlorobenzene Graph 1,2,4-Trichlorbenzol|1,2,4-Trichlorobenzene|1,2,4-trichlorobenzene|1,2,5-trichlorobenzene|Trichlorobenzene A|as-trichlorobenzene|unsym-trichlorobenzene 1,2,4-Trichlorobenzene|1,2,4-trichlorobenzene 1,2,4-Trichlorbenzol|1,2,4-Trichlorobenzene|1,2,4-trichlorobenzene|1,2,5-trichlorobenzene|Trichlorobenzene A|as-trichlorobenzene|unsym-trichlorobenzene http://purl.obolibrary.org/obo/CHEBI_28222 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28225 biolink:ChemicalEntity D-leucine The D-enantiomer of leucine. cas:328-38-1|drugbank:DB01746|gmelin:82675|hmdb:HMDB0013773|kegg.compound:C01570|pdb-ccd:DLE|pubmed:15375647|pubmed:21941889|pubmed:24097941|reaxys:1721721|ymdb:YMDB00997 Graph (2R)-2-amino-4-methylpentanoic acid|(R)-(-)-leucine|(R)-leucine|D-2-Amino-4-methylvaleric acid|D-LEUCINE|D-Leucin|D-Leucine|D-Leuzin|D-leucine|DLE D-LEUCINE|D-Leucine|D-leucine (2R)-2-amino-4-methylpentanoic acid|(R)-(-)-leucine|(R)-leucine|D-2-Amino-4-methylvaleric acid|D-LEUCINE|D-Leucin|D-Leucine|D-Leuzin|D-leucine|DLE http://purl.obolibrary.org/obo/CHEBI_28225 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28228 biolink:ChemicalEntity S-acetylphosphopantotheine beilstein:6784226|kegg.compound:C03725 Graph S-Acetylphosphopantetheine|S-[2-({N-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] ethanethioate S-[2-({N-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] ethanethioate S-Acetylphosphopantetheine|S-[2-({N-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] ethanethioate http://purl.obolibrary.org/obo/CHEBI_28228 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28229 biolink:ChemicalEntity N(omega)-methyl-L-arginine A L-arginine derivative with a Nω-methyl substituent. beilstein:2262067|cas:17035-90-4|kegg.compound:C03884|pdb-ccd:NMM Graph (2S)-2-amino-5-(N'-methylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[imino(methylamino)methyl]amino}pentanoic acid|L-NMMA|L-monomethylarginine|N(5)-(N-methylcarbamimidoyl)-L-ornithine|N(5)-(methylamidino)-L-ornithine|N(5)-(metilamidino)-L-ornitina|N(5)-[imino(methylamino)methyl]-L-ornithine|N(G)-monomethyl-L-arginine|N-monomethyl-L-arginine|Ngamma-Monomethyl-L-arginine|acide (2S)-2-amino-5-(3-methylguanidino)pentanoique|omega-N-methylarginine|omega-N-monomethylarginine|targinina|targinine|targininum|tilarginina|tilarginine|tilargininum (2S)-2-amino-5-(N'-methylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[imino(methylamino)methyl]amino}pentanoic acid|N(5)-(N-methylcarbamimidoyl)-L-ornithine|N(5)-[imino(methylamino)methyl]-L-ornithine (2S)-2-amino-5-(N'-methylcarbamimidamido)pentanoic acid|(2S)-2-amino-5-{[imino(methylamino)methyl]amino}pentanoic acid|L-NMMA|L-monomethylarginine|N(5)-(N-methylcarbamimidoyl)-L-ornithine|N(5)-(methylamidino)-L-ornithine|N(5)-(metilamidino)-L-ornitina|N(5)-[imino(methylamino)methyl]-L-ornithine|N(G)-monomethyl-L-arginine|N-monomethyl-L-arginine|Ngamma-Monomethyl-L-arginine|acide (2S)-2-amino-5-(3-methylguanidino)pentanoique|omega-N-methylarginine|omega-N-monomethylarginine|targinina|targinine|targininum|tilarginina|tilarginine|tilargininum http://purl.obolibrary.org/obo/CHEBI_28229 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28230 biolink:ChemicalEntity hesperetin A trihydroxyflavanone having the three hydroxy gropus located at the 3'-, 5- and 7-positions and an additional methoxy substituent at the 4'-position. cas:520-33-2|drugbank:DB01094|drugcentral:1362|hmdb:HMDB0005782|kegg.compound:C01709|knapsack:C00000968|lincs.smallmolecule:LSM-20933|lipidmaps:LMPK12140003|metacyc.compound:CPD-7072|pubmed:16964766|pubmed:22409373|pubmed:22794525|pubmed:22899565|pubmed:22903244|reaxys:92705|wikipedia.en:Hesperetin Graph (-)-(S)-hesperetin|(-)-hesperetin|(2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-hesperetin|(S)-2,3-dihydro-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|3',5,7-Trihydroxy-4'-methoxyflavanone|Hesperetin (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one (-)-(S)-hesperetin|(-)-hesperetin|(2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-hesperetin|(S)-2,3-dihydro-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one|3',5,7-Trihydroxy-4'-methoxyflavanone|Hesperetin http://purl.obolibrary.org/obo/CHEBI_28230 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28233 biolink:ChemicalEntity 2,4,6-trihydroxybenzophenone A benzenetriol that is benzophenone in which one of the phenyl groups is substituted at by hydroxy groups at positions 2, 4, and 6. cas:3555-86-0|kegg.compound:C06356|metacyc.compound:CPD-6881|pubmed:12795704|pubmed:19699497|pubmed:22390826|reaxys:2054361 Graph 2,4,6-Trihydroxybenzophenone|phenyl(2,4,6-trihydroxyphenyl)methanone phenyl(2,4,6-trihydroxyphenyl)methanone 2,4,6-Trihydroxybenzophenone|phenyl(2,4,6-trihydroxyphenyl)methanone http://purl.obolibrary.org/obo/CHEBI_28233 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28235 biolink:ChemicalEntity p-methoxybenzaldehyde A member of the class of benzaldehydes consisting of benzaldehyde itself carrying a methoxy substituent at position 4. cas:123-11-5|hmdb:HMDB0029686|kegg.compound:C10761|knapsack:C00002636|pubmed:20809147|pubmed:22502535|pubmed:22610435|pubmed:24817361|pubmed:27081359|pubmed:27333544|pubmed:28190358|pubmed:28534578|pubmed:28846628|pubmed:28892803|pubmed:29029251|pubmed:29029346|reaxys:471382|wikipedia.en:Anisaldehyde Graph 4-Anisaldehyde|4-Methoxy-Benzaldehyde|4-methoxybenzaldehyde|Anisal|Para-Anisaldehyde|p-Anisaldehyde|p-Anisic aldehyde|p-Formylanisole|p-Methoxybenzaldehyde 4-methoxybenzaldehyde 4-Anisaldehyde|4-Methoxy-Benzaldehyde|4-methoxybenzaldehyde|Anisal|Para-Anisaldehyde|p-Anisaldehyde|p-Anisic aldehyde|p-Formylanisole|p-Methoxybenzaldehyde http://purl.obolibrary.org/obo/CHEBI_28235 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28240 biolink:ChemicalEntity dichloroacetate A monocarboxylic acid anion that is the conjugate base of dichloroacetic acid. cas:13425-80-4|gmelin:200685|metacyc.compound:CPD-9674|pubmed:21153705|reaxys:3903873|umbbd.compound:c0012 Graph dichloracetate|dichloroacetate|dichloroacetate ion|dichloroacetic acid ion(1-) dichloroacetate dichloracetate|dichloroacetate|dichloroacetate ion|dichloroacetic acid ion(1-) http://purl.obolibrary.org/obo/CHEBI_28240 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28241 biolink:ChemicalEntity papaverine A benzylisoquinoline alkaloid that is isoquinoline substituted by methoxy groups at positions 6 and 7 and a 3,4-dimethoxybenzyl group at position 1. It has been isolated from Papaver somniferum. cas:58-74-2|drugbank:DB01113|drugcentral:2056|hmdb:HMDB0015245|kegg.compound:C06533|kegg.drug:D07425|knapsack:C00001899|knapsack:C00027467|lincs.smallmolecule:LSM-2338|metacyc.compound:CPD-15742|pdb-ccd:EV1|pubmed:11971205|pubmed:24414229|reaxys:312930|wikipedia.en:Papaverine Graph 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline 1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline http://purl.obolibrary.org/obo/CHEBI_28241 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28245 biolink:ChemicalEntity (S)-2-amino-6-oxopimelic acid cas:75650-93-0|kegg.compound:C03871|pdb-ccd:26P Graph (2S)-2-amino-6-oxoheptanedioic acid|(S)-2-amino-6-oxoheptanedioic acid|2-AMINO-6-OXOPIMELIC ACID|L-2-Amino-6-oxoheptanedioate|L-2-Amino-6-oxopimelate|L-alpha-amino-epsilon-keto-pimelic acid (2S)-2-amino-6-oxoheptanedioic acid (2S)-2-amino-6-oxoheptanedioic acid|(S)-2-amino-6-oxoheptanedioic acid|2-AMINO-6-OXOPIMELIC ACID|L-2-Amino-6-oxoheptanedioate|L-2-Amino-6-oxopimelate|L-alpha-amino-epsilon-keto-pimelic acid http://purl.obolibrary.org/obo/CHEBI_28245 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28247 biolink:ChemicalEntity 11beta-hydroxyprogesterone A 11β-hydroxy steroid that is progesterone substituted by a β-hydroxy group at position 11. cas:600-57-7|hmdb:HMDB0004031|kegg.compound:C05498|lipidmaps:LMST02030168|pubmed:1022526|pubmed:13252188|pubmed:3546944|reaxys:2062114 Graph (11beta)-11-hydroxypregn-4-ene-3,20-dione|11-beta-hydroxyprogesterone|11beta-Hydroxyprogesterone|11beta-hydroxypregn-4-ene-3,20-dione|21-deoxycorticosterone 11beta-hydroxypregn-4-ene-3,20-dione (11beta)-11-hydroxypregn-4-ene-3,20-dione|11-beta-hydroxyprogesterone|11beta-Hydroxyprogesterone|11beta-hydroxypregn-4-ene-3,20-dione|21-deoxycorticosterone http://purl.obolibrary.org/obo/CHEBI_28247 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2825 biolink:ChemicalEntity aristolochic acid A An aristolochic acid that is phenanthrene-1-carboxylic acid that is substituted by a methylenedioxy group at the 3,4 positions, by a methoxy group at position 8, and by a nitro group at position 10. It is the most abundant of the aristolochic acids and is found in almost all Aristolochia (birthworts or pipevines) species. It has been tried in a number of treatments for inflammatory disorders, mainly in Chinese and folk medicine. However, there is concern over their use as aristolochic acid is both carcinogenic and nephrotoxic. cas:313-67-7|kegg.compound:C08469|knapsack:C00001526|knapsack:C00027516|lincs.smallmolecule:LSM-2373|pubmed:21558304|pubmed:21719716|pubmed:22071594|pubmed:22118289|pubmed:22126455|pubmed:22245565|pubmed:22373701|reaxys:345159|wikipedia.en:Aristolochic_acid Graph 3,4-methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid|8-methoxy-6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid|8-methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid|8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid|AAA|Aristolochic acid|Aristolochic acid I|aristolochic acid A|aristolochic acid-I|aristolochin 8-methoxy-6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid 3,4-methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid|8-methoxy-6-nitro-2H-phenanthro[3,4-d][1,3]dioxole-5-carboxylic acid|8-methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid|8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid|AAA|Aristolochic acid|Aristolochic acid I|aristolochic acid A|aristolochic acid-I|aristolochin http://purl.obolibrary.org/obo/CHEBI_2825 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28250 biolink:ChemicalEntity 6-O-acetyl-beta-D-galactoside kegg.compound:C03773 Graph 6-Acetyl-beta-D-galactoside|6-O-acetyl-beta-D-galactosides|a 6-acetyl-beta-D-galactoside 6-Acetyl-beta-D-galactoside|6-O-acetyl-beta-D-galactosides|a 6-acetyl-beta-D-galactoside http://purl.obolibrary.org/obo/CHEBI_28250 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28255 biolink:ChemicalEntity N-glycolyl-D-mannosamine kegg.compound:C03521 Graph 2-deoxy-2-[(hydroxyacetyl)amino]-D-mannose|Glycolyl-D-mannosamine|N-Glycolyl-D-mannosamine|N-glycolyl-D-mannosamine 2-deoxy-2-[(hydroxyacetyl)amino]-D-mannose 2-deoxy-2-[(hydroxyacetyl)amino]-D-mannose|Glycolyl-D-mannosamine|N-Glycolyl-D-mannosamine|N-glycolyl-D-mannosamine http://purl.obolibrary.org/obo/CHEBI_28255 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28257 biolink:ChemicalEntity N-acetyl-alpha-D-galactosaminide kegg.compound:C04134 Graph N-Acetyl-alpha-D-galactosaminide|N-acetyl-alpha-D-galactosaminides|an N-acetyl-alpha-D-galactosaminyl derivative N-Acetyl-alpha-D-galactosaminide|N-acetyl-alpha-D-galactosaminides|an N-acetyl-alpha-D-galactosaminyl derivative http://purl.obolibrary.org/obo/CHEBI_28257 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28258 biolink:ChemicalEntity vomifoliol A fenchane monoterpenoid that is 3,5,5-trimethylcyclohex-2-en-1-one substituted by a hydroxy and a (1E)-3-hydroxybut-1-en-1-yl group at position 4. beilstein:2331902|kegg.compound:C04166|pubmed:24436000|pubmed:24949478|pubmed:25282893|pubmed:25918779|reaxys:2331902 Graph (+/-)-6-Hydroxy-3-oxo-alpha-ionol|(+/-)-6-hydroxy-3-oxo-alpha-ionol|4-hydroxy-4-[(1E)-3-hydroxybut-1-en-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one|Vomifoliol 4-hydroxy-4-[(1E)-3-hydroxybut-1-en-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one (+/-)-6-Hydroxy-3-oxo-alpha-ionol|(+/-)-6-hydroxy-3-oxo-alpha-ionol|4-hydroxy-4-[(1E)-3-hydroxybut-1-en-1-yl]-3,5,5-trimethylcyclohex-2-en-1-one|Vomifoliol http://purl.obolibrary.org/obo/CHEBI_28258 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28259 biolink:ChemicalEntity (S)-3-hydroxyisobutyryl-CoA A hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxyisobutyric acid. hmdb:HMDB0001052|kegg.compound:C06000|pubmed:17160907 Graph (S)-3-Hydroxyisobutyryl-CoA|(S)-3-hydroxy-2-methylpropanoyl-coenzyme A|(S)-3-hydroxy-2-methylpropionyl-coenzyme A|(S)-3-hydroxyisobutanoyl-CoA|(S)-3-hydroxyisobutanoyl-coenzyme A|(S)-3-hydroxyisobutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S)-3-hydroxy-2-methylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S)-3-hydroxy-2-methylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxyisobutyryl-CoA|(S)-3-hydroxy-2-methylpropanoyl-coenzyme A|(S)-3-hydroxy-2-methylpropionyl-coenzyme A|(S)-3-hydroxyisobutanoyl-CoA|(S)-3-hydroxyisobutanoyl-coenzyme A|(S)-3-hydroxyisobutyryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(2S)-3-hydroxy-2-methylpropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_28259 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28260 biolink:ChemicalEntity galactose An aldohexose that is the C-4 epimer of glucose. cas:26566-61-0|kegg.compound:C01582|wikipedia.en:Galactose Graph Gal|Galactose|Galaktose|galacto-hexose|galactose Galactose|galacto-hexose|galactose Gal|Galactose|Galaktose|galacto-hexose|galactose http://purl.obolibrary.org/obo/CHEBI_28260 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28261 biolink:ChemicalEntity (+)-alpha-pinene The (+)-enantiomer of α-pinene. cas:7785-70-8|hmdb:HMDB0006525|kegg.compound:C06306|lipidmaps:LMPR0102120012|metacyc.compound:CPD-8754|pdb-ccd:TMH|reaxys:2038653 Graph (+)-3,6,6-TRIMETHYLBICYCLO[3.1.1]HEPT-2-ENE|(+)-alpha-Pinene|(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-alpha-pinene|(1R,5R)-pin-2-ene|alpha-Pinene(dextro) (1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-pin-2-ene (+)-3,6,6-TRIMETHYLBICYCLO[3.1.1]HEPT-2-ENE|(+)-alpha-Pinene|(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1R,5R)-alpha-pinene|(1R,5R)-pin-2-ene|alpha-Pinene(dextro) http://purl.obolibrary.org/obo/CHEBI_28261 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28262 biolink:ChemicalEntity dimethyl sulfoxide A 2-carbon sulfoxide in which the sulfur atom has two methyl substituents. cas:67-68-5|chemspider:659|drugbank:DB01093|drugcentral:906|foodb.food:FDB000764|gmelin:1556|hmdb:HMDB0002151|kegg.compound:C11143|kegg.drug:D01043|knapsack:C00053120|lincs.smallmolecule:LSM-36361|metacyc.compound:DMSO|pdb-ccd:DMS|pubmed:10298633|pubmed:11162043|pubmed:11350866|pubmed:11474739|pubmed:12663039|pubmed:15237653|pubmed:15588915|pubmed:15868171|pubmed:16434015|pubmed:16522014|pubmed:19096138|pubmed:19382398|pubmed:19443933|pubmed:20828537|pubmed:21426213|pubmed:22030943|pubmed:22722716|pubmed:22768202|pubmed:22814967|pubmed:23050031|pubmed:23313473|pubmed:28220525|pubmed:29938311|pubmed:31489176|pubmed:3510103|pubmed:3898376|pubmed:3916302|pubmed:4223708|pubmed:4556944|pubmed:4963226|pubmed:6309056|pubmed:6379027|reaxys:506008|umbbd.compound:c0236|wikipedia.en:Dimethyl_sulfoxide Graph (CH3)2SO|(methanesulfinyl)methane|DIMETHYL SULFOXIDE|DMSO|Dimethyl sulfoxide|Dimethylsulfoxid|S(O)Me2|dimethyl sulfoxide|dimethyl sulfur oxide|dimethyl sulphoxide|dimethyli sulfoxidum|dimethylsulfoxyde|dimetil sulfoxido|dmso|methylsulfinylmethane|sulfinylbis(methane) (methanesulfinyl)methane|DIMETHYL SULFOXIDE|Dimethyl sulfoxide|dimethyl sulfoxide (CH3)2SO|(methanesulfinyl)methane|DIMETHYL SULFOXIDE|DMSO|Dimethyl sulfoxide|Dimethylsulfoxid|S(O)Me2|dimethyl sulfoxide|dimethyl sulfur oxide|dimethyl sulphoxide|dimethyli sulfoxidum|dimethylsulfoxyde|dimetil sulfoxido|dmso|methylsulfinylmethane|sulfinylbis(methane) http://purl.obolibrary.org/obo/CHEBI_28262 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28263 biolink:ChemicalEntity 2,3,5-trichlorobenzene-1,4-diol A member of the class of chlorohydroquinones that is hydroquinone in which three of the four hydrogens attached to the benzene ring have been replaced by chlorines. cas:608-94-6|kegg.compound:C07099|knapsack:C00007486|metacyc.compound:236-TRICHLOROHYDROQUINONE|pubmed:1459949|pubmed:1731793|pubmed:17956123|pubmed:18275157|umbbd.compound:c0328 Graph 2,3,5-trichloro-p-hydroquinone|2,3,5-trichlorobenzene-1,4-diol|2,3,5-trichlorohydroquinone|2,3,6-Trichlorohydroquinone|2,3,6-trichloro-p-hydroquinone|trichlorohydroquinone 2,3,5-trichlorobenzene-1,4-diol 2,3,5-trichloro-p-hydroquinone|2,3,5-trichlorobenzene-1,4-diol|2,3,5-trichlorohydroquinone|2,3,6-Trichlorohydroquinone|2,3,6-trichloro-p-hydroquinone|trichlorohydroquinone http://purl.obolibrary.org/obo/CHEBI_28263 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28264 biolink:ChemicalEntity 3-oxooctanoyl-CoA An oxo-fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 3-oxooctanoic acid. hmdb:HMDB0003941|kegg.compound:C05267|pubmed:344310|reaxys:11066711 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxooctanoyl-CoA|3-ketooctanoyl-CoA|3-ketooctanoyl-coenzyme A|3-oxooctanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxooctanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxooctanoyl-CoA|3-ketooctanoyl-CoA|3-ketooctanoyl-coenzyme A|3-oxooctanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28264 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28266 biolink:ChemicalEntity fluorene An ortho-fused tricyclic hydrocarbon that is a major component of fossil fuels and their derivatives cas:86-73-7|chemspider:6592|foodb.food:FDB007671|gmelin:28451|kegg.compound:C07715|metacyc.compound:FLUORENE|pdb-ccd:9FL|pubmed:15120562|pubmed:15800860|pubmed:16539455|pubmed:17129129|pubmed:17243671|pubmed:17285163|pubmed:17824593|pubmed:19060398|pubmed:21110374|pubmed:21478643|pubmed:23202077|pubmed:24584240|pubmed:24889657|pubmed:28409789|reaxys:1363491|umbbd.compound:c0388|wikipedia.en:Fluorene Graph 2,2'-Methylenebiphenyl|2,3-benzindene|9H-fluorene|Diphenylenemethane|Fluoren|Fluorene|fluorene|o-biphenylenemethane|o-biphenylmethane 9H-fluorene|Fluorene|fluorene 2,2'-Methylenebiphenyl|2,3-benzindene|9H-fluorene|Diphenylenemethane|Fluoren|Fluorene|fluorene|o-biphenylenemethane|o-biphenylmethane http://purl.obolibrary.org/obo/CHEBI_28266 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28272 biolink:ChemicalEntity beta-L-arabinofuranose beilstein:5242094|drugbank:DB03246|glytoucan:G64007OP Graph beta-L-arabinofuranose beta-L-arabinofuranose beta-L-arabinofuranose http://purl.obolibrary.org/obo/CHEBI_28272 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28273 biolink:ChemicalEntity aldehydo-N-acetyl-D-mannosamine 6-phosphate An aldehydo-N-acyl-D-mannosamine 6-phosphate that has acetyl as the acyl group. kegg.compound:C04257 Graph 2-acetamido-2-deoxy-6-O-phosphono-D-mannose|2-acetamido-2-deoxy-D-mannose 6-(dihydrogen phosphate)|N-Acetyl-D-mannosamine 6-phosphate|N-Acetylmannosamine 6-phosphate 2-acetamido-2-deoxy-D-mannose 6-(dihydrogen phosphate) 2-acetamido-2-deoxy-6-O-phosphono-D-mannose|2-acetamido-2-deoxy-D-mannose 6-(dihydrogen phosphate)|N-Acetyl-D-mannosamine 6-phosphate|N-Acetylmannosamine 6-phosphate http://purl.obolibrary.org/obo/CHEBI_28273 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28276 biolink:ChemicalEntity (S)-3-hydroxyhexanoyl-CoA A hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxyhexanoyl-CoA. kegg.compound:C05268|lipidmaps:LMFA07050017 Graph (S)-3-Hydroxyhexanoyl-CoA|(S)-3-hydroxycaproyl-CoA|(S)-3-hydroxycaproyl-coenzyme A|(S)-Hydroxyhexanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-hydroxyhexanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxyhexanoyl-CoA|(S)-3-hydroxycaproyl-CoA|(S)-3-hydroxycaproyl-coenzyme A|(S)-Hydroxyhexanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-hydroxyhexanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28276 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28277 biolink:ChemicalEntity brassinolide beilstein:3633298|bpdb:1724|cas:72962-43-7|kegg.compound:C08814|knapsack:C00000176|lipidmaps:LMST01140001 Graph (22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-6,7-seco-5alpha-campestano-6,7-lactone|(22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-7a-homo-7-oxa-5alpha-campestan-6-one|Brassinolide|brassinolide (22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-7a-homo-7-oxa-5alpha-campestan-6-one (22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-6,7-seco-5alpha-campestano-6,7-lactone|(22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-7a-homo-7-oxa-5alpha-campestan-6-one|Brassinolide|brassinolide http://purl.obolibrary.org/obo/CHEBI_28277 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28279 biolink:ChemicalEntity 6-methylthiopurine A thiopurine that is 9H-purine substituted by a methylsulfanyl group at position 6. cas:50-66-8|hmdb:HMDB0060412|kegg.compound:C16614|pdb-ccd:XQG|pmc:PMC2203228|pubmed:10344752|pubmed:11218242|pubmed:15107925|pubmed:16880012|pubmed:21122558|pubmed:21561141|pubmed:23666567|pubmed:27496503|pubmed:27859568|pubmed:30318058|pubmed:32867649|pubmed:33636909|pubmed:37621013|pubmed:38386080 Graph 6-(methylsulfanyl)-9H-purine|6-(methylthio)-9H-purine|6-(methylthio)purine|6-methylmercaptopurine|6-methylthiopurine|S-methyl-6-mercaptopurine|thiopurine S-methylether 6-(methylsulfanyl)-9H-purine 6-(methylsulfanyl)-9H-purine|6-(methylthio)-9H-purine|6-(methylthio)purine|6-methylmercaptopurine|6-methylthiopurine|S-methyl-6-mercaptopurine|thiopurine S-methylether http://purl.obolibrary.org/obo/CHEBI_28279 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28282 biolink:ChemicalEntity N-benzyloxycarbonyl-L-leucine A L-leucine derivative obtained by the substitution of a benzyloxycarbonyl group on the nitrogen atom. cas:2018-66-8|kegg.compound:C04335 Graph Carbobenzoxy-L-leucine|Carbobenzyloxy-L-leucine|N(alpha)-Benzyloxycarbonyl-L-leucine|N-((Phenylmethoxy)carbonyl)-L-leucine|N-benzyloxycarbonyl-L-leucine N-benzyloxycarbonyl-L-leucine Carbobenzoxy-L-leucine|Carbobenzyloxy-L-leucine|N(alpha)-Benzyloxycarbonyl-L-leucine|N-((Phenylmethoxy)carbonyl)-L-leucine|N-benzyloxycarbonyl-L-leucine http://purl.obolibrary.org/obo/CHEBI_28282 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28283 biolink:ChemicalEntity capsidiol An eremophilane sesquiterpenoid that is (+)-5-epi-aristolochene bearing additional 1β- and 3α-hydroxy substituents. It is a phytoalexin produced in Nicotiana and Capsicum plant species in response to pathogen attack. agr:IND22792720|agr:IND43633624|agr:IND44026531|agr:IND44039864|agr:IND82057124|beilstein:2331764|cas:37208-05-2|foodb.food:FDB014812|hmdb:HMDB0002352|kegg.compound:C09627|knapsack:C00003108|lipidmaps:LMPR0103250002|metacyc.compound:CPD-4661|pubmed:12009313|pubmed:12135497|pubmed:15497966|pubmed:18066498|pubmed:19420326|pubmed:20822656|pubmed:24178358|pubmed:24367019|pubmed:25203155|pubmed:29929021|pubmed:31294452|pubmed:31864296|pubmed:32694584|pubmed:33124100|pubmed:34395763|pubmed:8316587|pubmed:9816674|wikipedia.en:Capsidiol Graph (1R,3R,4S,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene-1,3-diol|(1R,3R,4S,4aR,6R)-6-isopropenyl-4,4a-dimethyl-1,2,3,4,4a,5,6,7-octahydronaphthalene-1,3-diol|1beta,3alpha,4betaH-eremophila-9,11-diene-1,3-diol|Capsidiol|capsidiol (1R,3R,4S,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene-1,3-diol|1beta,3alpha,4betaH-eremophila-9,11-diene-1,3-diol (1R,3R,4S,4aR,6R)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene-1,3-diol|(1R,3R,4S,4aR,6R)-6-isopropenyl-4,4a-dimethyl-1,2,3,4,4a,5,6,7-octahydronaphthalene-1,3-diol|1beta,3alpha,4betaH-eremophila-9,11-diene-1,3-diol|Capsidiol|capsidiol http://purl.obolibrary.org/obo/CHEBI_28283 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28285 biolink:ChemicalEntity oligomycin A An oligomycin with formula C45H74011. An inhibitor of mitochondrial F1FO ATP synthase that induces apoptosis in a variety of cell types and exhibits antifungal, antitumour, and nematicidal activities, but its clinical application has been limited by poor solubility in water and other biocompatible solvents. cas:579-13-5|kegg.compound:C11311|lincs.smallmolecule:LSM-43230|lincs.smallmolecule:LSM-43272|lincs.smallmolecule:LSM-43347|metacyc.compound:CPD-21956|pdb-ccd:EFO|pubmed:22869738|pubmed:233519|pubmed:24084683|pubmed:25849761|pubmed:28420869|pubmed:29650704|reaxys:5702132 Graph (1R,4E,5'S,6S,6'S,7R,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,28S,29R)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethyl-3',4',5',6'-tetrahydro-3H,9H,13H-spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-pyran]-3,9,13-trione|Oligomycin A|RP-32705 (1R,4E,5'S,6S,6'S,7R,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,28S,29R)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethyl-3',4',5',6'-tetrahydro-3H,9H,13H-spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-pyran]-3,9,13-trione (1R,4E,5'S,6S,6'S,7R,8S,10R,11R,12S,14R,15S,16R,18E,20E,22R,25S,27R,28S,29R)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2R)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethyl-3',4',5',6'-tetrahydro-3H,9H,13H-spiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-pyran]-3,9,13-trione|Oligomycin A|RP-32705 http://purl.obolibrary.org/obo/CHEBI_28285 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28293 biolink:ChemicalEntity (S)-1-aminopropan-2-yl phosphate kegg.compound:C04126 Graph (1S)-2-amino-1-methylethyl dihydrogen phosphate|(2S)-1-aminopropan-2-yl dihydrogen phosphate|(S)-1-Aminopropan-2-yl phosphate|L-1-Aminopropan-2-ol O-phosphate (2S)-1-aminopropan-2-yl dihydrogen phosphate (1S)-2-amino-1-methylethyl dihydrogen phosphate|(2S)-1-aminopropan-2-yl dihydrogen phosphate|(S)-1-Aminopropan-2-yl phosphate|L-1-Aminopropan-2-ol O-phosphate http://purl.obolibrary.org/obo/CHEBI_28293 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28295 biolink:ChemicalEntity 2-deoxystreptamine An amino cyclitol consisting of scyllo-inositol with the hydroxy groups at positions 1 and 3 replaced by unsubstituted amino groups and that at position 2 replaced by hydrogen. cas:2037-48-1|kegg.compound:C02627|metacyc.compound:CPD-10151|pdb-ccd:CYY|pubmed:23108876|pubmed:24440302|reaxys:2802188 Graph (1R,2r,3S,4R,6S)-4,6-diaminocyclohexane-1,2,3-triol|2-Deoxystreptamine|2-Desoxystreptamine|4,6-diamino-1,2,3-cyclohexanetriol|Deoxystreptamine (1R,2r,3S,4R,6S)-4,6-diaminocyclohexane-1,2,3-triol (1R,2r,3S,4R,6S)-4,6-diaminocyclohexane-1,2,3-triol|2-Deoxystreptamine|2-Desoxystreptamine|4,6-diamino-1,2,3-cyclohexanetriol|Deoxystreptamine http://purl.obolibrary.org/obo/CHEBI_28295 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28297 biolink:ChemicalEntity hydantoin-5-propionic acid A imidazolidine-2,4-dione that is hydantoin substituted by a 2-carboxyethyl group at position 4. cas:5624-26-0|hmdb:HMDB0001212|kegg.compound:C05565|pubmed:13960896|pubmed:3760095|pubmed:5835442|reaxys:83925 Graph 3-(2,5-dioxoimidazolidin-4-yl)propanoic acid 3-(2,5-dioxoimidazolidin-4-yl)propanoic acid 3-(2,5-dioxoimidazolidin-4-yl)propanoic acid http://purl.obolibrary.org/obo/CHEBI_28297 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28299 biolink:ChemicalEntity quercetin 3-O-beta-D-glucofuranoside A quercetin O-glucoside in which a glucofuranosyl residue is attached at position 3 of quercetin via a β-glycosidic linkage. cas:21637-25-2|kegg.compound:C05623|reaxys:1444784 Graph 2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl beta-D-glucofuranoside|3,3',4',5,7-Pentahydroxyflavone 3-beta-D-glucofuranoside|Isoquercitrin|Isoquercitroside|Isotrifoliin|Quercetin 3-O-glucoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl beta-D-glucofuranoside 2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one|2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl beta-D-glucofuranoside|3,3',4',5,7-Pentahydroxyflavone 3-beta-D-glucofuranoside|Isoquercitrin|Isoquercitroside|Isotrifoliin|Quercetin 3-O-glucoside http://purl.obolibrary.org/obo/CHEBI_28299 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28300 biolink:ChemicalEntity glutamine An α-amino acid that consists of butyric acid bearing an amino substituent at position 2 and a carbamoyl substituent at position 4. cas:585-21-7|cas:6899-04-3|gmelin:27318|kegg.compound:C00303|knapsack:C00001359|reaxys:1723795|wikipedia.en:Glutamine Graph 2,5-diamino-5-oxopentanoic acid|2-Aminoglutaramic acid|2-amino-4-carbamoylbutanoic acid|Glutamin|Glutamine|Glutaminsaeure-5-amid|Hgln|glutamic acid gamma-amide|glutamine Glutamine|glutamine 2,5-diamino-5-oxopentanoic acid|2-Aminoglutaramic acid|2-amino-4-carbamoylbutanoic acid|Glutamin|Glutamine|Glutaminsaeure-5-amid|Hgln|glutamic acid gamma-amide|glutamine http://purl.obolibrary.org/obo/CHEBI_28300 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28302 biolink:ChemicalEntity glucuronoarabinoxylan Graph Glucuronoarabinoxylan|glucuronoarabinoxylan Glucuronoarabinoxylan|glucuronoarabinoxylan http://purl.obolibrary.org/obo/CHEBI_28302 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:28304 biolink:ChemicalEntity heparin A highly sulfated linear glycosaminoglycan comprising complex patterns of uronic acid-(1→4)-D-glucosamine repeating subunits. Used as an injectable anticoagulant, it has the highest negative charge density of any known biological molecule. cas:9005-49-6|drugbank:DB01109|kegg.compound:C00374|kegg.drug:D07510|pubmed:16860191|pubmed:18809206|pubmed:8713797|wikipedia.en:Heparin Graph Bemiparin|Certoparin|Cy 222|Enoxaparin|Fluxum|Heparin|Heparinic acid|Parnaparin|Reviparin|Sandoparin|heparin|heparina|heparine|heparinum Bemiparin|Certoparin|Cy 222|Enoxaparin|Fluxum|Heparin|Heparinic acid|Parnaparin|Reviparin|Sandoparin|heparin|heparina|heparine|heparinum http://purl.obolibrary.org/obo/CHEBI_28304 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28306 biolink:ChemicalEntity semicarbazide A monocarboxylic acid amide that is urea where one of the amino groups has been replaced with hydrazine. cas:57-56-7|gmelin:100758|kegg.compound:C02077|metacyc.compound:SEMICARBAZIDE|pubmed:11958526|pubmed:17499072|pubmed:23194563|pubmed:23683401|reaxys:506319|wikipedia.en:Semicarbazide Graph Aminoharnstoff|Aminourea|Carbamidsaeurehydrazid|Carbamoylhydrazine|Hydrazinecarboxamide|Semicarbazide|Semikarbazid|carbamylhydrazine|carbazamide|hydrazinecarboxamide Hydrazinecarboxamide|hydrazinecarboxamide Aminoharnstoff|Aminourea|Carbamidsaeurehydrazid|Carbamoylhydrazine|Hydrazinecarboxamide|Semicarbazide|Semikarbazid|carbamylhydrazine|carbazamide|hydrazinecarboxamide http://purl.obolibrary.org/obo/CHEBI_28306 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28307 biolink:ChemicalEntity precorrin-3A The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which three methyl groups have been introduced at positions 2, 7 and 20 of the tetrapyrrole framework. beilstein:7070339|kegg.compound:C05772 Graph 3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid|Precorrin 3A 3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid 3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid|Precorrin 3A http://purl.obolibrary.org/obo/CHEBI_28307 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28310 biolink:ChemicalEntity 1D-3-O-methyl-myo-inositol A member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1S,2R,3R,4S,5S,6R-isomer). kegg.compound:C03660|pubmed:17190443|reaxys:2043790 Graph (1S,2R,3R,4S,5S,6R)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-3-O-Methyl-myo-inositol|1D-3-O-methyl-myo-inositol|3-O-Methyl-myo-inositol 1D-3-O-Methyl-myo-inositol|1D-3-O-methyl-myo-inositol (1S,2R,3R,4S,5S,6R)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-3-O-Methyl-myo-inositol|1D-3-O-methyl-myo-inositol|3-O-Methyl-myo-inositol http://purl.obolibrary.org/obo/CHEBI_28310 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28311 biolink:ChemicalEntity indol-3-ylacetaldehyde oxime An aldoxime resulting from the formal condensation of the aldehyde moiety of indol-3-ylacetaldehyde with hydroxylamine. agr:IND608026231|cas:2776-06-9|knapsack:C00000110|pubmed:35631729|pubmed:37105378|pubmed:37233670|pubmed:37366635|pubmed:37547917|pubmed:38089848|pubmed:38102832|reaxys:1528281 Graph 1H-indol-3-ylacetaldehyde oxime|IAOx|Indole-3-acetaldoxime|N-[2-(1H-indol-3-yl)ethylidene]hydroxylamine|indol-3-ylacetaldoxime|indole-3-acetaldehyde oxime N-[2-(1H-indol-3-yl)ethylidene]hydroxylamine 1H-indol-3-ylacetaldehyde oxime|IAOx|Indole-3-acetaldoxime|N-[2-(1H-indol-3-yl)ethylidene]hydroxylamine|indol-3-ylacetaldoxime|indole-3-acetaldehyde oxime http://purl.obolibrary.org/obo/CHEBI_28311 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28312 biolink:ChemicalEntity chlorhexidine gluconate beilstein:4348068|cas:18472-51-0|kegg.drug:D00858 Graph 1,1'-hexamethylene bis(5-(p-chlorophenyl)biguanide), digluconate|Hibiclens|N',N'''''-hexane-1,6-diylbis[N-(4-chlorophenyl)(imidodicarbonimidic diamide)]--D-gluconic acid (1/2)|Peridex|chlorhexidine D-digluconate|chlorhexidine di-D-gluconate|chlorhexidine digluconate|chlorhexidine gluconate N',N'''''-hexane-1,6-diylbis[N-(4-chlorophenyl)(imidodicarbonimidic diamide)]--D-gluconic acid (1/2) 1,1'-hexamethylene bis(5-(p-chlorophenyl)biguanide), digluconate|Hibiclens|N',N'''''-hexane-1,6-diylbis[N-(4-chlorophenyl)(imidodicarbonimidic diamide)]--D-gluconic acid (1/2)|Peridex|chlorhexidine D-digluconate|chlorhexidine di-D-gluconate|chlorhexidine digluconate|chlorhexidine gluconate http://purl.obolibrary.org/obo/CHEBI_28312 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28315 biolink:ChemicalEntity alloxanthine A pyrazolopyrimidine that is 4,5,6,7-tetrahydro-H-pyrazolo[3,4-d]pyrimidine substituted by oxo groups at positions 4 and 6. bpdb:2154|cas:2465-59-0|hmdb:HMDB0000786|kegg.compound:C07599|kegg.drug:D02365|pubmed:18484017|pubmed:23751350|pubmed:24184830|pubmed:24591375|reaxys:139956|wikipedia.en:Oxypurinol Graph 1H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione|Alloxanthine|Oxipurinol|Oxoallopurinol|Oxypurinol 1H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione 1H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione|Alloxanthine|Oxipurinol|Oxoallopurinol|Oxypurinol http://purl.obolibrary.org/obo/CHEBI_28315 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28317 biolink:ChemicalEntity 3-aminobutyryl-CoA An aminobutanoyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-aminobutanoic acid. kegg.compound:C05117|pubmed:17166837|pubmed:7410315 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Aminobutanoyl-CoA|3-aminobutanoyl-coenzyme A|3-aminobutyryl-CoA|3-aminobutyryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-aminobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Aminobutanoyl-CoA|3-aminobutanoyl-coenzyme A|3-aminobutyryl-CoA|3-aminobutyryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28317 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28319 biolink:ChemicalEntity L-fucopyranose 1-phosphate beilstein:4255068|kegg.compound:C02985 Graph 6-Deoxy-L-galactose 1-phosphate|6-deoxy-1-O-phosphono-L-galactopyranose|6-deoxy-L-galactopyranose 1-(dihydrogen phosphate)|L-Fucose 1-phosphate|L-fucopyranose 1-(dihydrogen phosphate) 6-deoxy-L-galactopyranose 1-(dihydrogen phosphate)|L-fucopyranose 1-(dihydrogen phosphate) 6-Deoxy-L-galactose 1-phosphate|6-deoxy-1-O-phosphono-L-galactopyranose|6-deoxy-L-galactopyranose 1-(dihydrogen phosphate)|L-Fucose 1-phosphate|L-fucopyranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28319 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28324 biolink:ChemicalEntity 11-deoxycortisol A deoxycortisol that is cortisol in which the hydroxy group at position 11 has been replaced by a hydrogen. cas:152-58-9|hmdb:HMDB0000015|kegg.compound:C05488|kegg.drug:D03595|lipidmaps:LMST02030086|pubmed:18958601|pubmed:24863084|reaxys:2511358|wikipedia.en:Cortexolone Graph 11-Deoxycortisol|11-deoxycortisol|11-desoxy-17-hydroxycorticosterone|17,21-dihydroxypregn-4-ene-3,20-dione|Cortodoxone|cortodoxone 17,21-dihydroxypregn-4-ene-3,20-dione 11-Deoxycortisol|11-deoxycortisol|11-desoxy-17-hydroxycorticosterone|17,21-dihydroxypregn-4-ene-3,20-dione|Cortodoxone|cortodoxone http://purl.obolibrary.org/obo/CHEBI_28324 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28325 biolink:ChemicalEntity (S)-3-hydroxydecanoyl-CoA A 3-hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 3-hydroxydecanoic acid. cas:79171-49-6|hmdb:HMDB0003938|kegg.compound:C05264|metacyc.compound:CPD0-2244|pubmed:15513944|pubmed:19925642|pubmed:2760034 Graph (S)-3-Hydroxydecanoyl-CoA|(S)-3-hydroxydecanoyl-coenzyme A|(S)-Hydroxydecanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxydecanoyl-coenzyme A|3-OH 10:0-CoA|3-OH C10:0-CoA|S-(3-hydroxydecanoyl)coenzyme A|beta-hydroxydecanoyl coenzyme A|beta-hydroxydecanoyl-CoA|coenzyme A S-3-hydroxydecanoate 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxydecanoyl-CoA|(S)-3-hydroxydecanoyl-coenzyme A|(S)-Hydroxydecanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3-Hydroxydecanoyl-coenzyme A|3-OH 10:0-CoA|3-OH C10:0-CoA|S-(3-hydroxydecanoyl)coenzyme A|beta-hydroxydecanoyl coenzyme A|beta-hydroxydecanoyl-CoA|coenzyme A S-3-hydroxydecanoate http://purl.obolibrary.org/obo/CHEBI_28325 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28328 biolink:ChemicalEntity D-galactosamine The D-stereoisomer of galactosamine. pubmed:16530410|pubmed:19067146|pubmed:6196640|wikipedia.en:Galactosamine Graph http://purl.obolibrary.org/obo/CHEBI_28328 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28329 biolink:ChemicalEntity trioxsalen 7H-Furo[3,2-g]chromen-7-one in which positions 2, 5, and 9 are substituted by methyl groups. Like other psoralens, trioxsalen causes photosensitization of the skin. It is administered orally in conjunction with UV-A for phototherapy treatment of vitiligo. After photoactivation it creates interstrand cross-links in DNA, inhibiting DNA synthesis and cell division, and can lead to cell injury; recovery from the cell injury may be followed by increased melanisation of the epidermis. beilstein:221723|cas:3902-71-4|drugbank:DB04571|drugcentral:2759|kegg.compound:C09314|kegg.drug:D01034|knapsack:C00002502|lincs.smallmolecule:LSM-3223|patent:US3201421|wikipedia.en:Trioxsalen Graph 2',4,8-Trimethylpsoralen|2,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one|4,5',8-Trimethylpsoralen|4,8,5'-Trimethylpsoralen|6-hydroxy-beta,2,7-trimethyl-5-benzofuranacrylic acid, delta-lactone|Trimethylpsoralen|Trioxsalen|Trioxysalen|trioxisaleno|trioxysalen|trioxysalene|trioxysalenum 2,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one 2',4,8-Trimethylpsoralen|2,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one|4,5',8-Trimethylpsoralen|4,8,5'-Trimethylpsoralen|6-hydroxy-beta,2,7-trimethyl-5-benzofuranacrylic acid, delta-lactone|Trimethylpsoralen|Trioxsalen|Trioxysalen|trioxisaleno|trioxysalen|trioxysalene|trioxysalenum http://purl.obolibrary.org/obo/CHEBI_28329 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28330 biolink:ChemicalEntity 4-hydroxy-L-threonine A hydroxy-amino acid consisting of L-threonine having a hydroxy substituent at the 4-position. beilstein:1722829|cas:21768-45-6|kegg.compound:C06056|pdb-ccd:TH6|reaxys:1722829 Graph (2S,3S)-2-amino-3,4-dihydroxybutanoic acid|4-Hydroxy-L-threonine|4-hydroxy-L-threonine|hydroxythreonine (2S,3S)-2-amino-3,4-dihydroxybutanoic acid|4-Hydroxy-L-threonine|4-hydroxy-L-threonine (2S,3S)-2-amino-3,4-dihydroxybutanoic acid|4-Hydroxy-L-threonine|4-hydroxy-L-threonine|hydroxythreonine http://purl.obolibrary.org/obo/CHEBI_28330 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28340 biolink:ChemicalEntity L-2-aminobutyrate beilstein:4958536|gmelin:958982|kegg.compound:C02356 Graph (2S)-2-aminobutanoate|(S)-2-Aminobutanoate (2S)-2-aminobutanoate (2S)-2-aminobutanoate|(S)-2-Aminobutanoate http://purl.obolibrary.org/obo/CHEBI_28340 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28349 biolink:ChemicalEntity alpha-L-fucoside kegg.compound:C02475 Graph alpha-L-Fucoside|alpha-L-fucosides|an alpha-L-fucoside alpha-L-Fucoside|alpha-L-fucosides|an alpha-L-fucoside http://purl.obolibrary.org/obo/CHEBI_28349 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28354 biolink:ChemicalEntity 1-deoxy-D-xylulose kegg.compound:C06257|knapsack:C00018095 Graph 1-Deoxy-D-xylulose|1-deoxy-D-threo-pent-2-ulose|1-deoxy-D-xylulose 1-Deoxy-D-xylulose|1-deoxy-D-threo-pent-2-ulose|1-deoxy-D-xylulose 1-Deoxy-D-xylulose|1-deoxy-D-threo-pent-2-ulose|1-deoxy-D-xylulose http://purl.obolibrary.org/obo/CHEBI_28354 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28355 biolink:ChemicalEntity adenosine 2',5'-bisphosphate cas:3805-37-6|kegg.compound:C03850 Graph Adenosine 2',5'-bisphosphate|adenosine 2',5'-bisphosphate Adenosine 2',5'-bisphosphate|adenosine 2',5'-bisphosphate http://purl.obolibrary.org/obo/CHEBI_28355 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:28358 biolink:ChemicalEntity rac-lactic acid A racemate comprising equimolar amounts of (R)- and (S)-lactic acid. cas:50-21-5|drugbank:DB04398|kegg.compound:C01432|kegg.drug:D00111|lipidmaps:LMFA01050002|pubmed:17190852|pubmed:29079364|pubmed:40279267|reaxys:1209341|wikipedia.en:Lactic_acid Graph (+-)-2-hydroxypropanoic acid|2-Hydroxypropanoic acid|2-Hydroxypropionic acid|E270|Lactic acid|Milchsaeure|alpha-hydroxypropanoic acid|alpha-hydroxypropionic acid|rac-2-hydroxypropanoic acid 2-Hydroxypropanoic acid|rac-2-hydroxypropanoic acid (+-)-2-hydroxypropanoic acid|2-Hydroxypropanoic acid|2-Hydroxypropionic acid|E270|Lactic acid|Milchsaeure|alpha-hydroxypropanoic acid|alpha-hydroxypropionic acid|rac-2-hydroxypropanoic acid http://purl.obolibrary.org/obo/CHEBI_28358 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28364 biolink:ChemicalEntity all-cis-5,8,11,14,17-icosapentaenoic acid An icosapentaenoic acid having five cis-double bonds at positions 5, 8, 11, 14 and 17. cas:10417-94-4|drugbank:DB00159|drugcentral:3174|hmdb:HMDB0001999|kegg.compound:C06428|kegg.drug:D08061|knapsack:C00000408|knapsack:C00001215|lipidmaps:LMFA01030759|metacyc.compound:EICOSAPENTAENOATE|pdb-ccd:EPA|pubmed:12549599|pubmed:18638380|pubmed:19054597|pubmed:21118482|pubmed:21274596|pubmed:23920312|pubmed:24108131|pubmed:24238887|pubmed:24387137|pubmed:24389665|pubmed:9668087|reaxys:1714433 Graph (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-eicosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-Eicosapentaenoate|(5Z,8Z,11Z,14Z,17Z)-Eicosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-Icosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid|(all-Z)-5,8,11,14,17-eicosapentaenoic acid|5,8,11,14,17-EICOSAPENTAENOIC ACID|5,8,11,14,17-Icosapentaenoic acid|EPA|Eicosapentaenoic acid|Icosapentaenoic acid|Timnodonic acid|all-cis-5,8,11,14,17-eicosapentaenoic acid|all-cis-icosa-5,8,11,14,17-pentaenoic acid|cis, cis, cis, cis, cis-eicosa-5,8,11,14,17-pentaenoic acid|cis-5,8,11,14,17-EPA|cis-5,8,11,14,17-eicosapentaenoic acid|cis-Delta(5,8,11,14,17)-eicosapentaenoic acid|icosapent|icosapento|icosapentum (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-eicosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-Eicosapentaenoate|(5Z,8Z,11Z,14Z,17Z)-Eicosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-Icosapentaenoic acid|(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid|(all-Z)-5,8,11,14,17-eicosapentaenoic acid|5,8,11,14,17-EICOSAPENTAENOIC ACID|5,8,11,14,17-Icosapentaenoic acid|EPA|Eicosapentaenoic acid|Icosapentaenoic acid|Timnodonic acid|all-cis-5,8,11,14,17-eicosapentaenoic acid|all-cis-icosa-5,8,11,14,17-pentaenoic acid|cis, cis, cis, cis, cis-eicosa-5,8,11,14,17-pentaenoic acid|cis-5,8,11,14,17-EPA|cis-5,8,11,14,17-eicosapentaenoic acid|cis-Delta(5,8,11,14,17)-eicosapentaenoic acid|icosapent|icosapento|icosapentum http://purl.obolibrary.org/obo/CHEBI_28364 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28368 biolink:ChemicalEntity novobiocin A coumarin-derived antibiotic obtained from Streptomyces niveus. cas:303-81-1|drugbank:DB01051|drugcentral:1974|hmdb:HMDB0015185|kegg.compound:C05080|knapsack:C00002487|lincs.smallmolecule:LSM-5910|patent:WO2012049521|patent:WO2012103487|pdb-ccd:NOV|pubmed:17132020|pubmed:18418407|pubmed:19282394|pubmed:19762445|pubmed:20325309|pubmed:21388139|pubmed:22897434|pubmed:26844397|pubmed:26926630|pubmed:27829510|pubmed:27914946|pubmed:28246042|pubmed:28316592|pubmed:9687383|reaxys:1445842 Graph N-{7-[(3-O-carbamoyl-6-deoxy-5-methyl-4-O-methyl-beta-D-gulopyranosyl)oxy]-4-hydroxy-8-methyl-2-oxo-2H-chromen-3-yl}-4-hydroxy-3-(3-methylbut-2-en-1-yl)benzamide|Novobiocin|novobiocina|novobiocine|novobiocinum N-{7-[(3-O-carbamoyl-6-deoxy-5-methyl-4-O-methyl-beta-D-gulopyranosyl)oxy]-4-hydroxy-8-methyl-2-oxo-2H-chromen-3-yl}-4-hydroxy-3-(3-methylbut-2-en-1-yl)benzamide|Novobiocin|novobiocina|novobiocine|novobiocinum http://purl.obolibrary.org/obo/CHEBI_28368 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28379 biolink:ChemicalEntity (R)-3-methyl-2-oxovaleric acid The (R)-enantiomer of 3-methyl-2-oxovaleric acid. beilstein:1722135|kegg.compound:C06008|lipidmaps:LMFA01020280|pubmed:1638756 Graph (3R)-2-oxo-3-methyl-n-valeric acid|(3R)-2-oxoisoleucine|(3R)-3-Methyl-2-oxopentanoic acid|(3R)-3-methyl-2-oxopentanoic acid|(R)-2-Oxo-3-methylpentanoate|(R)-2-Oxo-3-methylpentanoic acid|(R)-OMV|alpha-oxo-beta-methyl-n-valeric acid|alpha-oxo-beta-methylvaleric acid (3R)-3-Methyl-2-oxopentanoic acid|(3R)-3-methyl-2-oxopentanoic acid (3R)-2-oxo-3-methyl-n-valeric acid|(3R)-2-oxoisoleucine|(3R)-3-Methyl-2-oxopentanoic acid|(3R)-3-methyl-2-oxopentanoic acid|(R)-2-Oxo-3-methylpentanoate|(R)-2-Oxo-3-methylpentanoic acid|(R)-OMV|alpha-oxo-beta-methyl-n-valeric acid|alpha-oxo-beta-methylvaleric acid http://purl.obolibrary.org/obo/CHEBI_28379 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28383 biolink:ChemicalEntity alpha,omega-dicarboxylic acid kegg.compound:C04025 Graph alpha(omega)-Dicarboxylic acid|alpha,omega-Dicarboxylic acid|alpha,omega-dicarboxylic acids alpha(omega)-Dicarboxylic acid|alpha,omega-Dicarboxylic acid|alpha,omega-dicarboxylic acids http://purl.obolibrary.org/obo/CHEBI_28383 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28384 biolink:ChemicalEntity vitamin K Any member of a group of fat-soluble 2-methyl-1,4-napthoquinones that exhibit biological activity against vitamin K deficiency. Vitamin K is required for the synthesis of prothrombin and certain other blood coagulation factors. cas:12001-79-5|kegg.compound:C01628|metacyc.compound:CPD-11501|pubmed:26413183|pubmed:33255760|pubmed:34109217|wikipedia.en:Vitamin_K Graph Vitamin K|vitamin K vitamer|vitamin K vitamers|vitamine K|vitamins K Vitamin K|vitamin K vitamer|vitamin K vitamers|vitamine K|vitamins K http://purl.obolibrary.org/obo/CHEBI_28384 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28386 biolink:ChemicalEntity 4-hydroxycinnamyl alcohol A primary alcohol being cinnamyl alcohol hydroxylated at C-4 of the phenyl ring. cas:3690-05-9|kegg.compound:C02646|knapsack:C00000613|pubmed:21240761|pubmed:24575890|reaxys:1930679 Graph 4-(3-hydroxyprop-1-en-1-yl)phenol|4-Coumaryl alcohol|4-Hydroxycinnamyl alcohol|p-Coumaryl alcohol 4-(3-hydroxyprop-1-en-1-yl)phenol 4-(3-hydroxyprop-1-en-1-yl)phenol|4-Coumaryl alcohol|4-Hydroxycinnamyl alcohol|p-Coumaryl alcohol http://purl.obolibrary.org/obo/CHEBI_28386 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28387 biolink:ChemicalEntity (2-trans,6-cis)-dodeca-2,6-dienoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (2-trans,6-cis)-dodeca-2,6-dienoic acid. kegg.compound:C05279 Graph (2-trans,6-cis)-dodeca-2,6-dienoyl-coenzyme A|(2t,6c)-dodecadienoyl-coenzyme A|(2t,6c)-lauro-2,6-dienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,6Z)-dodeca-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|trans,cis-2,6-laurodienoyl-coenzyme A|trans,cis-Lauro-2,6-dienoyl-CoA|trans,cis-lauro-2,6-dienoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,6Z)-dodeca-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (2-trans,6-cis)-dodeca-2,6-dienoyl-coenzyme A|(2t,6c)-dodecadienoyl-coenzyme A|(2t,6c)-lauro-2,6-dienoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E,6Z)-dodeca-2,6-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|trans,cis-2,6-laurodienoyl-coenzyme A|trans,cis-Lauro-2,6-dienoyl-CoA|trans,cis-lauro-2,6-dienoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28387 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28390 biolink:ChemicalEntity (R)-1-aminopropan-2-yl phosphate kegg.compound:C04122 Graph (1R)-2-amino-1-methylethyl dihydrogen phosphate|(2R)-1-aminopropan-2-yl dihydrogen phosphate|(R)-1-Aminopropan-2-yl phosphate|D-1-Aminopropan-2-ol O-phosphate (2R)-1-aminopropan-2-yl dihydrogen phosphate (1R)-2-amino-1-methylethyl dihydrogen phosphate|(2R)-1-aminopropan-2-yl dihydrogen phosphate|(R)-1-Aminopropan-2-yl phosphate|D-1-Aminopropan-2-ol O-phosphate http://purl.obolibrary.org/obo/CHEBI_28390 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28393 biolink:ChemicalEntity beta-D-glucosamine A 2-amino-2-deoxy-D-glucopyranose that is D-glucosamine having a β-configuration at the anomeric position. cas:14257-69-3|cas:3416-24-8|glygen:G19577LJ|glytoucan:G19577LJ|gmelin:720725|hmdb:HMDB0030091|kegg.compound:C08349|knapsack:C00001121|metacyc.compound:CPD-12539|pdb-ccd:GCS|pubmed:23817094|pubmed:24455869|reaxys:1723616 Graph 2-amino-2-deoxy-beta-D-glucopyranose|D-GLUCOSAMINE|beta-D-Glucosamine|beta-D-glucosamine 2-amino-2-deoxy-beta-D-glucopyranose|D-GLUCOSAMINE 2-amino-2-deoxy-beta-D-glucopyranose|D-GLUCOSAMINE|beta-D-Glucosamine|beta-D-glucosamine http://purl.obolibrary.org/obo/CHEBI_28393 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28394 biolink:ChemicalEntity enol-oxaloacetic acid A dicarboxylic acid that is butenedioic acid in which the hydrogen at the 2-position is substituted by a hydroxy group. kegg.compound:C03981|lipidmaps:LMFA01170061|pdb-ccd:Y3P|reaxys:3661871 Graph (2Z)-2-hydroxybut-2-enedioic acid|2-Hydroxybut-2-enedioic acid|enol-Oxaloacetic acid|hydroxyfumaric acid (2Z)-2-hydroxybut-2-enedioic acid (2Z)-2-hydroxybut-2-enedioic acid|2-Hydroxybut-2-enedioic acid|enol-Oxaloacetic acid|hydroxyfumaric acid http://purl.obolibrary.org/obo/CHEBI_28394 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28395 biolink:ChemicalEntity (+-)-trans-acenaphthene-1,2-diol beilstein:2617350|beilstein:2617351|cas:2963-87-3|kegg.compound:C04167 Graph (+-)-trans-acenaphthene-1,2-diol|(+/-)-trans-Acenaphthene-1,2-diol|(+/-)-trans-acenaphthene-1,2-diol|rel-(1R,2R)-1,2-dihydroacenaphthylene-1,2-diol|trans-1,2-dihydro-1,2-acenaphthylenediol rel-(1R,2R)-1,2-dihydroacenaphthylene-1,2-diol (+-)-trans-acenaphthene-1,2-diol|(+/-)-trans-Acenaphthene-1,2-diol|(+/-)-trans-acenaphthene-1,2-diol|rel-(1R,2R)-1,2-dihydroacenaphthylene-1,2-diol|trans-1,2-dihydro-1,2-acenaphthylenediol http://purl.obolibrary.org/obo/CHEBI_28395 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28396 biolink:ChemicalEntity 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-diacyl-sn-glycerol A digalactosylglycerol derivative in which the digalactosyl moiety is α-D-galactosyl-(1→6)-β-D-galactosyl at O-3, with O-1 and O-2 both acylated. kegg.compound:C06037|lipidmaps:LMGL0501AD00 Graph 2,3-Di-O-acyl-1-O-(6-O-alpha-D-galactosyl-beta-D-galactosyl)-D-glycerol|3-[alpha-D-Galactosyl-(1->6)-beta-D-galactosyl]-1,2-diacyl-sn-glycerol|DGDG|Digalactosyl-diacylglycerol|a 1,2-diacyl-3-O-(alpha-D-galactosyl-(1->6)-beta-D-galactosyl)-sn-glycerol 2,3-Di-O-acyl-1-O-(6-O-alpha-D-galactosyl-beta-D-galactosyl)-D-glycerol|3-[alpha-D-Galactosyl-(1->6)-beta-D-galactosyl]-1,2-diacyl-sn-glycerol|DGDG|Digalactosyl-diacylglycerol|a 1,2-diacyl-3-O-(alpha-D-galactosyl-(1->6)-beta-D-galactosyl)-sn-glycerol http://purl.obolibrary.org/obo/CHEBI_28396 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28397 biolink:ChemicalEntity cis-4-hydroxy-L-proline L-Proline in which a hydrogen at the 4-position of the pyrrolidine ring is substituted by a hydroxy group (S-configuration). cas:618-27-9|kegg.compound:C01015|pdb-ccd:HZP|pubmed:22770225|reaxys:81440 Graph (2S,4S)-4-hydroxy-2-pyrrolidinecarboxylic acid|(4S)-4-hydroxy-L-proline|4-cis-L-hydroxyproline|L-allo-hydroxyproline|L-cis-4-hydroxyproline|allo-4-hydroxy-L-proline|cis-4-Hydroxy-L-proline (4S)-4-hydroxy-L-proline (2S,4S)-4-hydroxy-2-pyrrolidinecarboxylic acid|(4S)-4-hydroxy-L-proline|4-cis-L-hydroxyproline|L-allo-hydroxyproline|L-cis-4-hydroxyproline|allo-4-hydroxy-L-proline|cis-4-Hydroxy-L-proline http://purl.obolibrary.org/obo/CHEBI_28397 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28398 biolink:ChemicalEntity butan-2-one A dialkyl ketone that is a four-carbon ketone carrying a single keto- group at position C-2. cas:78-93-3|gmelin:25656|hmdb:HMDB0000474|kegg.compound:C02845|lipidmaps:LMFA12000043|metacyc.compound:MEK|pubmed:20403429|pubmed:23050457|reaxys:741880|umbbd.compound:c0020|wikipedia.en:Butanone Graph 2-Butanon|2-Butanone|3-butanone|Aethylmethylketon|C2H5COCH3|Ethyl methyl ketone|Ethylmethylketon|MEK|Methyl ethyl ketone|Methylethylketon|butan-2-one|butanone|butanone 2|ethyl methyl cetone|ethyl(methyl) ketone|ethylmethyl ketone|meetco|methyl acetone|methyl ethyl cetone|methyl(ethyl) ketone|methylacetone|methylethyl ketone|oxobutane butan-2-one 2-Butanon|2-Butanone|3-butanone|Aethylmethylketon|C2H5COCH3|Ethyl methyl ketone|Ethylmethylketon|MEK|Methyl ethyl ketone|Methylethylketon|butan-2-one|butanone|butanone 2|ethyl methyl cetone|ethyl(methyl) ketone|ethylmethyl ketone|meetco|methyl acetone|methyl ethyl cetone|methyl(ethyl) ketone|methylacetone|methylethyl ketone|oxobutane http://purl.obolibrary.org/obo/CHEBI_28398 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28401 biolink:ChemicalEntity N-acetyl-D-glucosaminide kegg.compound:C03518 Graph N-Acetyl-D-glucosaminide|N-acetyl-D-glucosaminides N-Acetyl-D-glucosaminide|N-acetyl-D-glucosaminides http://purl.obolibrary.org/obo/CHEBI_28401 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28411 biolink:ChemicalEntity allicin beilstein:1752823|cas:539-86-6|kegg.compound:C07600|knapsack:C00001242 Graph 2-Propene-1-sulfinothioic acid S-2-propenyl ester|Allicin|S-allyl prop-2-ene-1-sulfinothioate|thio-2-propene-1-sulfinic acid S-allyl ester S-allyl prop-2-ene-1-sulfinothioate 2-Propene-1-sulfinothioic acid S-2-propenyl ester|Allicin|S-allyl prop-2-ene-1-sulfinothioate|thio-2-propene-1-sulfinic acid S-allyl ester http://purl.obolibrary.org/obo/CHEBI_28411 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28412 biolink:ChemicalEntity eriodictyol A tetrahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3' and 4' respectively. beilstein:92358|cas:552-58-9|kegg.compound:C05631|knapsack:C00000960|lipidmaps:LMPK12140002|lipidmaps:LMPK12140432 Graph (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|(S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-4-benzopyrone|(S)-eriodictyol|Eriodictiol|Eriodictyol (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one|(S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-4-benzopyrone|(S)-eriodictyol|Eriodictiol|Eriodictyol http://purl.obolibrary.org/obo/CHEBI_28412 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28413 biolink:ChemicalEntity 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylic acid kegg.compound:C04751|pdb-ccd:C2R Graph 1-(5'-Phosphoribosyl)-4-carboxy-5-aminoimidazole|1-(5'-Phosphoribosyl)-5-amino-4-carboxyimidazole|1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxylate|1-(5-Phospho-D-ribosyl)-5-amino-4-imidazolecarboxylate|5'-Phosphoribosyl-4-carboxy-5-aminoimidazole|5'-Phosphoribosyl-5-amino-4-imidazolecarboxylate|5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylate|5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxylic acid 5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxylic acid 1-(5'-Phosphoribosyl)-4-carboxy-5-aminoimidazole|1-(5'-Phosphoribosyl)-5-amino-4-carboxyimidazole|1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxylate|1-(5-Phospho-D-ribosyl)-5-amino-4-imidazolecarboxylate|5'-Phosphoribosyl-4-carboxy-5-aminoimidazole|5'-Phosphoribosyl-5-amino-4-imidazolecarboxylate|5-Amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylate|5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole-4-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_28413 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28415 biolink:ChemicalEntity hexacosan-1-ol A very long-chain primary fatty alcohol that is hexacosane in which a hydrogen attached to one of the terminal carbons is replaced by a hydroxy group. agr:IND607418673|agr:IND607771787|cas:506-52-5|cba:357361|foodb.food:FDB001482|hmdb:HMDB0243887|kegg.compound:C08381|knapsack:C00001255|lipidmaps:LMFA05000002|pubmed:12916085|pubmed:15814229|pubmed:18000340|pubmed:18404565|pubmed:19731141|pubmed:21485271|pubmed:21823454|pubmed:27916676|pubmed:28344474|pubmed:29886159|pubmed:36228969|pubmed:36518632|pubmed:7768265|reaxys:1783162|wikipedia.en:1-Hexacosanol Graph 1-hexacosanol|1-hydroxyhexacosane|Hexacosan-1-ol|cerotyl alcohol|ceryl alcohol|cerylic alcohol|hexacosan-1-ol|hexacosyl alcohol|n-hexacosanol Hexacosan-1-ol|hexacosan-1-ol 1-hexacosanol|1-hydroxyhexacosane|Hexacosan-1-ol|cerotyl alcohol|ceryl alcohol|cerylic alcohol|hexacosan-1-ol|hexacosyl alcohol|n-hexacosanol http://purl.obolibrary.org/obo/CHEBI_28415 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28416 biolink:ChemicalEntity 5-hydroxyimidazole-4-acetic acid A hydroxyimidazole that is 5-hydroxyimidazole in which the hydrogen at position 4 is replaced by a carboxymethyl group. Graph (5-hydroxy-1H-imidazol-4-yl)acetic acid (5-hydroxy-1H-imidazol-4-yl)acetic acid (5-hydroxy-1H-imidazol-4-yl)acetic acid http://purl.obolibrary.org/obo/CHEBI_28416 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28417 biolink:ChemicalEntity gentamycin C cas:11097-82-8|kegg.compound:C01918 Graph Gentamicin C Gentamicin C http://purl.obolibrary.org/obo/CHEBI_28417 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28422 biolink:ChemicalEntity 3-oxohexanoic acid kegg.compound:C02122|lipidmaps:LMFA01060008 Graph 3-Oxohexanoate|3-Oxohexanoic acid|3-oxohexanoic acid 3-Oxohexanoic acid|3-oxohexanoic acid 3-Oxohexanoate|3-Oxohexanoic acid|3-oxohexanoic acid http://purl.obolibrary.org/obo/CHEBI_28422 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28424 biolink:ChemicalEntity alpha-Neu5NAc-(2->8)-alpha-Neu5NAc-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer A sialodiosylceramide consisting of the tetrasaccharide α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Gal-(1→4)-β-D-Glc attached to the primary hydroxy function of ceramide. kegg.compound:C06133|kegg.glycan:G00113|pubmed:12019315|pubmed:12032669|pubmed:12058281|pubmed:12770783|pubmed:12950986|pubmed:1371229|pubmed:15207324|pubmed:15896784|pubmed:16081368|pubmed:16341241|pubmed:16434401|pubmed:17043769|pubmed:1724444|pubmed:17855742|pubmed:19726417|pubmed:21149694|pubmed:21376640|pubmed:2303428|pubmed:2448252|pubmed:25748038|pubmed:2604027|pubmed:28424|pubmed:3292056|pubmed:3742610|pubmed:6204642|pubmed:6206564|pubmed:6362854|pubmed:7534889|pubmed:7691279|pubmed:7693874|pubmed:8448384 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)2 (Cer)1|(Neu5Ac)GD3|CD60a|GD3|GD3 ganglioside|Ganglioside GD3|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->4Glcbeta1->1Cer|NeuAc(alpha2-8)NeuAc(alpha2-3)Gal(beta1-4)Glc(beta1-1)Cer|NeuAc-alpha2->8NeuAc-alpha2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc2->3LacCer|NeuAc2-GD3|NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta1-1'Cer|alpha-N-Acetylneuraminyl-2,8-alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1,4-beta-glucosyl-1,1'-ceramide|alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide|alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramides|alpha-Neu5NAc-(2->8)-alpha-Neu5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|disialoganglioside GD3 (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)2 (Cer)1|(Neu5Ac)GD3|CD60a|GD3|GD3 ganglioside|Ganglioside GD3|Neu5Acalpha2->8Neu5Acalpha2->3Galbeta1->4Glcbeta1->1Cer|NeuAc(alpha2-8)NeuAc(alpha2-3)Gal(beta1-4)Glc(beta1-1)Cer|NeuAc-alpha2->8NeuAc-alpha2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc2->3LacCer|NeuAc2-GD3|NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta1-1'Cer|alpha-N-Acetylneuraminyl-2,8-alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1,4-beta-glucosyl-1,1'-ceramide|alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide|alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramides|alpha-Neu5NAc-(2->8)-alpha-Neu5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|disialoganglioside GD3 http://purl.obolibrary.org/obo/CHEBI_28424 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28425 biolink:ChemicalEntity alpha-carotene A cyclic carotene with a β- and an ε-ring at opposite ends respectively. beilstein:2067408|beilstein:3227599|cas:432-70-2|hmdb:HMDB0003993|kegg.compound:C05433|knapsack:C00003765|lipidmaps:LMPR01070258|pubmed:23620017|pubmed:24169341|pubmed:9408998|reaxys:2682045 Graph Alpha-carotene|all-trans-alpha-carotene|alpha-Carotene|beta,epsilon-carotene beta,epsilon-carotene Alpha-carotene|all-trans-alpha-carotene|alpha-Carotene|beta,epsilon-carotene http://purl.obolibrary.org/obo/CHEBI_28425 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28426 biolink:ChemicalEntity cyanidin 3-O-beta-D-glucoside An anthocyanin cation that is a cyanidin cation linked to a β-D-glucosyl moiety at position 3. cas:7084-24-4|hmdb:HMDB0030684|kegg.compound:C08604|knapsack:C00002374|lipidmaps:LMPK12010110|reaxys:1695615 Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl beta-D-glucopyranoside|Cyanidin 3-O-beta-D-glucoside|Cyanidin 3-O-glucoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl beta-D-glucopyranoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl beta-D-glucopyranoside|Cyanidin 3-O-beta-D-glucoside|Cyanidin 3-O-glucoside http://purl.obolibrary.org/obo/CHEBI_28426 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28427 biolink:ChemicalEntity arabinoxylan A member of the class of arabinoxylans that consists of a polymer chain of β-(1→4)-linked D-xylopyranose units, many of which are 2- or 3-substituted, or 2,3-disubstituted by α-L-arabinofuranosyl residues. cas:9040-27-1|kegg.compound:C01889|pubmed:16659029|pubmed:21535740|pubmed:21615152 Graph Arabinoxylan Arabinoxylan http://purl.obolibrary.org/obo/CHEBI_28427 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28428 biolink:ChemicalEntity beta-hexachlorocyclohexane The β-isomer of hexachlorocyclohexane. cas:319-85-7|kegg.compound:C06988|pubmed:19760616|pubmed:23866943|pubmed:24183346|pubmed:24361731|pubmed:32525731|pubmed:32675895|pubmed:32906049|reaxys:1907338|umbbd.compound:c0139 Graph (1alpha,2beta,3alpha,4beta,5alpha,6beta)-1,2,3,4,5,6-hexachlorocyclohexane|(1r,2t,3c,4t,5c,6t)-1,2,3,4,5,6-hexachlorocyclohexane|beta-1,2,3,4,5,6-Hexachlorocyclohexane|beta-1,2,3,4,5,6-hexachlorocyclohexane|beta-BHC|beta-HCH|beta-Hexachlorocyclohexane|beta-Lindane|beta-benzene hexachloride|beta-lindane|trans-1,2,3,4,5,6-hexachlorocyclohexane (1r,2t,3c,4t,5c,6t)-1,2,3,4,5,6-hexachlorocyclohexane (1alpha,2beta,3alpha,4beta,5alpha,6beta)-1,2,3,4,5,6-hexachlorocyclohexane|(1r,2t,3c,4t,5c,6t)-1,2,3,4,5,6-hexachlorocyclohexane|beta-1,2,3,4,5,6-Hexachlorocyclohexane|beta-1,2,3,4,5,6-hexachlorocyclohexane|beta-BHC|beta-HCH|beta-Hexachlorocyclohexane|beta-Lindane|beta-benzene hexachloride|beta-lindane|trans-1,2,3,4,5,6-hexachlorocyclohexane http://purl.obolibrary.org/obo/CHEBI_28428 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28429 biolink:ChemicalEntity (+)-dihydromyricetin An optically active form of dihydromyricetin having (2R,3R)-configuration. beilstein:4331256|cas:27200-12-0|kegg.compound:C02906|knapsack:C00000938|metacyc.compound:CPD-7087|pubmed:12889119|pubmed:17059013|pubmed:22693649|reaxys:5303758|wikipedia.en:Dihydromyricetin Graph (+)-Ampelopsin|(+)-Dihydromyricetin|(2R,3R)-2,3-dihydro-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one|(2R,3R)-3,3',4',5,5',7-hexahydroxy-2,3-dihydroflavanonol|(2R,3R)-3,5,7,3',4',5'-hexahydroxyflavanone|(2R,3R)-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2R,3R)-dihydromyricetin|Ampelopsin|Ampeloptin|Dihydromyricetin (2R,3R)-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-4H-chromen-4-one (+)-Ampelopsin|(+)-Dihydromyricetin|(2R,3R)-2,3-dihydro-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one|(2R,3R)-3,3',4',5,5',7-hexahydroxy-2,3-dihydroflavanonol|(2R,3R)-3,5,7,3',4',5'-hexahydroxyflavanone|(2R,3R)-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2R,3R)-dihydromyricetin|Ampelopsin|Ampeloptin|Dihydromyricetin http://purl.obolibrary.org/obo/CHEBI_28429 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28433 biolink:ChemicalEntity phyllohydroquinone beilstein:3168075|cas:572-96-3|kegg.compound:C03313 Graph 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol|Phytonadiol|Vitamin K hydroquinone|Vitamin K1 hydroquinone|phylloquinol|vitamin K1 hydroquinone 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol 2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol|Phytonadiol|Vitamin K hydroquinone|Vitamin K1 hydroquinone|phylloquinol|vitamin K1 hydroquinone http://purl.obolibrary.org/obo/CHEBI_28433 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28436 biolink:ChemicalEntity delphinidin An anthocyanidin cation consisting of benzopyrylium with hydroxy substituents at the 3-, 5- and 7-positions and a 3,4,5-trihydroxyphenyl group at the 2-position. It is a plant pigment responsible for the colours of the plants of the genera Viola and Delphinium. cas:13270-61-6|kegg.compound:C05908|knapsack:C00020091|lipidmaps:LMPK12010001|pubmed:11906973|pubmed:12871827|pubmed:16902416|pubmed:18948740|pubmed:23129091|reaxys:1691007|wikipedia.en:Delphinidin Graph 3,3',4',5,5',7-Hexahydroxyflavylium|3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium 3,3',4',5,5',7-Hexahydroxyflavylium|3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium http://purl.obolibrary.org/obo/CHEBI_28436 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28442 biolink:ChemicalEntity 15-oxoprostaglandin F2alpha A prostaglandin Fα obtained by formal oxidation of the 15-hydroxy group of prostaglandin F2α. cas:35850-13-6|kegg.compound:C05960|lipidmaps:LMFA03010026|pubmed:11441438|pubmed:3473753|reaxys:2951600 Graph (5Z,13E)-9alpha,11alpha-dihydroxy-15-oxoprosta-5,13-dien-1-oic acid|15-Keto-PGF2a|15-Keto-PGF2alpha|15-Keto-prostaglandin F2a|15-Keto-prostaglandin F2alpha|15-Ketoprostaglandin F2alpha (5Z,13E)-9alpha,11alpha-dihydroxy-15-oxoprosta-5,13-dien-1-oic acid (5Z,13E)-9alpha,11alpha-dihydroxy-15-oxoprosta-5,13-dien-1-oic acid|15-Keto-PGF2a|15-Keto-PGF2alpha|15-Keto-prostaglandin F2a|15-Keto-prostaglandin F2alpha|15-Ketoprostaglandin F2alpha http://purl.obolibrary.org/obo/CHEBI_28442 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28445 biolink:ChemicalEntity vincristine A vinca alkaloid with formula C46H56N4O10 found in the Madagascar periwinkle, Catharanthus roseus. It is used (commonly as the corresponding sulfate salt)as a chemotherapy drug for the treatment of leukaemia, lymphoma, myeloma, breast cancer and head and neck cancer. beilstein:4779289|cas:57-22-7|drugbank:DB00541|drugcentral:2825|hmdb:HMDB0014681|kegg.compound:C07204|kegg.drug:D08679|knapsack:C00001783|metacyc.compound:CPD-19894|pubmed:18520608|pubmed:30277559|pubmed:30429697|pubmed:30599272|pubmed:30604513|pubmed:30657998|pubmed:31048222|pubmed:31161774|pubmed:31214762|pubmed:31296986|wikipedia.en:Vincristine Graph (+)-Vincristine|22-Oxovincaleukoblastine|22-oxo-vincaleukoblastine|22-oxovincaleukoblastine|Vincristine|leucristine|leurocristine|oncovin|vincristin|vinkristin 22-Oxovincaleukoblastine|22-oxovincaleukoblastine (+)-Vincristine|22-Oxovincaleukoblastine|22-oxo-vincaleukoblastine|22-oxovincaleukoblastine|Vincristine|leucristine|leurocristine|oncovin|vincristin|vinkristin http://purl.obolibrary.org/obo/CHEBI_28445 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28446 biolink:ChemicalEntity 3D-3,5/4-trihydroxycyclohexane-1,2-dione beilstein:3199845|cas:949461-91-0|kegg.compound:C04287 Graph (3R,4S,5R)-3,4,5-Trihydroxy-1,2-cyclohexanedione|(3R,4S,5R)-3,4,5-trihydroxycyclohexane-1,2-dione|3,5/4-Trihydroxycyclohexa-1,2-dione|3D-3,5/4-trihydroxycyclohexane-1,2-dione|D-2,3-Diketo-4-deoxy-epi-inositol (3R,4S,5R)-3,4,5-trihydroxycyclohexane-1,2-dione (3R,4S,5R)-3,4,5-Trihydroxy-1,2-cyclohexanedione|(3R,4S,5R)-3,4,5-trihydroxycyclohexane-1,2-dione|3,5/4-Trihydroxycyclohexa-1,2-dione|3D-3,5/4-trihydroxycyclohexane-1,2-dione|D-2,3-Diketo-4-deoxy-epi-inositol http://purl.obolibrary.org/obo/CHEBI_28446 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28450 biolink:ChemicalEntity 3'-phosphoadenylyl selenate An organoselenium compound that is adenylyl selenate with the hydroxy at position 3' replaced by a phosphate group. hmdb:HMDB0011104|kegg.compound:C05696 Graph 3'-Phosphoadenosine-5'-phosphoselanate|3'-Phosphoadenosine-5'-phosphoselenate|3'-Phosphoadenylylselenate|3-Phosphoadenylylselenate|5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) 5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) 3'-Phosphoadenosine-5'-phosphoselanate|3'-Phosphoadenosine-5'-phosphoselenate|3'-Phosphoadenylylselenate|3-Phosphoadenylylselenate|5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine 3'-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28450 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28453 biolink:ChemicalEntity (20S)-20-hydroxypregn-4-en-3-one beilstein:2220567|beilstein:5754299|cas:145-14-2|kegg.compound:C04042 Graph (20S)-20-hydroxypregn-4-en-3-one|(20S)-hydroxypregn-4-en-3-one|(S)-20-Hydroxypregn-4-en-3-one|20alpha-Hydroxy-4-pregnen-3-one|20alpha-Hydroxypregn-4-en-3-one|20alpha-Hydroxyprogesterone|20alpha-dihydroprogesterone|dihydroprogesterone (20S)-20-hydroxypregn-4-en-3-one (20S)-20-hydroxypregn-4-en-3-one|(20S)-hydroxypregn-4-en-3-one|(S)-20-Hydroxypregn-4-en-3-one|20alpha-Hydroxy-4-pregnen-3-one|20alpha-Hydroxypregn-4-en-3-one|20alpha-Hydroxyprogesterone|20alpha-dihydroprogesterone|dihydroprogesterone http://purl.obolibrary.org/obo/CHEBI_28453 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28460 biolink:ChemicalEntity maltotetraose A maltotetraose tetrasaccharide in which the glucose residue at the reducing end is in the aldehydo open-chain form. cas:34612-38-9|kegg.compound:C02052|knapsack:C00018031|pubmed:1295602|pubmed:14074622|pubmed:18587768|pubmed:18597275|pubmed:365247|pubmed:6645121|pubmed:95558 Graph Maltotetraose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glc|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose Maltotetraose|alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glc|alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-D-glucose http://purl.obolibrary.org/obo/CHEBI_28460 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28462 biolink:ChemicalEntity ajmaline A monoterpenoid indole alkaloid that consists of ajmalan substituted at positions 17 and 21 by hydroxy groups. cas:4360-12-7|drugbank:DB01426|kegg.compound:C06542|kegg.drug:D00199|knapsack:C00001679|knapsack:C00024294 Graph (+)-Ajmaline|(5aR,6S,8S,10S,11S,11aS,12aR,13R)-5-methyl-5a,6,8,9,10,11,11a,12-octahydro-5H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizine-8,13-diol|Ajmaline|ajmalan-17alpha,21alpha-diol ajmalan-17alpha,21alpha-diol (+)-Ajmaline|(5aR,6S,8S,10S,11S,11aS,12aR,13R)-5-methyl-5a,6,8,9,10,11,11a,12-octahydro-5H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizine-8,13-diol|Ajmaline|ajmalan-17alpha,21alpha-diol http://purl.obolibrary.org/obo/CHEBI_28462 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28465 biolink:ChemicalEntity acetaldehyde oxime An aldoxime derived from acetaldehyde. cas:107-29-9|gmelin:217292|kegg.compound:C02658|patent:CN101624353|pubmed:12787823|pubmed:16663781|pubmed:16665692|pubmed:23333686|pubmed:24338896|reaxys:1209252|wikipedia.en:Acetaldoxime Graph Acetaldehyde oxime|Acetaldoxime|Aldoxime|acetaldehyde oxime|ethanal oxime|ethylidenehydroxylamine Acetaldehyde oxime|acetaldehyde oxime Acetaldehyde oxime|Acetaldoxime|Aldoxime|acetaldehyde oxime|ethanal oxime|ethylidenehydroxylamine http://purl.obolibrary.org/obo/CHEBI_28465 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28470 biolink:ChemicalEntity 3,5-dihydro-4H-imidazol-4-one beilstein:105893|kegg.compound:C06195 Graph 3,5-dihydro-4H-imidazol-4-one|4-Imidazolone|Imidazolone|imidazol-4-one 3,5-dihydro-4H-imidazol-4-one 3,5-dihydro-4H-imidazol-4-one|4-Imidazolone|Imidazolone|imidazol-4-one http://purl.obolibrary.org/obo/CHEBI_28470 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28477 biolink:ChemicalEntity 7alpha,12alpha-dihydroxycholest-4-en-3-one cas:1254-03-1|kegg.compound:C17339|lipidmaps:LMST04030114|pubmed:11181760|pubmed:1194785|pubmed:1245792|pubmed:18624455|pubmed:19075558|pubmed:4380319|pubmed:4385432|pubmed:5640503 Graph 4-cholesten-7alpha,12alpha-diol-3-one|7-alpha,12-alpha-dihydroxycholest-4-en-3-one|7alpha,12alpha-Dihydroxy-4-cholesten-3-one|7alpha,12alpha-Dihydroxycholest-4-en-3-one|7alpha,12alpha-dihydroxycholest-4-en-3-one 7alpha,12alpha-Dihydroxycholest-4-en-3-one|7alpha,12alpha-dihydroxycholest-4-en-3-one 4-cholesten-7alpha,12alpha-diol-3-one|7-alpha,12-alpha-dihydroxycholest-4-en-3-one|7alpha,12alpha-Dihydroxy-4-cholesten-3-one|7alpha,12alpha-Dihydroxycholest-4-en-3-one|7alpha,12alpha-dihydroxycholest-4-en-3-one http://purl.obolibrary.org/obo/CHEBI_28477 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28478 biolink:ChemicalEntity (2-hydroxyphenyl)acetic acid A hydroxy monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 2-hydroxyphenyl group. It is a metabolite of phenylalanine and is excreted in the urine of patients suffering from diseases like phenylketonuria. cas:614-75-5|hmdb:HMDB0000669|kegg.compound:C05852|pdb-ccd:OHP|pubmed:13658992|pubmed:22770225|reaxys:908000 Graph (2-hydroxyphenyl)acetic acid|(o-hydroxyphenyl)acetic acid|2'-hydroxyphenylacetic acid|2-hydroxybenzeneacetic acid|2-hydroxyphenylacetic acid|o-hydroxyphenylacetic acid (2-hydroxyphenyl)acetic acid (2-hydroxyphenyl)acetic acid|(o-hydroxyphenyl)acetic acid|2'-hydroxyphenylacetic acid|2-hydroxybenzeneacetic acid|2-hydroxyphenylacetic acid|o-hydroxyphenylacetic acid http://purl.obolibrary.org/obo/CHEBI_28478 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28479 biolink:ChemicalEntity D-tyrosine An optically active form of tyrosine having D-configuration. cas:556-02-5|drugbank:DB03839|ecmdb:ECMDB21520|gmelin:603524|kegg.compound:C06420|metacyc.compound:D-TYROSINE|pdb-ccd:DTY|pubmed:15292242|pubmed:23381872|pubmed:24936396|reaxys:2212157|ymdb:YMDB00805 Graph (2R)-2-amino-3-(4-hydroxyphenyl)propanoic acid|(R)-2-Amino-3-(p-hydroxyphenyl)propionic acid|(R)-3-(p-Hydroxyphenyl)alanine|D-TYROSINE|D-Tyr|D-Tyrosin|D-Tyrosine|D-tyrosine|DTY D-TYROSINE|D-Tyrosine|D-tyrosine (2R)-2-amino-3-(4-hydroxyphenyl)propanoic acid|(R)-2-Amino-3-(p-hydroxyphenyl)propionic acid|(R)-3-(p-Hydroxyphenyl)alanine|D-TYROSINE|D-Tyr|D-Tyrosin|D-Tyrosine|D-tyrosine|DTY http://purl.obolibrary.org/obo/CHEBI_28479 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28480 biolink:ChemicalEntity aldehydo-L-lyxose An L-lyxose in open-chain aldehyde form. cas:1949-78-6|glytoucan:G95233PP|kegg.compound:C01508|metacyc.compound:CPD-15868 Graph L-Lyx|L-Lyxose|L-lyxose L-Lyxose|L-lyxose L-Lyx|L-Lyxose|L-lyxose http://purl.obolibrary.org/obo/CHEBI_28480 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28481 biolink:ChemicalEntity aldehydo-L-iduronic acid The open-chain aldehydo-form of L-iduronic acid. Graph L-iduronic acid L-iduronic acid L-iduronic acid http://purl.obolibrary.org/obo/CHEBI_28481 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28484 biolink:ChemicalEntity isovaleric acid A C5, branched-chain saturated fatty acid. beilstein:1098522|cas:503-74-2|drugbank:DB03750|gmelin:101117|kegg.compound:C08262|knapsack:C00001189|lipidmaps:LMFA01020181|pdb-ccd:IVA|ppdb:3129|pubmed:12743728 Graph 3-Methylbutanoic acid|3-Methylbuttersaeure|3-methyl-n-butyric acid|3-methylbutanoic acid|3-methylbutyric acid|ISOVALERIC ACID|Isovalerate|Isovaleriansaeure|Isovaleric acid|beta-methylbutyric acid|delphinic acid|isobutylformic acid|isopentanoic acid|isopropylacetic acid|isovalerianic acid 3-Methylbutanoic acid|3-methylbutanoic acid 3-Methylbutanoic acid|3-Methylbuttersaeure|3-methyl-n-butyric acid|3-methylbutanoic acid|3-methylbutyric acid|ISOVALERIC ACID|Isovalerate|Isovaleriansaeure|Isovaleric acid|beta-methylbutyric acid|delphinic acid|isobutylformic acid|isopentanoic acid|isopropylacetic acid|isovalerianic acid http://purl.obolibrary.org/obo/CHEBI_28484 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28487 biolink:ChemicalEntity reserpine An alkaloid found in the roots of Rauwolfia serpentina and R. vomitoria. beilstein:5326088|cas:50-55-5|drugbank:DB00206|drugcentral:2370|hmdb:HMDB0014351|kegg.compound:C06539|kegg.drug:D00197|knapsack:C00001763|lincs.smallmolecule:LSM-4162|pubmed:20701244|pubmed:20825390|pubmed:24603678|reaxys:102014|wikipedia.en:Reserpine Graph (-)-reserpine|(3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester|3,4,5-trimethoxybenzoyl methyl reserpate|Apoplon|Reserpin|Reserpine|Serpalan|methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate (-)-reserpine|(3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester|3,4,5-trimethoxybenzoyl methyl reserpate|Apoplon|Reserpin|Reserpine|Serpalan|methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate http://purl.obolibrary.org/obo/CHEBI_28487 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28488 biolink:ChemicalEntity m-xylene A xylene carrying methyl groups at positions 1 and 3. cas:108-38-3|gmelin:101390|hmdb:HMDB0059810|kegg.compound:C07208|metacyc.compound:META-XYLENE|pubmed:14755610|pubmed:22360283|pubmed:24389912|reaxys:605441|umbbd.compound:c0240|wikipedia.en:M-xylene Graph 1,3-Dimethylbenzene|1,3-Dimethylbenzol|1,3-Xylene|1,3-xylene|3-xylene|m-Xylene|m-Xylol|m-dimethylbenzene|m-methyltoluene|m-xylene|meta-xylene 1,3-Xylene|1,3-xylene 1,3-Dimethylbenzene|1,3-Dimethylbenzol|1,3-Xylene|1,3-xylene|3-xylene|m-Xylene|m-Xylol|m-dimethylbenzene|m-methyltoluene|m-xylene|meta-xylene http://purl.obolibrary.org/obo/CHEBI_28488 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28492 biolink:ChemicalEntity 5-methylbarbituric acid beilstein:127336|cas:2417-22-3|kegg.compound:C05281 Graph 5-Methylbarbiturate|5-Methylbarbituric acid|5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione|5-methylbarbituric acid|5-methylpyrimidine-2,4,6(1H,3H,5H)-trione 5-methylpyrimidine-2,4,6(1H,3H,5H)-trione 5-Methylbarbiturate|5-Methylbarbituric acid|5-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione|5-methylbarbituric acid|5-methylpyrimidine-2,4,6(1H,3H,5H)-trione http://purl.obolibrary.org/obo/CHEBI_28492 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28493 biolink:ChemicalEntity decanoyl-CoA A medium-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of decanoic acid. cas:1264-57-9|hmdb:HMDB0006404|kegg.compound:C05274|lipidmaps:LMFA07050022|pubmed:1422210|pubmed:21175|pubmed:2178686|pubmed:3729425|pubmed:4147365|reaxys:8033370 Graph 10:0-CoA|3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(decanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|C10:0-CoA|Coenzyme A, S-decanoate|Decanoyl-CoA|Decanoyl-coenzyme A|capryl-CoA|capryl-coenzyme A 3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(decanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate) 10:0-CoA|3'-phosphoadenosine 5'-(3-{(3R)-4-[(3-{[2-(decanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} dihydrogen diphosphate)|C10:0-CoA|Coenzyme A, S-decanoate|Decanoyl-CoA|Decanoyl-coenzyme A|capryl-CoA|capryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28493 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28494 biolink:ChemicalEntity cardiolipin A phosphatidylglycerol composed of two molecules of phosphatidic acid covalently linked to a molecule of glycerol. drugbank:DB03429|kegg.compound:C05980|lipidmaps:LMGP12010000|pdb-ccd:CDN|pubmed:10540156|pubmed:11339809|pubmed:16341241|pubmed:1694860|pubmed:17294083|pubmed:18515061|pubmed:18790112|pubmed:19303420|pubmed:19962311|pubmed:22819940|pubmed:2413066|pubmed:28458255|pubmed:3196084|wikipedia.en:Cardiolipin Graph 1',3'-Bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol|1',3'-bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol|CARDIOLIPIN|Cardiolipin|DPG|Diphosphatidylglycerol|cardiolipins 1',3'-Bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol|1',3'-bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol 1',3'-Bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol|1',3'-bis(1,2-diacyl-sn-glycero-3-phospho)-sn-glycerol|CARDIOLIPIN|Cardiolipin|DPG|Diphosphatidylglycerol|cardiolipins http://purl.obolibrary.org/obo/CHEBI_28494 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28496 biolink:ChemicalEntity N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine A tripeptoid arising from cleavage of both rings of a penicillin derivative. cas:21566-74-5|drugbank:DB02025|kegg.compound:C05556|pdb-ccd:ACV Graph (alpha-Aminoadipyl)-cys-val|5-(2-Aminoad)-cys-val|AADCV|ACV|L-D-(A-AMINOADIPOYL)-L-CYSTEINYL-D-VALINE|L-delta-(alpha-Aminoadipoyl)-L-cysteinyl-D-valine|N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine|N-[L-5-Amino-5-carboxypentanoyl]-L-cysteinyl-D-valine|delta(L-2-Aminoadipyl)-L-cysteinyl-D-valine|delta(L-2-aminoadipyl)-L-cysteinyl-D-valine N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine (alpha-Aminoadipyl)-cys-val|5-(2-Aminoad)-cys-val|AADCV|ACV|L-D-(A-AMINOADIPOYL)-L-CYSTEINYL-D-VALINE|L-delta-(alpha-Aminoadipoyl)-L-cysteinyl-D-valine|N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine|N-[L-5-Amino-5-carboxypentanoyl]-L-cysteinyl-D-valine|delta(L-2-Aminoadipyl)-L-cysteinyl-D-valine|delta(L-2-aminoadipyl)-L-cysteinyl-D-valine http://purl.obolibrary.org/obo/CHEBI_28496 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28497 biolink:ChemicalEntity N-acetyl-beta-D-galactosamine An N-acetyl-D-galactosamine having β-configuration at the anomeric centre. cas:1811-31-0|glygen:G61418DU|glytoucan:G61418DU|hmdb:HMDB0000853|kegg.compound:C05021|metacyc.compound:CPD-12557|pdb-ccd:NGA|pubmed:19443021|pubmed:31537530|reaxys:1728373 Graph 2-(acetylamino)-2-deoxy-beta-D-galactopyranose|2-acetamido-2-deoxy-beta-D-galactopyranose|2-acetamido-2-deoxy-beta-D-galactopyranoside|N-Acetyl-beta-D-galactosamine|N-acetyl-beta-D-galactosamine|bGalNAc|beta-D-galactopyranose, 2-(acetylamino)-2-deoxy-|beta-GalNAc 2-acetamido-2-deoxy-beta-D-galactopyranose 2-(acetylamino)-2-deoxy-beta-D-galactopyranose|2-acetamido-2-deoxy-beta-D-galactopyranose|2-acetamido-2-deoxy-beta-D-galactopyranoside|N-Acetyl-beta-D-galactosamine|N-acetyl-beta-D-galactosamine|bGalNAc|beta-D-galactopyranose, 2-(acetylamino)-2-deoxy-|beta-GalNAc http://purl.obolibrary.org/obo/CHEBI_28497 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28498 biolink:ChemicalEntity acadesine A 1-ribosylimidazolecarboxamide in which the carboxamide group is situated at position 4 of the imidazole ring, which is further substituted at position 5 by an amino group. A purine nucleoside analogue and activator of AMP-activated protein kinase, it is is used for the treatment of acute lymphoblastic leukemia and is reported to have cardioprotective effects. cas:2627-69-2|drugbank:DB04944|drugcentral:37|kegg.drug:D02742|pubmed:17513706|pubmed:17706943|pubmed:18090925|pubmed:18457469|pubmed:18671468|pubmed:20185792|pubmed:20367195|pubmed:21244913|pubmed:23228986|pubmed:24303202|pubmed:24519895|pubmed:24778186|pubmed:8227467|pubmed:8458030|reaxys:38255|wikipedia.en:Acadesine Graph 5-amino-1-(beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide|5-amino-1-beta-D-ribofuranosyl-4-imidazolecarboxamide|5-amino-1-beta-D-ribofuranosylimidazole-4-carboxamide|5-amino-1-beta-ribofuranosyl-imidazole-4-carboxamide|5-amino-1-ribofuranosylimidazole-4-carboxamide|5-amino-1beta-D-ribofuranosylimidazole-4-carboxyamide|5-amino-4-imidazolecarboxamide ribofuranoside|5-aminoimidazole-4-carboxamide ribonucleoside|AIC-Riboside|AICA-riboside|AICAr|EC Number 220-097-5|GP 1-110|GP-1-110|N(1)-(beta-D-ribofuranosyl)-5-aminoimidazole-4-carboxamide|acadesina|acadesine|acadesinum 5-amino-1-(beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide 5-amino-1-(beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide|5-amino-1-beta-D-ribofuranosyl-4-imidazolecarboxamide|5-amino-1-beta-D-ribofuranosylimidazole-4-carboxamide|5-amino-1-beta-ribofuranosyl-imidazole-4-carboxamide|5-amino-1-ribofuranosylimidazole-4-carboxamide|5-amino-1beta-D-ribofuranosylimidazole-4-carboxyamide|5-amino-4-imidazolecarboxamide ribofuranoside|5-aminoimidazole-4-carboxamide ribonucleoside|AIC-Riboside|AICA-riboside|AICAr|EC Number 220-097-5|GP 1-110|GP-1-110|N(1)-(beta-D-ribofuranosyl)-5-aminoimidazole-4-carboxamide|acadesina|acadesine|acadesinum http://purl.obolibrary.org/obo/CHEBI_28498 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28499 biolink:ChemicalEntity kaempferol A tetrahydroxyflavone in which the four hydroxy groups are located at positions 3, 5, 7 and 4'. Acting as an antioxidant by reducing oxidative stress, it is currently under consideration as a possible cancer treatment. cas:520-18-3|drugbank:DB01852|hmdb:HMDB0005801|kegg.compound:C05903|knapsack:C00004565|lincs.smallmolecule:LSM-5304|lipidmaps:LMPK12110003|metacyc.compound:CPD1F-90|pdb-ccd:KMP|pubmed:12592675|pubmed:15234754|pubmed:17426744|pubmed:17551714|pubmed:28166217|reaxys:304401|wikipedia.en:kaempferol Graph 3,4',5,7-Tetrahydroxyflavone|3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-5,7,4'-Trihydroxyflavonol|5,7,4'-trihydroxyflavonol|C.I. 75640|Indigo yellow|Kaempferol|Kaempherol|Kampherol|Kempferol|Nimbecetin|Pelargidenolon|Populnetin|Rhamnolutein|Rhamnolutin|Robigenin|Swartziol|Trifolitin|campherol 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 3,4',5,7-Tetrahydroxyflavone|3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one|4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-5,7,4'-Trihydroxyflavonol|5,7,4'-trihydroxyflavonol|C.I. 75640|Indigo yellow|Kaempferol|Kaempherol|Kampherol|Kempferol|Nimbecetin|Pelargidenolon|Populnetin|Rhamnolutein|Rhamnolutin|Robigenin|Swartziol|Trifolitin|campherol http://purl.obolibrary.org/obo/CHEBI_28499 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28502 biolink:ChemicalEntity tolazoline A member of the class of imidazoles that is 4,5-dihydro-1H-imidazole substituted by a benzyl group. cas:59-98-3|drugbank:DB00797|drugcentral:2695|hmdb:HMDB0014935|kegg.compound:C07147|kegg.drug:D08614|lincs.smallmolecule:LSM-3020|pubmed:14366198|pubmed:23321455|pubmed:23438114|reaxys:128757|wikipedia.en:Tolazoline Graph 2-Benzyl-2-imidazoline|2-Benzyl-4,5-imidazoline|2-Benzylimidazoline|2-benzyl-4,5-dihydro-1H-imidazole|4,5-Dihydro-2-(phenylmethyl)-1H-imidazole|Tolazoline 2-benzyl-4,5-dihydro-1H-imidazole 2-Benzyl-2-imidazoline|2-Benzyl-4,5-imidazoline|2-Benzylimidazoline|2-benzyl-4,5-dihydro-1H-imidazole|4,5-Dihydro-2-(phenylmethyl)-1H-imidazole|Tolazoline http://purl.obolibrary.org/obo/CHEBI_28502 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28506 biolink:ChemicalEntity arsonoacetic acid An organoarsonic acid that is methylarsonic acid in which one of the hydrogens of the methyl group is replaced by a carboxy group. cas:107-38-0|kegg.compound:C06550|pubmed:7711909|reaxys:1764356|umbbd.compound:c0524 Graph (carboxymethyl)arsonic acid|Arsonoacetate|arsonoacetic acid Arsonoacetate|arsonoacetic acid (carboxymethyl)arsonic acid|Arsonoacetate|arsonoacetic acid http://purl.obolibrary.org/obo/CHEBI_28506 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28509 biolink:ChemicalEntity chloroethene A monohaloethene that is ethene in which one of the hydrogens has been replaced by a chloro group. cas:75-01-4|gmelin:100541|kegg.compound:C06793|pubmed:15989139|pubmed:18678006|reaxys:1731576|umbbd.compound:c0358|wikipedia.en:Chloroethene Graph Chloroethylene|VC|Vinyl chloride|Vinylchlorid|chloroethene|chlorure de vinyle|cloroetileno|cloruro de vinilo|ethylene monochloride|monochloroethene|monochloroethylene|monovinyl chloride chloroethene Chloroethylene|VC|Vinyl chloride|Vinylchlorid|chloroethene|chlorure de vinyle|cloroetileno|cloruro de vinilo|ethylene monochloride|monochloroethene|monochloroethylene|monovinyl chloride http://purl.obolibrary.org/obo/CHEBI_28509 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28514 biolink:ChemicalEntity N-acetyl-D-glucosaminyl-(1->4)-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysine An N-acetyl-β-D-glycosaminyl glycopeptide consisting of an N-acetyl-β-D-glycosaminyl-(1→4)-N-acetylmuramoyl moiety attached to the amino terminus of the tripeptide L-alanyl-D-glutamyl-6-carboxy-L-lysine via an amide linkage. kegg.compound:C04876 Graph N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysine|beta-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-Glu-6-carboxy-L-Lys N-Acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L-lysine|beta-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-Glu-6-carboxy-L-Lys http://purl.obolibrary.org/obo/CHEBI_28514 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28516 biolink:ChemicalEntity 1,2-dihydronaphthalene-1,2-diol A member of the class of naphthalenediols that is 1,2-dihydronaphthalene substituted by hydroxy groups at positions 1 and 2 respectively. beilstein:2045863|cas:7234-04-0|hmdb:HMDB0060335|kegg.compound:C06205|pubmed:24554759 Graph 1,2-Dihydronaphthalene-1,2-diol|1,2-Dihydroxy-1,2-dihydronaphthalene|1,2-dihydronaphthalene-1,2-diol 1,2-Dihydronaphthalene-1,2-diol|1,2-dihydronaphthalene-1,2-diol 1,2-Dihydronaphthalene-1,2-diol|1,2-Dihydroxy-1,2-dihydronaphthalene|1,2-dihydronaphthalene-1,2-diol http://purl.obolibrary.org/obo/CHEBI_28516 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28517 biolink:ChemicalEntity biphenyl-2,2',3-triol beilstein:2581185|cas:91368-55-7|kegg.compound:C03569|umbbd.compound:c0040 Graph 2,2',3-Trihydroxybiphenyl|2,2',3-biphenyltriol|3-(2-hydroxyphenyl)catechol|[1,1'-biphenyl]-2,2',3-triol|biphenyl-2,2',3-triol [1,1'-biphenyl]-2,2',3-triol 2,2',3-Trihydroxybiphenyl|2,2',3-biphenyltriol|3-(2-hydroxyphenyl)catechol|[1,1'-biphenyl]-2,2',3-triol|biphenyl-2,2',3-triol http://purl.obolibrary.org/obo/CHEBI_28517 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28518 biolink:ChemicalEntity alpha-D-xylose A D-xylopyranose in with an α-configuration at the anomeric position. cas:25990-60-7|cas:6763-34-4|drugbank:DB03389|glygen:G03144EF|glytoucan:G03144EF|kegg.compound:C01394|kegg.compound:C02205|knapsack:C00007290 Graph alpha-D-Xylose|alpha-D-xylopyranose|alpha-D-xylose alpha-D-xylopyranose alpha-D-Xylose|alpha-D-xylopyranose|alpha-D-xylose http://purl.obolibrary.org/obo/CHEBI_28518 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28522 biolink:ChemicalEntity 4-hydroxybutyryl-CoA An acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of 4-hydroxybutyric acid. kegg.compound:C11062|pubmed:11041350|pubmed:1768145|pubmed:8344309|reaxys:10514896 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl]dihydrogen diphosphate}|4-Hydroxybutanoyl-CoA|4-Hydroxybutyryl-CoA|4-hydroxybutanoyl-CoA|4-hydroxybutanoyl-coenzyme A|4-hydroxybutyryl-coenzyme A|gamma-hydroxybutanoyl-CoA|gamma-hydroxybutyryl-CoA|gamma-hydroxybutyryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl]dihydrogen diphosphate}|4-hydroxybutanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl]dihydrogen diphosphate}|4-Hydroxybutanoyl-CoA|4-Hydroxybutyryl-CoA|4-hydroxybutanoyl-CoA|4-hydroxybutanoyl-coenzyme A|4-hydroxybutyryl-coenzyme A|gamma-hydroxybutanoyl-CoA|gamma-hydroxybutyryl-CoA|gamma-hydroxybutyryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28522 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28526 biolink:ChemicalEntity (KDO)2-lipid IVA Lipid IVA glycosylated with two 3-deoxy-D-manno-octulosonic acid (KDO) residues. kegg.compound:C06025|kegg.glycan:G11160 Graph 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|Di[3-deoxy-D-manno-octulosonyl]-lipid IV(A)|KDO2-lipid IV(A) 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose 3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphono-alpha-D-glucopyranose|Di[3-deoxy-D-manno-octulosonyl]-lipid IV(A)|KDO2-lipid IV(A) http://purl.obolibrary.org/obo/CHEBI_28526 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28527 biolink:ChemicalEntity rutin A rutinoside that is quercetin with the hydroxy group at position C-3 substituted with glucose and rhamnose sugar groups. cas:153-18-4|drugbank:DB01698|drugcentral:3535|hmdb:HMDB0003249|kegg.compound:C05625|kegg.drug:D00190|kegg.drug:D08499|knapsack:C00005413|lincs.smallmolecule:LSM-2457|metacyc.compound:RUTIN|pdb-ccd:RUT|pubmed:14979715|pubmed:15601236|pubmed:20701244|pubmed:30307940|pubmed:31382673|pubmed:33917795|reaxys:75455|wikipedia.en:Rutin Graph 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|3-Rhamnoglucosylquercetin|3-Rutinosyl quercetin|3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|Phytomelin|Quercetin 3-rutinoside|Quercetin-3-rutinoside|Rutin|Rutoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|3-Rhamnoglucosylquercetin|3-Rutinosyl quercetin|3-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one|Phytomelin|Quercetin 3-rutinoside|Quercetin-3-rutinoside|Rutin|Rutoside http://purl.obolibrary.org/obo/CHEBI_28527 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28528 biolink:ChemicalEntity 3-oxodecanoyl-CoA An oxo-fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxylic acid group of 3-oxodecanoic acid. hmdb:HMDB0003939|kegg.compound:C05265|metacyc.compound:CPD0-2123|pubmed:344310 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxodecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxodecanoyl-CoA|3-ketodecanoyl-CoA|3-ketodecanoyl-coenzyme A|3-oxodecanoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxodecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxodecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxodecanoyl-CoA|3-ketodecanoyl-CoA|3-ketodecanoyl-coenzyme A|3-oxodecanoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28528 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2853 biolink:ChemicalEntity artemorin A germacranolide isolated from Laurus nobilis L.. cas:64845-92-7|kegg.compound:C09345|knapsack:C00003222|pubmed:6476889|reaxys:1623173 Graph (7R,10E)-7-hydroxy-10-methyl-3,6-bis(methylidene)-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-2(3H)-one|Artemorin (7R,10E)-7-hydroxy-10-methyl-3,6-bis(methylidene)-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-2(3H)-one (7R,10E)-7-hydroxy-10-methyl-3,6-bis(methylidene)-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-2(3H)-one|Artemorin http://purl.obolibrary.org/obo/CHEBI_2853 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28530 biolink:ChemicalEntity GDP-4-dehydro-L-fucose A GDP-hexose compound having 6-deoxy-L-xylo-hexopyranosyl-4-ulose as the hexose fragment. pubmed:25126572 Graph GDP-4-oxo-L-fucose|guanosine 5'-[3-(6-deoxy-L-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] guanosine 5'-[3-(6-deoxy-L-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] GDP-4-oxo-L-fucose|guanosine 5'-[3-(6-deoxy-L-xylo-hexopyranosyl-4-ulose) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_28530 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28533 biolink:ChemicalEntity 3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA A cholestanoyl-CoA formed by thioester linkage between 3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oic acid and coenzyme A. kegg.compound:C05449|pubmed:11146090 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-24-oxocholestanoyl-CoA|3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-24-oxocholestanoyl-CoA|3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28533 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28536 biolink:ChemicalEntity 3-hydroxyindolin-2-one An oxindole that is 1,3-dihydro-2H-indol-2-one substituted by a hydroxy group at position 3. beilstein:131835|cas:61-71-2|kegg.compound:C11130|reaxys:82628 Graph 1,3-Dihydro-3-hydroxy-2H-indol-2-one|3-Hydroxy-indolin-2-one|3-hydroxy-1,3-dihydro-2H-indol-2-one|3-hydroxy-2-indolinone|3-hydroxyindolin-2-one|3-hydroxyoxindole|Dioxindole 3-hydroxy-1,3-dihydro-2H-indol-2-one 1,3-Dihydro-3-hydroxy-2H-indol-2-one|3-Hydroxy-indolin-2-one|3-hydroxy-1,3-dihydro-2H-indol-2-one|3-hydroxy-2-indolinone|3-hydroxyindolin-2-one|3-hydroxyoxindole|Dioxindole http://purl.obolibrary.org/obo/CHEBI_28536 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28537 biolink:ChemicalEntity all-trans-dehydroretinal A retinal which contains an additional double bond between the 3 and 4 positions of the six-membered ring, and in which all of the double bonds in the side chain have the E-configuration. cas:472-87-7|kegg.compound:C05918|reaxys:2055104 Graph (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenal|(all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-2,4,6,8-nonatetraenal|3,4-Didehydroretinal|3-Dehydroretinal|3-Dehydroretinaldehyde|Dehydroretinal|Dehydroretinaldehyd|Dehydroretinaldehyde|Retinene 2|Vitamin A2 aldehyde|all-trans-3,4-Dehydroretinal|all-trans-3,4-didehydroretinal|all-trans-Dehydroretinal|trans-3-Dehydroretinal (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenal (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenal|(all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-2,4,6,8-nonatetraenal|3,4-Didehydroretinal|3-Dehydroretinal|3-Dehydroretinaldehyde|Dehydroretinal|Dehydroretinaldehyd|Dehydroretinaldehyde|Retinene 2|Vitamin A2 aldehyde|all-trans-3,4-Dehydroretinal|all-trans-3,4-didehydroretinal|all-trans-Dehydroretinal|trans-3-Dehydroretinal http://purl.obolibrary.org/obo/CHEBI_28537 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28540 biolink:ChemicalEntity 5beta-cholestane-3alpha,7alpha,26-triol cas:15313-69-6|kegg.compound:C05444|lipidmaps:LMST04030020 Graph 3alpha,7alpha,26-Trihydroxy-5beta-cholestane|3alpha,7alpha,26-trihydroxy-5beta-cholestane|5beta-Cholestane-3alpha,7alpha,26-triol|5beta-cholestan-3alpha,7alpha,26-triol|5beta-cholestane-3alpha,7alpha,26-triol|Cholestane-3,7,26-triol 5beta-Cholestane-3alpha,7alpha,26-triol|5beta-cholestane-3alpha,7alpha,26-triol 3alpha,7alpha,26-Trihydroxy-5beta-cholestane|3alpha,7alpha,26-trihydroxy-5beta-cholestane|5beta-Cholestane-3alpha,7alpha,26-triol|5beta-cholestan-3alpha,7alpha,26-triol|5beta-cholestane-3alpha,7alpha,26-triol|Cholestane-3,7,26-triol http://purl.obolibrary.org/obo/CHEBI_28540 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28541 biolink:ChemicalEntity N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine A sialodiosylceramide consisting of the pentasaccharide α-Neu5NAc-(2→8)-α-Neu5NAc-(2→8)-α-Neu5NAc-(2→3)-β-D-Gal-(1→4)-β-D-Glc attached to the primary hydroxy function of ceramide. kegg.compound:C06299|kegg.glycan:G00118|pubmed:1371229|pubmed:1567198|pubmed:2303428 Graph (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT3|N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide|NeuAc-alpha2->8NeuAc-alpha2->8NeuAc2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc-alpha2->8NeuAc2->3LacCer|NeuActrans2->8NeuAcalpha2->8NeuAcalpha2->3Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer|alpha-Neup5NAc-(2->8)-alpha-Neup5NAc-(2->8)-alpha-Neup5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GT3 (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-alkanamido-3-hydroxyoctadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (Glc)1 (Neu5Ac)3 (Cer)1|GT3|N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide|NeuAc-alpha2->8NeuAc-alpha2->8NeuAc2->3Gal-beta1->4Glc-beta1->1'Cer|NeuAc-alpha2->8NeuAc-alpha2->8NeuAc2->3LacCer|NeuActrans2->8NeuAcalpha2->8NeuAcalpha2->3Galbeta1->4Glc-Cer|alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer|alpha-Neup5NAc-(2->8)-alpha-Neup5NAc-(2->8)-alpha-Neup5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer|ganglioside GT3 http://purl.obolibrary.org/obo/CHEBI_28541 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28542 biolink:ChemicalEntity 2-deoxy-D-ribofuranose 1-phosphate A 2-deoxyribose 1-phosphate with D-ribofuranose as the sugar. An intermediate in the metabolism of pyrimidine. beilstein:1285902|cas:17210-42-3|ecmdb:ECMDB01351|hmdb:HMDB0001351|kegg.compound:C00672|pubmed:11103787|reaxys:1285902|ymdb:YMDB00663 Graph 2-Deoxy-D-ribose 1-phosphate|2-deoxy-1-O-phosphono-D-erythro-pentofuranose|2-deoxy-1-O-phosphono-D-ribofuranose|2-deoxy-D-erythro-pentofuranose 1-(dihydrogen phosphate) 2-deoxy-D-erythro-pentofuranose 1-(dihydrogen phosphate) 2-Deoxy-D-ribose 1-phosphate|2-deoxy-1-O-phosphono-D-erythro-pentofuranose|2-deoxy-1-O-phosphono-D-ribofuranose|2-deoxy-D-erythro-pentofuranose 1-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28542 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28544 biolink:ChemicalEntity digitoxin A cardenolide glycoside in which the 3β-hydroxy group of digitoxigenin carries a 2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D-ribo-hexopyranosyl trisaccharide chain. cas:71-63-6|drugbank:DB01396|drugcentral:881|kegg.compound:C06955|kegg.drug:D00297|knapsack:C00003617|pubmed:10438974|pubmed:10687899|pubmed:26573786|reaxys:76678|wikipedia.en:Digitoxin Graph 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide|Crystodigin (TN)|Digitoxin|Digitoxoside 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide|Crystodigin (TN)|Digitoxin|Digitoxoside http://purl.obolibrary.org/obo/CHEBI_28544 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28545 biolink:ChemicalEntity valinomycin A twelve-membered cyclodepsipeptide composed of three repeating D-α-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl units joined in sequence. An antibiotic found in several Streptomyces strains. cas:2001-95-8|kegg.compound:C06684|pubmed:10603383|pubmed:18633285|pubmed:19347893|pubmed:22683555|pubmed:7590182|reaxys:78657|wikipedia.en:Valinomycin Graph (3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,6,9,15,18,21,27,30,33-nonaisopropyl-12,24,36-trimethyl-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexaazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone|Cyclic(D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl-D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl-D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl)|Valinomycin|cyclo[-D-O-Val-D-Val-L-O-Ala-L-Val]3 (3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,6,9,15,18,21,27,30,33-nonaisopropyl-12,24,36-trimethyl-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexaazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone (3R,6R,9S,12S,15R,18R,21S,24S,27R,30R,33S,36S)-3,6,9,15,18,21,27,30,33-nonaisopropyl-12,24,36-trimethyl-1,7,13,19,25,31-hexaoxa-4,10,16,22,28,34-hexaazacyclohexatriacontane-2,5,8,11,14,17,20,23,26,29,32,35-dodecone|Cyclic(D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl-D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl-D-alpha-hydroxyisovaleryl-D-valyl-L-lactoyl-L-valyl)|Valinomycin|cyclo[-D-O-Val-D-Val-L-O-Ala-L-Val]3 http://purl.obolibrary.org/obo/CHEBI_28545 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28547 biolink:ChemicalEntity D-glucuronate 1-phosphate A carbohydrate acid derivative anion arising from selective deprotonation of the carboxy function of D-glucuronic acid 1-phosphate. kegg.compound:C05385 Graph 1-O-phosphono-D-glucopyranuronate|D-Glucuronate 1-phosphate 1-O-phosphono-D-glucopyranuronate 1-O-phosphono-D-glucopyranuronate|D-Glucuronate 1-phosphate http://purl.obolibrary.org/obo/CHEBI_28547 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28548 biolink:ChemicalEntity D-pinitol The D-enantiomer of pinitol. beilstein:2043789|beilstein:4291950|cas:10284-63-6|chemspider:10369209|foodb.food:FDB012524|hmdb:HMDB0034219|kegg.compound:C03844|knapsack:C00001168|pubmed:22843669|pubmed:9834164|wikipedia.en:Pinitol Graph (+)-pinitol|(1R,2S,3R,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-3-O-Methyl-chiro-inositol|1D-3-O-methyl-chiro-inositol|5D-5-O-Methyl-chiro-inositol|5D-5-O-methyl-chiro-inositol|D-(+)-pinitol|D-Pinitol|Pinit 1D-3-O-methyl-chiro-inositol (+)-pinitol|(1R,2S,3R,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol|1D-3-O-Methyl-chiro-inositol|1D-3-O-methyl-chiro-inositol|5D-5-O-Methyl-chiro-inositol|5D-5-O-methyl-chiro-inositol|D-(+)-pinitol|D-Pinitol|Pinit http://purl.obolibrary.org/obo/CHEBI_28548 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28549 biolink:ChemicalEntity 3-(indol-3-yl)-2-oxobutyric acid A 2-oxo monocarboxylic acid that is 2-oxobutyric acid which is substituted at position 3 by an indol-3-yl group. beilstein:477498|kegg.compound:C05644 Graph 3-(1H-indol-3-yl)-2-oxobutanoic acid|3-Methylindolepyruvate 3-(1H-indol-3-yl)-2-oxobutanoic acid 3-(1H-indol-3-yl)-2-oxobutanoic acid|3-Methylindolepyruvate http://purl.obolibrary.org/obo/CHEBI_28549 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28553 biolink:ChemicalEntity selenocystine beilstein:1969559|cas:1464-43-3|kegg.compound:C05704 Graph 3,3'-Diselenobisalanine|3,3'-Diselenodialanine|3,3'-diselane-1,2-diylbis(2-aminopropanoic acid)|Selenocystine 3,3'-diselane-1,2-diylbis(2-aminopropanoic acid) 3,3'-Diselenobisalanine|3,3'-Diselenodialanine|3,3'-diselane-1,2-diylbis(2-aminopropanoic acid)|Selenocystine http://purl.obolibrary.org/obo/CHEBI_28553 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28554 biolink:ChemicalEntity ajugose A hexasaccharide that is verbascose which has an additional unit of α-D-galactopyranose attached by a 1→6 glycosidic linkage to the terminal galactosyl residue. cas:512-72-1|kegg.compound:C08238|knapsack:C00001133|metacyc.compound:CPD-8066|pubmed:15998152|pubmed:16716272|pubmed:7445755|reaxys:78323 Graph Ajugose|alpha-Galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-glucosyl-(1-2)-beta-fructose|beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside Ajugose|alpha-Galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-galactosyl-(1-6)-alpha-glucosyl-(1-2)-beta-fructose|beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_28554 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28556 biolink:ChemicalEntity biochanin A 7-O-(6-O-malonyl-beta-D-glucoside) A glycosyloxyisoflavone that is biochanin A 7-O-β-D-glucoside in which the hydroxy group at position 6 of the glucosyl moiety has been acylated by one of the carboxy groups of malonic acid. cas:34232-17-2|kegg.compound:C12625|knapsack:C00010117 Graph 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside|Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)|Biochanin A 7-O-beta-D-glucoside 6''-O-malonate|biochanin A 7-O-(6-O-malonyl-beta-D-glucoside) 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(carboxyacetyl)-beta-D-glucopyranoside|Biochanin A 7-O-(6-O-malonyl-beta-D-glucoside)|Biochanin A 7-O-beta-D-glucoside 6''-O-malonate|biochanin A 7-O-(6-O-malonyl-beta-D-glucoside) http://purl.obolibrary.org/obo/CHEBI_28556 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28568 biolink:ChemicalEntity piperazine An azacycloalkane that consists of a six-membered ring containing two nitrogen atoms at opposite positions. cas:110-85-0|cas:142-88-1|chemspider:13835459|drugbank:DB00592|drugcentral:2188|foodb.food:FDB012189|gmelin:25695|hmdb:HMDB0014730|kegg.compound:C07973|kegg.drug:D00807|kegg.drug:D02145|metacyc.compound:PIPERAZINE|pdb-ccd:PZE|pesticides:piperazine|pubmed:15017096|pubmed:16987490|pubmed:24201896|pubmed:28842264|pubmed:29438107|pubmed:32912125|pubmed:33336346|pubmed:33751807|pubmed:9265850|reaxys:102555|vsdb:1781|wikipedia.en:Piperazine Graph 1,4-diazacyclohexane|1,4-diethylenediamine|1,4-piperazine|Diethylenediamine|Piperazin|Piperazine|Vermizine (TN)|hexahydro-1,4-diazine|piperazine Piperazine|piperazine 1,4-diazacyclohexane|1,4-diethylenediamine|1,4-piperazine|Diethylenediamine|Piperazin|Piperazine|Vermizine (TN)|hexahydro-1,4-diazine|piperazine http://purl.obolibrary.org/obo/CHEBI_28568 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28575 biolink:ChemicalEntity L-glutamate methyl ester A L-glutamyl ester that is the α-methyl ester derivative of L-glutamic acid. kegg.compound:C05016|reaxys:1707273 Graph (4S)-4-amino-5-methoxy-5-oxopentanoic acid|Glu(alpha-OMe)-OH|H-Glu-OMe|L-glutamate methylester|L-glutamic acid 1-methyl ester|glutamic acid alpha-methyl ester|glutamic acid methyl ester (4S)-4-amino-5-methoxy-5-oxopentanoic acid (4S)-4-amino-5-methoxy-5-oxopentanoic acid|Glu(alpha-OMe)-OH|H-Glu-OMe|L-glutamate methylester|L-glutamic acid 1-methyl ester|glutamic acid alpha-methyl ester|glutamic acid methyl ester http://purl.obolibrary.org/obo/CHEBI_28575 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28578 biolink:ChemicalEntity 2-hydroxyglutaryl-CoA A hydroxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 2-hydroxyglutaric acid. kegg.compound:C03058|pubmed:1417419|pubmed:3691501 Graph 2-Hydroxyglutaryl-CoA|2-hydroxyglutaryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-2-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-2-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 2-Hydroxyglutaryl-CoA|2-hydroxyglutaryl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-carboxy-2-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_28578 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28579 biolink:ChemicalEntity epsilon-caprolactam A member of the class of caprolactams that is azepane substituted by an oxo group at position 2. cas:105-60-2|gmelin:101802|kegg.compound:C06593|knapsack:C00000318|metacyc.compound:CPD-883|patent:KR20120003540|patent:US2011183386|patent:WO2011108251|pdb-ccd:ICC|pubmed:17161908|pubmed:2263224|pubmed:9688819|reaxys:106934|umbbd.compound:c0432|wikipedia.en:Caprolactam Graph 2-ketohexamethyleneimine|2-oxohexamethylenimine|6-caprolactam|Kaprolaktam|aminocaproic lactam|azepan-2-one|caprolactam|epsilon-Caprolactam|epsilon-caprolactam|hexahydro-2H-azepin-2-one azepan-2-one 2-ketohexamethyleneimine|2-oxohexamethylenimine|6-caprolactam|Kaprolaktam|aminocaproic lactam|azepan-2-one|caprolactam|epsilon-Caprolactam|epsilon-caprolactam|hexahydro-2H-azepin-2-one http://purl.obolibrary.org/obo/CHEBI_28579 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28581 biolink:ChemicalEntity UDP-N-acetyl-D-mannosaminouronic acid A UDP-N-acetyl-mannosaminouronic acid in which the N-acetyl-mannosaminouronic acid fragment has D-configuration. Graph uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyluronic acid) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyluronic acid) dihydrogen diphosphate] uridine 5'-[3-(2-acetamido-2-deoxy-D-mannopyranosyluronic acid) dihydrogen diphosphate] http://purl.obolibrary.org/obo/CHEBI_28581 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28584 biolink:ChemicalEntity gossypol cas:303-45-7|drugbank:DB13044|drugcentral:1328|foodb.food:FDB000742|kegg.compound:C07667|knapsack:C00003136|lincs.smallmolecule:LSM-6229|lipidmaps:LMPR0103330002|metacyc.compound:CPD-9526|pdb-ccd:GO3|pubmed:36718333|pubmed:36928775|pubmed:37626472|pubmed:37763992|pubmed:37865884|pubmed:38098026|pubmed:38582865|pubmed:38632634|pubmed:38786676|pubmed:38786884|pubmed:38856661|pubmed:38864347|pubmed:38936520|pubmed:38960107|wikipedia.en:Gossypol Graph 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-8,8'-dicarbaldehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-diisopropyl-2,2'-binaphthyl-8,8'-dialdehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-diisopropyl[2,2'-binaphthalene]-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-8,8'-dicarbaldehyde|1,6,7,1',6',7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2']binaphthalenyl-8,8'-dicarboxaldehyde|2,2'-bis[1,6,7-trihydroxy-3-methyl-5-isopropyl-8-aldehydonaphthyl]|2,2'-bis[8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthyl]|gosipol 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-8,8'-dicarbaldehyde 1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-8,8'-dicarbaldehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-diisopropyl-2,2'-binaphthyl-8,8'-dialdehyde|1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-5,5'-diisopropyl[2,2'-binaphthalene]-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-dicarboxaldehyde|1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-8,8'-dicarbaldehyde|1,6,7,1',6',7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2']binaphthalenyl-8,8'-dicarboxaldehyde|2,2'-bis[1,6,7-trihydroxy-3-methyl-5-isopropyl-8-aldehydonaphthyl]|2,2'-bis[8-formyl-1,6,7-trihydroxy-5-isopropyl-3-methylnaphthyl]|gosipol http://purl.obolibrary.org/obo/CHEBI_28584 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28585 biolink:ChemicalEntity 4-carboxy-4'-sulfoazobenzene A member of the class of azobenzenes that is azobenzene in which the para position of one of the phenyl groups is substituted by a carboxy group, whilst that of the other phenyl group is substituted by a sulfo group. kegg.compound:C06673|reaxys:3411412 Graph 4-(4-sulfophenylazo)benzoic acid|4-[(E)-(4-sulfophenyl)diazenyl]benzoic acid 4-[(E)-(4-sulfophenyl)diazenyl]benzoic acid 4-(4-sulfophenylazo)benzoic acid|4-[(E)-(4-sulfophenyl)diazenyl]benzoic acid http://purl.obolibrary.org/obo/CHEBI_28585 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28586 biolink:ChemicalEntity verbascose A pentasaccharide that is stachiose which has an additional unit of α-D-galactopyranose attached by a 1→6 glycosidic linkage to the terminal galactosyl residue. cas:546-62-3|kegg.compound:C08252|kegg.glycan:G00564|knapsack:C00001154|metacyc.compound:CPD-8065|pubmed:11675396|pubmed:22608234|reaxys:77323 Graph D-verbascose|beta-D-Fructofuranosyl O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-alpha-D-glucopyranoside|beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside D-verbascose|beta-D-Fructofuranosyl O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-alpha-D-glucopyranoside|beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-beta-D-Galp-(1->6)-alpha-D-Glcp-(1<->2)-beta-D-Fruf|beta-D-fructofuranosyl alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-galactopyranosyl-(1->6)-alpha-D-glucopyranoside http://purl.obolibrary.org/obo/CHEBI_28586 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28591 biolink:ChemicalEntity guaiacol A monomethoxybenzene that consists of phenol with a methoxy substituent at the ortho position. cas:90-05-1|drugcentral:1334|hmdb:HMDB0001398|kegg.compound:C01502|kegg.compound:C15572|kegg.drug:D00117|knapsack:C00002654|knapsack:C00029459|lincs.smallmolecule:LSM-6001|metacyc.compound:CPD-400|patent:RU94026717|pdb-ccd:JZ3|pubmed:22103597|pubmed:23587706|pubmed:24295708|reaxys:508112|wikipedia.en:Guaiacol Graph 1-Hydroxy-2-methoxybenzene|2-Hydroxyanisole|2-methoxyphenol|Catechol monomethyl ether|Guaiacol|guaiacol|o-Methoxyphenol 2-methoxyphenol 1-Hydroxy-2-methoxybenzene|2-Hydroxyanisole|2-methoxyphenol|Catechol monomethyl ether|Guaiacol|guaiacol|o-Methoxyphenol http://purl.obolibrary.org/obo/CHEBI_28591 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28592 biolink:ChemicalEntity ricinoleic acid A (9Z)-12-hydroxyoctadec-9-enoic acid in which the 12-hydroxy group has R-configuration.. cas:141-22-0|drugbank:DB02955|drugcentral:3527|kegg.compound:C08365|knapsack:C00001237|lipidmaps:LMFA01050233|pubmed:18080873|pubmed:19191319|pubmed:9675028|reaxys:1727811 Graph (9Z,12R)-12-hydroxyoctadec-9-enoic acid|(Z,R)-12-hydroxyoctadec-9-enoic acid|(cis,R)-12-hydroxyoctadec-9-enoic acid|12-Hydroxy-9-octadecenoic acid|12-Hydroxy-cis-9-octadecenoic acid|12-OH 9c-18:1|12-hydroxyoleic acid|Ricinoleic acid|Ricinolsaeure|ricinolic acid (9Z,12R)-12-hydroxyoctadec-9-enoic acid (9Z,12R)-12-hydroxyoctadec-9-enoic acid|(Z,R)-12-hydroxyoctadec-9-enoic acid|(cis,R)-12-hydroxyoctadec-9-enoic acid|12-Hydroxy-9-octadecenoic acid|12-Hydroxy-cis-9-octadecenoic acid|12-OH 9c-18:1|12-hydroxyoleic acid|Ricinoleic acid|Ricinolsaeure|ricinolic acid http://purl.obolibrary.org/obo/CHEBI_28592 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28593 biolink:ChemicalEntity quinidine A cinchona alkaloid consisting of cinchonine with the hydrogen at the 6-position of the quinoline ring substituted by methoxy. cas:56-54-2|drugbank:DB00908|drugcentral:2346|kegg.compound:C06527|kegg.drug:D08458|lincs.smallmolecule:LSM-3325|pubmed:12477351|pubmed:12699389|pubmed:14971904|pubmed:14973303|pubmed:15089813|pubmed:15225721|pubmed:15270556|pubmed:15328252|pubmed:16570918|pubmed:17132069|pubmed:17228875|pubmed:17249648|pubmed:17870541|pubmed:18324762|pubmed:18395298|pubmed:18788725|pubmed:23861085|pubmed:24130427|pubmed:445303|pubmed:8337232|pubmed:9864343|reaxys:91866 Graph (+)-Quinidine|(+)-quinidine|(8R,9S)-quinidine|(9S)-6'-methoxycinchonan-9-ol|(R)-(6-methoxyquinolin-4-yl)((3S,4R,7S)-3-vinylquinuclidin-7-yl)methanol|(S)-(6-Methoxy-quinolin-4-yl)-((2R,5R)-5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanol|(S)-(6-methoxyquinolin-4-yl)((2R,5R)-5-vinylquinuclidin-2-yl)methanol|6-methoxy-alpha-(5-vinyl-2-quinuclidinyl)-4-quinolinemethanol|CIN-QUIN|Chinidin|Conchinin|Kinidin|Quinidine|alpha-(6-methoxy-4-quinolyl)-5-vinyl-2-quinuclidinemethanol|beta-quinine|chinidinum|conquinine|pitayine|quinidina|quinidine (9S)-6'-methoxycinchonan-9-ol (+)-Quinidine|(+)-quinidine|(8R,9S)-quinidine|(9S)-6'-methoxycinchonan-9-ol|(R)-(6-methoxyquinolin-4-yl)((3S,4R,7S)-3-vinylquinuclidin-7-yl)methanol|(S)-(6-Methoxy-quinolin-4-yl)-((2R,5R)-5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanol|(S)-(6-methoxyquinolin-4-yl)((2R,5R)-5-vinylquinuclidin-2-yl)methanol|6-methoxy-alpha-(5-vinyl-2-quinuclidinyl)-4-quinolinemethanol|CIN-QUIN|Chinidin|Conchinin|Kinidin|Quinidine|alpha-(6-methoxy-4-quinolyl)-5-vinyl-2-quinuclidinemethanol|beta-quinine|chinidinum|conquinine|pitayine|quinidina|quinidine http://purl.obolibrary.org/obo/CHEBI_28593 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28599 biolink:ChemicalEntity siroheme cas:52553-42-1|drugbank:DB02832|kegg.compound:C00748|knapsack:C00007626|pdb-ccd:SRM|wikipedia.en:Siroheme Graph SIROHEME|Siroheme|[3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrayl-kappaN(21),kappaN(22),kappaN(23),kappaN(24)]tetrapropanoato(2-)]iron [3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrayl-kappaN(21),kappaN(22),kappaN(23),kappaN(24)]tetrapropanoato(2-)]iron SIROHEME|Siroheme|[3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrayl-kappaN(21),kappaN(22),kappaN(23),kappaN(24)]tetrapropanoato(2-)]iron http://purl.obolibrary.org/obo/CHEBI_28599 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28600 biolink:ChemicalEntity farnesol A farnesane sesquiterpenoid that is dodeca-2,6,10-triene substituted by methyl groups at positions 3, 7 and 11 and a hydroxy group at position 1. cas:4602-84-0|drugbank:DB02509|hmdb:HMDB0004305|kegg.compound:C01493|knapsack:C00003132|lincs.smallmolecule:LSM-5398|pubmed:17640272|pubmed:19402910|pubmed:23902158|pubmed:24987733|reaxys:1763926 Graph 3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|3,7,11-trimethyl-2,6,10-dodecatrienol|3,7,11-trimethyldodeca-2,6,10-trien-1-ol|Farnesol|farnesol|farnesyl alcohol 3,7,11-trimethyldodeca-2,6,10-trien-1-ol 3,7,11-trimethyl-2,6,10-dodecatrien-1-ol|3,7,11-trimethyl-2,6,10-dodecatrienol|3,7,11-trimethyldodeca-2,6,10-trien-1-ol|Farnesol|farnesol|farnesyl alcohol http://purl.obolibrary.org/obo/CHEBI_28600 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28602 biolink:ChemicalEntity beta-D-fructofuranose 2,6-bisphosphate A D-fructofuranose 2,6-bisphosphate with a β-configuration at the anomeric centre. cas:79082-92-1|hmdb:HMDB0001047|kegg.compound:C00665|knapsack:C00007441|pdb-ccd:FDP|reaxys:15436010|wikipedia.en:Fructose_2,6-bisphosphate Graph 2,6-di-O-phosphono-beta-D-fructofuranose|D-Fructose 2,6-bisphosphate|beta-D-fructofuranose 2,6-bis(dihydrogen phosphate) beta-D-fructofuranose 2,6-bis(dihydrogen phosphate) 2,6-di-O-phosphono-beta-D-fructofuranose|D-Fructose 2,6-bisphosphate|beta-D-fructofuranose 2,6-bis(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28602 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28607 biolink:ChemicalEntity coproporphyrinogen I beilstein:1208396|kegg.compound:C05768|pdb-ccd:1CP Graph 3,8,13,18-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropionic acid|COPROPORPHYRIN I|Coproporphyrinogen I 3,8,13,18-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid 3,8,13,18-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropionic acid|COPROPORPHYRIN I|Coproporphyrinogen I http://purl.obolibrary.org/obo/CHEBI_28607 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28609 biolink:ChemicalEntity N-benzoyl-4-methoxyanthranilic acid A member of the class of benzamides that results from the formal condensation of benzoic acid with the amino group of 4-methoxyanthranilic acid. kegg.compound:C04208|reaxys:6518079 Graph 2-(benzoylamino)-4-methoxybenzoic acid|2-benzamido-4-methoxybenzoic acid 2-benzamido-4-methoxybenzoic acid 2-(benzoylamino)-4-methoxybenzoic acid|2-benzamido-4-methoxybenzoic acid http://purl.obolibrary.org/obo/CHEBI_28609 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28616 biolink:ChemicalEntity carbamic acid A one-carbon compound that is ammonia in which one of the hydrogens is replaced by a carboxy group. Although carbamic acid derivatives are common, carbamic acid itself has never been synthesised. beilstein:1734754|cas:463-77-4|drugbank:DB04261|gmelin:130345|kegg.compound:C01563|pdb-ccd:OUT|wikipedia.en:Carbamic_acid Graph Aminoameisensaeure|Aminoformic acid|CARBAMIC ACID|Carbamate|Carbamic acid|Carbamidsaeure|carbamic acid CARBAMIC ACID|Carbamate|Carbamic acid|carbamic acid Aminoameisensaeure|Aminoformic acid|CARBAMIC ACID|Carbamate|Carbamic acid|Carbamidsaeure|carbamic acid http://purl.obolibrary.org/obo/CHEBI_28616 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28618 biolink:ChemicalEntity 1,4-dichlorobenzene A dichlorobenzene carrying chloro groups at positions 1 and 4. cas:106-46-7|gmelin:49722|hmdb:HMDB0041971|kegg.compound:C07092|patent:WO2010122925|pubmed:10817668|pubmed:17750169|pubmed:23899931|reaxys:1680023|umbbd.compound:c0593|wikipedia.en:1,4-Dichlorobenzene Graph 1,4-Dichlorobenzene|1,4-dichlorobenzene|PARA|PDCB|Paradichlorbenzol|p-Dichlorbenzol|p-Dichlorobenzene|p-chlorophenyl chloride|paradichlorobenzene 1,4-Dichlorobenzene|1,4-dichlorobenzene 1,4-Dichlorobenzene|1,4-dichlorobenzene|PARA|PDCB|Paradichlorbenzol|p-Dichlorbenzol|p-Dichlorobenzene|p-chlorophenyl chloride|paradichlorobenzene http://purl.obolibrary.org/obo/CHEBI_28618 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28619 biolink:ChemicalEntity acrylamide A member of the class of acrylamides that results from the formal condensation of acrylic acid with ammonia. cas:79-06-1|gmelin:81842|hmdb:HMDB0004296|kegg.compound:C01659|patent:US2535245|pubmed:10719038|pubmed:12166997|pubmed:15240786|pubmed:15901921|pubmed:17032038|pubmed:17234719|pubmed:17484107|pubmed:17558658|pubmed:17720246|pubmed:18469268|pubmed:19022940|pubmed:19846048|pubmed:22136129|pubmed:22784192|pubmed:7767980|reaxys:605349|umbbd.compound:c0149|wikipedia.en:Acrylamide Graph 2-Propenamide|Acrylamide|Akrylamid|acrylamide|ethylenecarboxamide|prop-2-enamide prop-2-enamide 2-Propenamide|Acrylamide|Akrylamid|acrylamide|ethylenecarboxamide|prop-2-enamide http://purl.obolibrary.org/obo/CHEBI_28619 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28623 biolink:ChemicalEntity campesterol cas:474-62-4|kegg.compound:C01789|knapsack:C00003647|lipidmaps:LMST01030097 Graph (24R)ergost-5-en-3beta-ol|Campesterol|campest-5-en-3beta-ol|campesterol campest-5-en-3beta-ol (24R)ergost-5-en-3beta-ol|Campesterol|campest-5-en-3beta-ol|campesterol http://purl.obolibrary.org/obo/CHEBI_28623 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28624 biolink:ChemicalEntity tetrahydrofolyl-poly(glutamic acid) macromolecule A tetrahydrofolyl glutamate consisting of a tetrahydrofolyl group linked via an amide bond to a poly(γ-glutamyl chain) kegg.compound:C03541 Graph N-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)carbonyl]poly(gamma-glutamyl)glutamic acid|THF-polyglutamate|Tetrahydrofolyl-[Glu](n)|Tetrahydrofolyl-[Glu](n+1)|Tetrahydropteroyl-[gamma-Glu]n|Tetrahydropteroyl-[gamma-Glu]n+1|tetrahydrofolyl-(Glu)n N-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)carbonyl]poly(gamma-glutamyl)glutamic acid N-[(4-{[(2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)carbonyl]poly(gamma-glutamyl)glutamic acid|THF-polyglutamate|Tetrahydrofolyl-[Glu](n)|Tetrahydrofolyl-[Glu](n+1)|Tetrahydropteroyl-[gamma-Glu]n|Tetrahydropteroyl-[gamma-Glu]n+1|tetrahydrofolyl-(Glu)n http://purl.obolibrary.org/obo/CHEBI_28624 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28626 biolink:ChemicalEntity 1H-indol-3-amine beilstein:114969|cas:56480-48-9|kegg.compound:C01819 Graph 1H-indol-3-amine|Indolamine|Indoleamine 1H-indol-3-amine 1H-indol-3-amine|Indolamine|Indoleamine http://purl.obolibrary.org/obo/CHEBI_28626 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28629 biolink:ChemicalEntity precorrin-8X The intermediate in the biosynthesis of vitamin B12 from uroporphyrinogen III in which eight methyl groups have been introduced into the tetrapyrrole framework, together with ring contraction and decarboxylation. cas:139663-56-2|kegg.compound:C06408 Graph (1R-(1alpha,2alpha,3beta,9beta,13alpha,17beta,18alpha,19beta))-2,13,18-tris(carboxymethyl)-4,5,6,7,8,11,12,22-octadehydro-4,5,6,9,10,11,21,22-octahydro-3,5,8,9,13,15,18,19-octamethyl-3,7,12,17-Corrintetrapropanoic acid|3,3',3'',3'''-[(1R,2S,3S,7S,8S,11S,17R,18R,19R)-2,7,18-tris(carboxymethyl)-1,2,5,7,11,12,15,17-octamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 8|Precorrin 8X 3,3',3'',3'''-[(1R,2S,3S,7S,8S,11S,17R,18R,19R)-2,7,18-tris(carboxymethyl)-1,2,5,7,11,12,15,17-octamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid (1R-(1alpha,2alpha,3beta,9beta,13alpha,17beta,18alpha,19beta))-2,13,18-tris(carboxymethyl)-4,5,6,7,8,11,12,22-octadehydro-4,5,6,9,10,11,21,22-octahydro-3,5,8,9,13,15,18,19-octamethyl-3,7,12,17-Corrintetrapropanoic acid|3,3',3'',3'''-[(1R,2S,3S,7S,8S,11S,17R,18R,19R)-2,7,18-tris(carboxymethyl)-1,2,5,7,11,12,15,17-octamethylcorrin-3,8,13,17-tetrayl]tetrapropanoic acid|Precorrin 8|Precorrin 8X http://purl.obolibrary.org/obo/CHEBI_28629 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28630 biolink:ChemicalEntity 3-hydroxypyridin-4(1H)-one beilstein:1524343|cas:1121-23-9|kegg.compound:C03927 Graph 3-Hydroxy-4(1H)-pyridinone|3-Hydroxy-4H-pyrid-4-one|3-Hydroxypyridin-4(1H)-one|3-hydroxy-4(1H)-pyridinone|3-hydroxy-4-pyridone|3-hydroxy-4H-pyrid-4-one|3-hydroxypyridin-4(1H)-one|3-hydroxypyridine-4-one 3-Hydroxypyridin-4(1H)-one|3-hydroxypyridin-4(1H)-one 3-Hydroxy-4(1H)-pyridinone|3-Hydroxy-4H-pyrid-4-one|3-Hydroxypyridin-4(1H)-one|3-hydroxy-4(1H)-pyridinone|3-hydroxy-4-pyridone|3-hydroxy-4H-pyrid-4-one|3-hydroxypyridin-4(1H)-one|3-hydroxypyridine-4-one http://purl.obolibrary.org/obo/CHEBI_28630 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28631 biolink:ChemicalEntity 3-phenylpropionic acid A monocarboxylic acid that is propionic acid substituted at position 3 by a phenyl group. cas:501-52-0|drugbank:DB02024|ecmdb:ECMDB00764|gmelin:102198|hmdb:HMDB0000764|kegg.compound:C05629|metacyc.compound:3-PHENYLPROPIONATE|pdb-ccd:HCI|pubmed:18062653|pubmed:20972783|pubmed:23470767|pubmed:24216280|reaxys:907515|wikipedia.en:Phenylpropanoic_acid Graph 3-Phenyl-propionic acid|3-Phenylpropanoic acid|3-Phenylpropionsaeure|3-phenylpropanoic acid|3-phenylpropionic acid|3PP|HYDROCINNAMIC ACID|Hydrozimtsaeure|Phenylpropanoate|benzenepropanoic acid|benzenepropionic acid|benzylacetic acid|beta-phenylpropionic acid|dihydrocinnamic acid 3-Phenylpropanoic acid|3-phenylpropanoic acid 3-Phenyl-propionic acid|3-Phenylpropanoic acid|3-Phenylpropionsaeure|3-phenylpropanoic acid|3-phenylpropionic acid|3PP|HYDROCINNAMIC ACID|Hydrozimtsaeure|Phenylpropanoate|benzenepropanoic acid|benzenepropionic acid|benzylacetic acid|beta-phenylpropionic acid|dihydrocinnamic acid http://purl.obolibrary.org/obo/CHEBI_28631 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28632 biolink:ChemicalEntity (S)-3-hydroxyoctanoyl-CoA A hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (S)-3-hydroxyoctanoic acid. hmdb:HMDB0003940|kegg.compound:C05266|lipidmaps:LMFA07050015 Graph (S)-3-Hydroxycapryloyl-CoA|(S)-3-Hydroxyoctanoyl-CoA|(S)-3-hydroxycapryloyl-coenzyme A|(S)-3-hydroxyoctanoyl-coenzyme A|(S)-Hydroxyoctanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (S)-3-Hydroxycapryloyl-CoA|(S)-3-Hydroxyoctanoyl-CoA|(S)-3-hydroxycapryloyl-coenzyme A|(S)-3-hydroxyoctanoyl-coenzyme A|(S)-Hydroxyoctanoyl-CoA|3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyoctanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} http://purl.obolibrary.org/obo/CHEBI_28632 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28635 biolink:ChemicalEntity 2-isopropylmalic acid A dicarboxylic acid that is malic acid (2-hydroxysuccinic acid) in which the hydrogen at position 2 is substituted by an isopropyl group. cas:3237-44-3|pubmed:17439666|pubmed:22770225|reaxys:1707897 Graph 2-hydroxy-2-(1-methylethyl)butanedioic acid|2-hydroxy-2-(propan-2-yl)butanedioic acid|2-hydroxy-2-isopropylsuccinic acid|3-carboxy-3-hydroxy-4-methylpentanoic acid|3-carboxy-3-hydroxyisocaproic acid|alpha-isopropylmalate|alpha-isopropylmalic acid 2-hydroxy-2-(propan-2-yl)butanedioic acid 2-hydroxy-2-(1-methylethyl)butanedioic acid|2-hydroxy-2-(propan-2-yl)butanedioic acid|2-hydroxy-2-isopropylsuccinic acid|3-carboxy-3-hydroxy-4-methylpentanoic acid|3-carboxy-3-hydroxyisocaproic acid|alpha-isopropylmalate|alpha-isopropylmalic acid http://purl.obolibrary.org/obo/CHEBI_28635 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28639 biolink:ChemicalEntity UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioic acid Graph UDP-Mur2Ac-L-Ala-gamma-D-Glu-A2pm|uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-oxo-1-{[(2S)-1-{[(1R)-4-{[(2S,6R)-6-aminoheptan-2-yl]amino}-1-carboxy-4-oxobutyl]amino}-1-oxopropan-2-yl]amino}propan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-oxo-1-{[(2S)-1-{[(1R)-4-{[(2S,6R)-6-aminoheptan-2-yl]amino}-1-carboxy-4-oxobutyl]amino}-1-oxopropan-2-yl]amino}propan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) UDP-Mur2Ac-L-Ala-gamma-D-Glu-A2pm|uridine 5'-(3-{2-acetamido-2-deoxy-3-O-[(2R)-1-oxo-1-{[(2S)-1-{[(1R)-4-{[(2S,6R)-6-aminoheptan-2-yl]amino}-1-carboxy-4-oxobutyl]amino}-1-oxopropan-2-yl]amino}propan-2-yl]-D-glucopyranosyl} dihydrogen diphosphate) http://purl.obolibrary.org/obo/CHEBI_28639 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28640 biolink:ChemicalEntity lipoteichoic acid A teichoic acid which is covalently bound to a lipid. pubmed:6083437|pubmed:9188087 Graph http://purl.obolibrary.org/obo/CHEBI_28640 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28645 biolink:ChemicalEntity beta-D-fructofuranose beilstein:1680732|cas:53188-23-1|kegg.compound:C02336|knapsack:C00001117|pdb-ccd:FRU Graph FRUCTOSE|beta-D-Fructose|beta-D-arabino-Hexulose|beta-D-fructofuranose|beta-D-fructose|beta-Fruit sugar|beta-Levulose FRUCTOSE|beta-D-fructofuranose FRUCTOSE|beta-D-Fructose|beta-D-arabino-Hexulose|beta-D-fructofuranose|beta-D-fructose|beta-Fruit sugar|beta-Levulose http://purl.obolibrary.org/obo/CHEBI_28645 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28646 biolink:ChemicalEntity ammeline beilstein:607753|cas:645-92-1|gmelin:240503|kegg.compound:C08733|umbbd.compound:c0171 Graph 2-Hydroxy-4,6-diamino-1,3,5-triazine|4,6-diamino-1,3,5-triazin-2-ol|Ammeline|ammeline 4,6-diamino-1,3,5-triazin-2-ol 2-Hydroxy-4,6-diamino-1,3,5-triazine|4,6-diamino-1,3,5-triazin-2-ol|Ammeline|ammeline http://purl.obolibrary.org/obo/CHEBI_28646 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28647 biolink:ChemicalEntity 3-O-methylgallic acid A member of the class of benzoic acids that is gallic acid in which the phenolic hydroxy group at position 3 is converted into the corresponding methyl ether. cas:3934-84-7|kegg.compound:C05616|reaxys:2695762 Graph 3,4-dihydroxy-5-methoxybenzoic acid|3-O-Methylgallic acid|4,5-Dihydroxy-m-anisic acid|gallic acid 3-methyl ether 3,4-dihydroxy-5-methoxybenzoic acid 3,4-dihydroxy-5-methoxybenzoic acid|3-O-Methylgallic acid|4,5-Dihydroxy-m-anisic acid|gallic acid 3-methyl ether http://purl.obolibrary.org/obo/CHEBI_28647 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28648 biolink:ChemicalEntity beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer A sialotriaosylceramide consisting of the pentasaccharide β-D-GalNAc-(1→4)-[α-Neu5Ac-(2→8)-α-Neu5Ac-(2→3)]-β-D-Gal-(1→4)-β-D-Glc attached to the primary hydroxy function of ceramide. kegg.compound:C06134|kegg.glycan:G00114|lipidmaps:LMSP0601AN00|pubmed:1371229|pubmed:1567198|pubmed:16341241|pubmed:1724444|pubmed:2448252|pubmed:25867522|pubmed:6204642|pubmed:7534889|pubmed:7691279|pubmed:9317004|wikipedia.en:GD2 Graph (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl]-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD2|GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|GalNAc-beta1->4(NeuAc-alpha2->8NeuAc2->3)Gal-beta1->4Glc-beta1->1'Cer|GalNAc-beta1->4(NeuAc-alpha2->8NeuAc2->3)LacCer|GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1'Cer|GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glc-Cer|beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|disialoganglioside GD2|ganglioside GD2 (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl]-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside (2S,3R,4E)-2-(acylamino)-3-hydroxyoctadec-4-en-1-yl 2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->8)-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl]-(2->3)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside|(Gal)1 (GalNAc)1 (Glc)1 (Neu5Ac)2 (Cer)1|GD2|GalNAc(beta1-4)[NeuAc(alpha2-8)NeuAc(alpha2-3)]Gal(beta1-4)Glc(beta1-1)Cer|GalNAc-beta1->4(NeuAc-alpha2->8NeuAc2->3)Gal-beta1->4Glc-beta1->1'Cer|GalNAc-beta1->4(NeuAc-alpha2->8NeuAc2->3)LacCer|GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta1-1'Cer|GalNAcbeta1->4(NeuAcalpha2->8NeuAcalpha2->3)Galbeta1->4Glc-Cer|beta-GalpNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Galp-(1->4)-beta-Glcp-(1<->1')-Cer|disialoganglioside GD2|ganglioside GD2 http://purl.obolibrary.org/obo/CHEBI_28648 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28654 biolink:ChemicalEntity 3-methyl-2-oxovalerate A 2-oxo monocarboxylic acid anion that is the conjugate base of 3-methyl-2-oxovaleric acid, arising from deprotonation of the carboxy group; major species at pH 7.3. hmdb:HMDB0000491|kegg.compound:C03465|reaxys:3904281 Graph 2-Oxo-3-methylpentanoate|2-Oxo-3-methylvalerate|2-keto-3-methylvalerate|3-Methyl-2-oxopentanoate|3-Methyl-2-oxovalerate|3-methyl-2-oxopentanoate|alpha-keto-beta-methylvalerate|alpha-oxo-beta-methylvalerate 3-methyl-2-oxopentanoate 2-Oxo-3-methylpentanoate|2-Oxo-3-methylvalerate|2-keto-3-methylvalerate|3-Methyl-2-oxopentanoate|3-Methyl-2-oxovalerate|3-methyl-2-oxopentanoate|alpha-keto-beta-methylvalerate|alpha-oxo-beta-methylvalerate http://purl.obolibrary.org/obo/CHEBI_28654 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28659 biolink:ChemicalEntity phosphorus atom cas:7723-14-0|gmelin:16235|kegg.compound:C06262|webelements:P Graph 15P|P|Phosphor|Phosphorus|fosforo|phosphore|phosphorus Phosphorus|phosphorus 15P|P|Phosphor|Phosphorus|fosforo|phosphore|phosphorus http://purl.obolibrary.org/obo/CHEBI_28659 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2866 biolink:ChemicalEntity ascaridole A p-menthane monoterpenoid that is p-menth-2-ene with a peroxy group across position 1 to 4. cas:512-85-6|hmdb:HMDB0035766|kegg.compound:C09836|knapsack:C00003027|pubmed:24184772|pubmed:24645715|reaxys:121382|wikipedia.en:Ascaridole Graph 1,4-epidioxy-p-menth-2-ene|1,4-peroxido-p-menthene-2|1,4-peroxy-p-menth-2-ene|1-isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-ene|1-methyl-4-(1-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene|4-methyl-1-(propan-2-yl)-2,3-dioxabicyclo[2.2.2]oct-5-ene|Ascaridole 4-methyl-1-(propan-2-yl)-2,3-dioxabicyclo[2.2.2]oct-5-ene 1,4-epidioxy-p-menth-2-ene|1,4-peroxido-p-menthene-2|1,4-peroxy-p-menth-2-ene|1-isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-ene|1-methyl-4-(1-methylethyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene|4-methyl-1-(propan-2-yl)-2,3-dioxabicyclo[2.2.2]oct-5-ene|Ascaridole http://purl.obolibrary.org/obo/CHEBI_2866 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28660 biolink:ChemicalEntity (-)-alpha-pinene cas:7785-26-4|kegg.compound:C06308 Graph (-)-alpha-Pinene|(-)-alpha-pinene|(1S)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-alpha-pinene|(1S,5S)-pin-2-ene (1S,5S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-pin-2-ene (-)-alpha-Pinene|(-)-alpha-pinene|(1S)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene|(1S,5S)-alpha-pinene|(1S,5S)-pin-2-ene http://purl.obolibrary.org/obo/CHEBI_28660 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28661 biolink:ChemicalEntity gamma-linolenic acid A C18, ω-6 acid fatty acid comprising a linolenic acid having cis- double bonds at positions 6, 9 and 12. cas:506-26-3|drugcentral:1276|hmdb:HMDB0003073|kegg.compound:C06426|kegg.drug:D07213|knapsack:C00001226|lipidmaps:LMFA01030141|metacyc.compound:CPD-8117|pubmed:11385052|pubmed:24435467|pubmed:9732298|reaxys:1712253|wikipedia.en:Gamma-Linolenic_acid Graph (6,9,12)-linolenic acid|(6Z,9Z,12Z)-Octadecatrienoic acid|(6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid|(Z,Z,Z)-6,9,12-octadecatrienoic acid|18:3 (n-6)|6,9,12-Octadecatrienoic acid|6-cis,9-cis,12-cis-octadecatrienoic acid|C18:3 (n-6)|C18:3, n-6,9,12 all-cis|GLA|Gamolenic acid|Octadeca-6,9,12-triensaeure|all-cis-6,9,12-octadecatrienoic acid|cis-Delta(6,9,12)-octadecatrienoic acid|gamma-Linolenic acid|gamma-Linolensaeure|gamoleic acid|gamolenic acid (6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid (6,9,12)-linolenic acid|(6Z,9Z,12Z)-Octadecatrienoic acid|(6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid|(Z,Z,Z)-6,9,12-octadecatrienoic acid|18:3 (n-6)|6,9,12-Octadecatrienoic acid|6-cis,9-cis,12-cis-octadecatrienoic acid|C18:3 (n-6)|C18:3, n-6,9,12 all-cis|GLA|Gamolenic acid|Octadeca-6,9,12-triensaeure|all-cis-6,9,12-octadecatrienoic acid|cis-Delta(6,9,12)-octadecatrienoic acid|gamma-Linolenic acid|gamma-Linolensaeure|gamoleic acid|gamolenic acid http://purl.obolibrary.org/obo/CHEBI_28661 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28663 biolink:ChemicalEntity galactitol 1-phosphate The 1-O-phospho derivative of galactitol. cas:15664-55-8|kegg.compound:C06311 Graph 1-O-phosphono-D-galactitol|D-Galactitol 1-phosphate|D-galactitol 1-(dihydrogen phosphate)|Galactitol 1-phosphate|L-Galactitol 6-phosphate D-Galactitol 1-phosphate|D-galactitol 1-(dihydrogen phosphate) 1-O-phosphono-D-galactitol|D-Galactitol 1-phosphate|D-galactitol 1-(dihydrogen phosphate)|Galactitol 1-phosphate|L-Galactitol 6-phosphate http://purl.obolibrary.org/obo/CHEBI_28663 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28666 biolink:ChemicalEntity leukotriene D4 A leukotriene that is (7E,9E,11Z,14Z)-icosa-7,9,11,14-tetraenoic acid substituted by a hydroxy group at position 5 (5S) and a L-cysteinylglycinyl group at position 6 (6R). cas:73836-78-9|hmdb:HMDB0003080|kegg.compound:C05951|lipidmaps:LMFA03020006|pubmed:23825762|pubmed:9160411|reaxys:4726738|wikipedia.en:Leukotriene_D4 Graph (R-(R*,S*-(E,E,Z,Z)))-N-(S-(1-(4-Carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)-L-cysteinyl)glycine|5S-hydroxy-6R-(S-cysteinylglycinyl)-7E,9E,11E,14Z-eicosatetraenoic acid|LTD4|Leukotriene D4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteinylglycine S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteinylglycine (R-(R*,S*-(E,E,Z,Z)))-N-(S-(1-(4-Carboxy-1-hydroxybutyl)-2,4,6,9-pentadecatetraenyl)-L-cysteinyl)glycine|5S-hydroxy-6R-(S-cysteinylglycinyl)-7E,9E,11E,14Z-eicosatetraenoic acid|LTD4|Leukotriene D4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]pentadeca-2,4,6,9-tetraen-1-yl}-L-cysteinylglycine http://purl.obolibrary.org/obo/CHEBI_28666 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28667 biolink:ChemicalEntity 11-dehydro-thromboxane B2 A thromboxane obtained by formal oxidation of the hemiacetal hydroxy function of thromboxane B2. cas:67910-12-7|hmdb:HMDB0004242|kegg.compound:C05964|lipidmaps:LMFA03030004|reaxys:5826438 Graph (5E)-7-[(2R,3S,4S)-4-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-6-oxooxan-3-yl]hept-5-enoic acid|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oic acid|11-Dehydro-thromboxane B2|11-Dehydro-txb2|11-DehydroTXB2|11-Dehydrothromboxane|11-Dehydrothromboxane B2|11-Keto-thromboxane B2|11-dehydro-TXB2 (5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oic acid (5E)-7-[(2R,3S,4S)-4-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-6-oxooxan-3-yl]hept-5-enoic acid|(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oic acid|11-Dehydro-thromboxane B2|11-Dehydro-txb2|11-DehydroTXB2|11-Dehydrothromboxane|11-Dehydrothromboxane B2|11-Keto-thromboxane B2|11-dehydro-TXB2 http://purl.obolibrary.org/obo/CHEBI_28667 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28669 biolink:ChemicalEntity bacitracin A mixture of at least nine closely related homodetic cyclic peptides produced by Bacillus subtilis and B. licheniformis, which is particularly active against Gram-positive bacteria. cas:1405-87-4|drugbank:DB00626|kegg.compound:C01667|kegg.drug:D00128|pubmed:22114686|wikipedia.en:Bacitracin Graph Baciim|Bacitracin|bacitracin|bacitracina|bacitracine|bacitracins|bacitracinum Baciim|Bacitracin|bacitracin|bacitracina|bacitracine|bacitracins|bacitracinum http://purl.obolibrary.org/obo/CHEBI_28669 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28670 biolink:ChemicalEntity neopterin wikipedia.en:Neopterin Graph 1-(2-amino-4-hydroxy-6-pteridinyl)-1,2,3-propanetriol|2-amino-6-(1,2,3-trihydroxypropyl)-4(3H)-pteridinone|2-amino-6-(1,2,3-trihydroxypropyl)pteridin-4(3H)-one|6-(1',2',3'-trihydroxy)pterin|neopterine 2-amino-6-(1,2,3-trihydroxypropyl)pteridin-4(3H)-one 1-(2-amino-4-hydroxy-6-pteridinyl)-1,2,3-propanetriol|2-amino-6-(1,2,3-trihydroxypropyl)-4(3H)-pteridinone|2-amino-6-(1,2,3-trihydroxypropyl)pteridin-4(3H)-one|6-(1',2',3'-trihydroxy)pterin|neopterine http://purl.obolibrary.org/obo/CHEBI_28670 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28675 biolink:ChemicalEntity dextrin Glucans produced by the hydrolysis of starch or glycogen. They are mixtures of polymers of D-glucose units linked by α(1→4) or α(1→6) glycosidic bonds. cas:9004-53-9|foodb.food:FDB012148|hmdb:HMDB0006857|kegg.compound:C00721|wikipedia.en:Dextrin Graph dextrine|dextrines|dextrins dextrine|dextrines|dextrins http://purl.obolibrary.org/obo/CHEBI_28675 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28680 biolink:ChemicalEntity cytarabine A pyrimidine nucleoside in which cytosine is attached to D-arabinofuranose via a β-N1-glycosidic bond. Used mainly in the treatment of leukaemia, especially acute non-lymphoblastic leukaemia, cytarabine is an antimetabolite antineoplastic agent that inhibits the synthesis of DNA. It also has antiviral and immunosuppressant properties. cas:147-94-4|drugbank:DB00987|drugcentral:770|hmdb:HMDB0015122|kegg.compound:C02961|kegg.drug:D00168|lincs.smallmolecule:LSM-5470|pdb-ccd:AR3|pubmed:15492802|reaxys:89175|wikipedia.en:Cytarabine Graph 1-beta-D-Arabinofuranosylcytosine|4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinone|4-amino-1-beta-D-arabinofuranosylpyrimidin-2(1H)-one|Arabinoside C|Cytarabine|Cytosine arabinoside|Cytosine-1-beta-D-arabinofuranoside|ara-C|arabinocytosine|citarabina|cytarabine|cytarabinum|cytosine-beta-D-arabinofuranoside 4-amino-1-beta-D-arabinofuranosylpyrimidin-2(1H)-one 1-beta-D-Arabinofuranosylcytosine|4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinone|4-amino-1-beta-D-arabinofuranosylpyrimidin-2(1H)-one|Arabinoside C|Cytarabine|Cytosine arabinoside|Cytosine-1-beta-D-arabinofuranoside|ara-C|arabinocytosine|citarabina|cytarabine|cytarabinum|cytosine-beta-D-arabinofuranoside http://purl.obolibrary.org/obo/CHEBI_28680 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28681 biolink:ChemicalEntity N,N'-diacetylchitobiose The N,N'-diacetylated derivative of chitobiose, but with no stereodesignation for the anomeric carbon atom. beilstein:1443239|cas:35061-50-8|glygen:G07982RO|glytoucan:G07982RO|kegg.compound:C01674|kegg.glycan:G10336|pubmed:20056550|pubmed:32568414 Graph 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-D-glucopyranose|Chitobiose|Diacetylchitobiose|N,N'-Diacetylchitobiose|N,N'-diacetylchitobiose 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-D-glucopyranose 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-D-glucopyranose|Chitobiose|Diacetylchitobiose|N,N'-Diacetylchitobiose|N,N'-diacetylchitobiose http://purl.obolibrary.org/obo/CHEBI_28681 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28683 biolink:ChemicalEntity kynurenine A ketone that is alanine in which one of the methyl hydrogens is substituted by a 2-aminobenzoyl group. cas:343-65-7|kegg.compound:C01718|pubmed:14651996|pubmed:16139256|pubmed:17386621|pubmed:19027117|pubmed:22770225|reaxys:2697333 Graph 2-amino-4-(2-aminophenyl)-4-oxobutanoic acid|Kynurenine 2-amino-4-(2-aminophenyl)-4-oxobutanoic acid 2-amino-4-(2-aminophenyl)-4-oxobutanoic acid|Kynurenine http://purl.obolibrary.org/obo/CHEBI_28683 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28684 biolink:ChemicalEntity 4-acetamidobutanoyl-CoA An acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of 4-acetamidobutanoic acid. kegg.compound:C03357|pubmed:6788773 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-acetamidobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Acetamidobutanoyl-CoA|4-acetamidobutanoyl-coenzyme A|4-acetamidobutyryl-CoA|4-acetamidobutyryl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-acetamidobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(4-acetamidobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|4-Acetamidobutanoyl-CoA|4-acetamidobutanoyl-coenzyme A|4-acetamidobutyryl-CoA|4-acetamidobutyryl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28684 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28685 biolink:ChemicalEntity molybdenum atom cas:7439-98-7|gmelin:16205|kegg.compound:C00150|webelements:Mo Graph 42Mo|Mo|Molybdaen|Molybdenum|molibdeno|molybdene|molybdenum Molybdenum|molybdenum 42Mo|Mo|Molybdaen|Molybdenum|molibdeno|molybdene|molybdenum http://purl.obolibrary.org/obo/CHEBI_28685 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28689 biolink:ChemicalEntity dehydroepiandrosterone An androstanoid that is androst-5-ene substituted by a β-hydroxy group at position 3 and an oxo group at position 17. It is a naturally occurring steroid hormone produced by the adrenal glands. cas:53-43-0|drugbank:DB01708|drugcentral:795|hmdb:HMDB0000077|kegg.compound:C01227|kegg.drug:D08409|lipidmaps:LMST02020021|metacyc.compound:3-BETA-HYDROXYANDROST-5-EN-17-ONE|pdb-ccd:AND|pubmed:14662261|pubmed:18634257|pubmed:24256992|pubmed:24424045|reaxys:2058110|wikipedia.en:Dehydroepiandrosterone Graph 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE|3-beta-hydroxyandrost-5-en-17-one|3beta-Hydroxyandrost-5-en-17-one|3beta-hydroxyandrost-5-en-17-one|DHA|DHEA|Dehydroepiandrosterone|Dehydroisoandrosterone|Intrarosa|Prasterone 3beta-Hydroxyandrost-5-en-17-one|3beta-hydroxyandrost-5-en-17-one 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE|3-beta-hydroxyandrost-5-en-17-one|3beta-Hydroxyandrost-5-en-17-one|3beta-hydroxyandrost-5-en-17-one|DHA|DHEA|Dehydroepiandrosterone|Dehydroisoandrosterone|Intrarosa|Prasterone http://purl.obolibrary.org/obo/CHEBI_28689 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28694 biolink:ChemicalEntity copper atom cas:7440-50-8|gmelin:16269|kegg.compound:C00070|webelements:Cu Graph 29Cu|Copper|Cu|Kupfer|cobre|copper|cuivre|cuprum Copper|copper 29Cu|Copper|Cu|Kupfer|cobre|copper|cuivre|cuprum http://purl.obolibrary.org/obo/CHEBI_28694 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28697 biolink:ChemicalEntity 21-deoxycortisol A deoxycortisol that is 17ξ-pregn-4-ene-3,20-dione substituted by a β-hydroxy group at position 11 and an α-hydroxy group at position 17. It is a marker of virilizing adrenal hyperplasia caused by 21-hydroxylase deficiency. cas:641-77-0|foodb.food:FDB023283|hmdb:HMDB0004030|kegg.compound:C05497|lipidmaps:LMST02030195|pubmed:10731638|pubmed:16551734|pubmed:17456574|pubmed:2531882|pubmed:2555382|pubmed:2614011|pubmed:2827419|pubmed:28499151|pubmed:28610588|pubmed:28774496|pubmed:2986404|pubmed:31450227|pubmed:3258316|pubmed:4372245|pubmed:6310249|pubmed:8055790|pubmed:845476|pubmed:8753277|wikipedia.en:21-Deoxycortisol Graph (1R,3aS,3bS,9aR,9bS,10S,11aS)-1-acetyl-1,10-dihydroxy-9a,11a-dimethyl-1,2,3,3a,3b,4,5,8,9,9a,9b,10,11,11a-tetradecahydro-7H-cyclopenta[a]phenanthren-7-one|11-beta,17-alpha-dihydroxypregn-4-ene-3,20-dione|11beta,17-dihydroxypregn-4-ene-3,20-dione|11beta,17-dihydroxyprogesterone|11beta,17alpha-dihydroxypregn-4-ene-3,20-dione|11beta,17alpha-dihydroxyprogesterone|21-deoxycortisol|4-pregnene-11beta,17alpha-diol-3,20-dione|pregn-4-ene-11beta,17alpha-diol-3,20-dione 11beta,17-dihydroxypregn-4-ene-3,20-dione (1R,3aS,3bS,9aR,9bS,10S,11aS)-1-acetyl-1,10-dihydroxy-9a,11a-dimethyl-1,2,3,3a,3b,4,5,8,9,9a,9b,10,11,11a-tetradecahydro-7H-cyclopenta[a]phenanthren-7-one|11-beta,17-alpha-dihydroxypregn-4-ene-3,20-dione|11beta,17-dihydroxypregn-4-ene-3,20-dione|11beta,17-dihydroxyprogesterone|11beta,17alpha-dihydroxypregn-4-ene-3,20-dione|11beta,17alpha-dihydroxyprogesterone|21-deoxycortisol|4-pregnene-11beta,17alpha-diol-3,20-dione|pregn-4-ene-11beta,17alpha-diol-3,20-dione http://purl.obolibrary.org/obo/CHEBI_28697 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28699 biolink:ChemicalEntity cyclic 2,3-bisphospho-D-glyceric acid cas:88280-54-0 Graph (6R)-2,4-dihydroxy-1,3,5,2,4-trioxadiphosphepane-6-carboxylic acid 2,4-dioxide|2,3-Cpp|2,3-Cyclopyrophosphoglycerate|Cycl dpg|Cyclic 2,3-bisphospho-D-glycerate|Cyclic 2,3-diphospho-D-glycerate|Cyclic glycerate-2,3P2|Cyclic-2,3-diphosphoglycerate|cDPG (6R)-2,4-dihydroxy-1,3,5,2,4-trioxadiphosphepane-6-carboxylic acid 2,4-dioxide (6R)-2,4-dihydroxy-1,3,5,2,4-trioxadiphosphepane-6-carboxylic acid 2,4-dioxide|2,3-Cpp|2,3-Cyclopyrophosphoglycerate|Cycl dpg|Cyclic 2,3-bisphospho-D-glycerate|Cyclic 2,3-diphospho-D-glycerate|Cyclic glycerate-2,3P2|Cyclic-2,3-diphosphoglycerate|cDPG http://purl.obolibrary.org/obo/CHEBI_28699 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28700 biolink:ChemicalEntity 20-hydroxy-leukotriene E4 cas:111844-33-8|kegg.compound:C03577|lipidmaps:LMFA03020025 Graph (5S,6R,7E,9E,11Z,14Z)-6-(cystein-S-yl)-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid|20-Hydroxy-leukotriene E4|20-OH-LTE4|20-OH-Leukotriene E4|20-hydroxy-leukotriene E4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]-15-hydroxypentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine (5S,6R,7E,9E,11Z,14Z)-6-(cystein-S-yl)-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]-15-hydroxypentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine (5S,6R,7E,9E,11Z,14Z)-6-(cystein-S-yl)-5,20-dihydroxyicosa-7,9,11,14-tetraenoic acid|20-Hydroxy-leukotriene E4|20-OH-LTE4|20-OH-Leukotriene E4|20-hydroxy-leukotriene E4|S-{(1R,2E,4E,6Z,9Z)-1-[(1S)-4-carboxy-1-hydroxybutyl]-15-hydroxypentadeca-2,4,6,9-tetraen-1-yl}-L-cysteine http://purl.obolibrary.org/obo/CHEBI_28700 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28701 biolink:ChemicalEntity chenodeoxycholoyl-CoA A choloyl-CoA formed by thioester linkage between chenodeoxycholic acid and coenzyme A. kegg.compound:C05337|pubmed:10817395|pubmed:10884298|pubmed:11673457|pubmed:2722825 Graph 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholanoyl-CoA|Chenodeoxycholoyl-CoA|chenodeoxycholoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|3alpha,7alpha-Dihydroxy-5beta-cholanoyl-CoA|Chenodeoxycholoyl-CoA|chenodeoxycholoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28701 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28706 biolink:ChemicalEntity trans-hex-2-enoyl-CoA An unsaturated fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans-hex-2-enoic acid. hmdb:HMDB0003944|kegg.compound:C05271|lipidmaps:LMFA07050019 Graph (2E)-Hexenoyl-CoA|(2E)-hexenoyl-coenzyme A|2E-hexenoyl-CoA|2E-hexenoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-hex-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|trans-2,3-dehydrohexanoyl-CoA|trans-2,3-dehydrohexanoyl-coenzyme A|trans-2-hexenoyl-coenzyme A|trans-Hex-2-enoyl-CoA|trans-hex-2-enoyl-coenzyme A 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-hex-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate} (2E)-Hexenoyl-CoA|(2E)-hexenoyl-coenzyme A|2E-hexenoyl-CoA|2E-hexenoyl-coenzyme A|3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-hex-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}|trans-2,3-dehydrohexanoyl-CoA|trans-2,3-dehydrohexanoyl-coenzyme A|trans-2-hexenoyl-coenzyme A|trans-Hex-2-enoyl-CoA|trans-hex-2-enoyl-coenzyme A http://purl.obolibrary.org/obo/CHEBI_28706 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28708 biolink:ChemicalEntity 3-isopropylcatechol A member of the class of catechols that is catechol in which one of the hydrogens that is ortho to a hydroxy group has been replaced by an isopropyl group. cas:2138-48-9|kegg.compound:C01014|metacyc.compound:CPD-14151|pubmed:7811094|pubmed:8899984|reaxys:2043545 Graph 1,2-dihydroxy-3-isopropyl benzene|3-(1-methylethyl)-1,2-benzenediol|3-isopropylbenzene-1,2-diol|3-isopropylcatechol|3-isopropylpyrocatechol 3-isopropylbenzene-1,2-diol 1,2-dihydroxy-3-isopropyl benzene|3-(1-methylethyl)-1,2-benzenediol|3-isopropylbenzene-1,2-diol|3-isopropylcatechol|3-isopropylpyrocatechol http://purl.obolibrary.org/obo/CHEBI_28708 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28714 biolink:ChemicalEntity S-butyl-DL-homocysteine (S,R)-sulfoximine A sulfoximide that is the sulfoximine derivative of an analogue of DL-methionine in which the S-methyl group is replaced by S-butyl. beilstein:236716|cas:5072-26-4|kegg.compound:C04543|lincs.smallmolecule:LSM-36606|pubmed:27008382|pubmed:27764704|pubmed:29127710|pubmed:31302132|pubmed:32965035|pubmed:34036678|wikipedia.en:Buthionine_sulfoximine Graph (2RS)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid|(2RS)-2-amino-4-(S-butylsulfonimidoyl)butyric acid|Buthionine sulfoximine|DL-butathionine-(S,R)-sulfoximine|DL-buthionine sulfoximine|S-butyl-DL-homocysteine-[S,R]-sulfoximine|buthionine sulfoximine|buthionine sulphoximine (2RS)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid (2RS)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid|(2RS)-2-amino-4-(S-butylsulfonimidoyl)butyric acid|Buthionine sulfoximine|DL-butathionine-(S,R)-sulfoximine|DL-buthionine sulfoximine|S-butyl-DL-homocysteine-[S,R]-sulfoximine|buthionine sulfoximine|buthionine sulphoximine http://purl.obolibrary.org/obo/CHEBI_28714 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28716 biolink:ChemicalEntity palmitoleic acid A hexadec-9-enoic acid in which the double bond at position C-9 has cis configuration. cas:373-49-9|drugbank:DB04257|hmdb:HMDB0003229|kegg.compound:C08362|knapsack:C00001234|knapsack:C00029354|lipidmaps:LMFA01030056|pdb-ccd:PAM|pubmed:19761868|pubmed:24362891|reaxys:1725389 Graph (9Z)-Hexadecenoic acid|(9Z)-hexadec-9-enoic acid|(Z)-9-hexadecenoic acid|(Z)-hexadec-9-enoic acid|16:1Delta9|9-cis-hexadecenoic acid|Oleopalmitic acid|PALMITOLEIC ACID|Palmitoleic acid|Zoomeric acid|cis-9-Hexadecenoic acid|cis-9-Palmitoleic acid|cis-Delta(9)-hexadecenoic acid|cis-Palmitoleic acid|cis-delta-9-Hexadecenoic acid|palmitolinoleic acid|zoomaric acid (9Z)-hexadec-9-enoic acid (9Z)-Hexadecenoic acid|(9Z)-hexadec-9-enoic acid|(Z)-9-hexadecenoic acid|(Z)-hexadec-9-enoic acid|16:1Delta9|9-cis-hexadecenoic acid|Oleopalmitic acid|PALMITOLEIC ACID|Palmitoleic acid|Zoomeric acid|cis-9-Hexadecenoic acid|cis-9-Palmitoleic acid|cis-Delta(9)-hexadecenoic acid|cis-Palmitoleic acid|cis-delta-9-Hexadecenoic acid|palmitolinoleic acid|zoomaric acid http://purl.obolibrary.org/obo/CHEBI_28716 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28718 biolink:ChemicalEntity L-allothreonine The L-enantiomer of allothreonine. cas:28954-12-3|hmdb:HMDB0004041|kegg.compound:C05519|pdb-ccd:ALO|pubmed:15726349|pubmed:17597243|pubmed:9151955|reaxys:1721645 Graph (2S,3S)-2-amino-3-hydroxybutanoic acid|ALLO-THREONINE|L-Allothreonine|L-allo-Threonine|L-allothreonine|allo-L-threonine L-Allothreonine|L-allothreonine (2S,3S)-2-amino-3-hydroxybutanoic acid|ALLO-THREONINE|L-Allothreonine|L-allo-Threonine|L-allothreonine|allo-L-threonine http://purl.obolibrary.org/obo/CHEBI_28718 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28719 biolink:ChemicalEntity 4-hydroxyphenylglyoxylic acid cas:15573-67-8|kegg.compound:C03590 Graph (4-hydroxyphenyl)(oxo)acetic acid|4-Hydroxybenzoylformate|4-Hydroxyphenylglyoxylate|4-Hydroxyphenylglyoxylic acid|4-hydroxybenzoylformate|4-hydroxyphenylglyoxylate|Pisolithin A (4-hydroxyphenyl)(oxo)acetic acid (4-hydroxyphenyl)(oxo)acetic acid|4-Hydroxybenzoylformate|4-Hydroxyphenylglyoxylate|4-Hydroxyphenylglyoxylic acid|4-hydroxybenzoylformate|4-hydroxyphenylglyoxylate|Pisolithin A http://purl.obolibrary.org/obo/CHEBI_28719 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28721 biolink:ChemicalEntity ribulose cas:488-84-6|cas:5556-48-9|kegg.compound:C05052|wikipedia.en:Ribulose Graph Ribulose|erythro-pent-2-ulose|ribulose Ribulose|erythro-pent-2-ulose|ribulose Ribulose|erythro-pent-2-ulose|ribulose http://purl.obolibrary.org/obo/CHEBI_28721 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28723 biolink:ChemicalEntity D-glycero-D-manno-heptose 7-phosphate D-glycero-D-manno-heptose in which the hydrogen of the primary hydroxy group is substituted by a dihydrogen phosphate group. beilstein:10187566|kegg.compound:C07836|knapsack:C00019574|pdb-ccd:M7P Graph 7-O-phosphono-D-glycero-D-manno-heptose|D-glycero-D-manno-Heptose 7-phosphate|D-glycero-D-manno-heptose 7-(dihydrogen phosphate) D-glycero-D-manno-heptose 7-(dihydrogen phosphate) 7-O-phosphono-D-glycero-D-manno-heptose|D-glycero-D-manno-Heptose 7-phosphate|D-glycero-D-manno-heptose 7-(dihydrogen phosphate) http://purl.obolibrary.org/obo/CHEBI_28723 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28724 biolink:ChemicalEntity 9,10-dihydroxyoctadecanoic acid A hydroxy-fatty acid formally derived from octacecanoic (stearic) acid by hydroxy substitution at positions 9 and 10. cas:120-87-6|gmelin:383116|lipidmaps:LMFA02000142|pubmed:15005144|reaxys:1728015 Graph 9,10-DHSA|9,10-Dihydroxystearinsaeure|9,10-diOH 18:0|9,10-diOH C18:0|9,10-dihydroxyoctadecanoic acid|9,10-dihydroxystearic acid|DHSA|Dioxystearinsaeure 9,10-dihydroxyoctadecanoic acid 9,10-DHSA|9,10-Dihydroxystearinsaeure|9,10-diOH 18:0|9,10-diOH C18:0|9,10-dihydroxyoctadecanoic acid|9,10-dihydroxystearic acid|DHSA|Dioxystearinsaeure http://purl.obolibrary.org/obo/CHEBI_28724 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28725 biolink:ChemicalEntity N(6')-acetylkanamycin Graph N(6')-acetylkanamycin|N(6')-acetylkanamycins N(6')-acetylkanamycin|N(6')-acetylkanamycins http://purl.obolibrary.org/obo/CHEBI_28725 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28726 biolink:ChemicalEntity 3-oxotetradecanoyl-CoA kegg.compound:C05261 Graph 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxotetradecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxotetradecanoyl-CoA|3-oxomyristoyl-CoA 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxotetradecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate} 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxotetradecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}|3-Oxotetradecanoyl-CoA|3-oxomyristoyl-CoA http://purl.obolibrary.org/obo/CHEBI_28726 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28728 biolink:ChemicalEntity thromboxane B2 A member of the class of thromboxanes B that is (5Z,13E)-thromboxa-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9, 11 and 15. cas:54397-85-2|hmdb:HMDB0003252|kegg.compound:C05963|lipidmaps:LMFA03030002|pubmed:24433337|pubmed:24786190|pubmed:7847191|reaxys:1399489|wikipedia.en:Thromboxane_B2 Graph (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid|TXB2|Thromboxane B2 (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid|TXB2|Thromboxane B2 http://purl.obolibrary.org/obo/CHEBI_28728 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28729 biolink:ChemicalEntity alpha-D-mannose D-Mannopyranose having α-configuration at the anomeric centre. cas:3458-28-4|cas:7296-15-3|drugbank:DB02944|glygen:G61491DK|glytoucan:G61491DK|gmelin:185283|kegg.compound:C00936|knapsack:C00001126|pdb-ccd:MAN|pubmed:19443021|pubmed:25568069|pubmed:31537530|reaxys:1281606 Graph ALPHA-D-MANNOSE|alpha-D-Man|alpha-D-Mannose|alpha-D-mannopyranose alpha-D-mannopyranose ALPHA-D-MANNOSE|alpha-D-Man|alpha-D-Mannose|alpha-D-mannopyranose http://purl.obolibrary.org/obo/CHEBI_28729 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2873 biolink:ChemicalEntity asiatic acid A pentacyclic triterpenoid that is ursane substituted by a carboxy group at position 28 and hydroxy groups at positions 2, 3 and 23 (the 2α,3β stereoisomer). It is isolated from Symplocos lancifolia and Vateria indica and exhibits anti-angiogenic activity. cas:464-92-6|kegg.compound:C08617|knapsack:C00003739|patent:JP2012092110|patent:TW200938215|pdb-ccd:0AS|pubmed:21265555|pubmed:21288041|pubmed:21561086|pubmed:23102509|reaxys:2712715 Graph (2alpha,3beta)-2,3,23-trihydroxyurs-12-en-28-oic acid|Asiatic acid (2alpha,3beta)-2,3,23-trihydroxyurs-12-en-28-oic acid (2alpha,3beta)-2,3,23-trihydroxyurs-12-en-28-oic acid|Asiatic acid http://purl.obolibrary.org/obo/CHEBI_2873 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28737 biolink:ChemicalEntity digalacturonate A carbohydrate acid anion resulting from the deprotonation of the carboxy groups of any digalacturonic acid. Graph http://purl.obolibrary.org/obo/CHEBI_28737 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28741 biolink:ChemicalEntity sodium fluoride A metal fluoride salt with a Na(+) counterion. cas:7681-49-4|kegg.compound:C08142|kegg.drug:D00943|wikipedia.en:Sodium_Fluoride Graph NaF|Sodium fluoride|sodium fluoride Sodium fluoride|sodium fluoride NaF|Sodium fluoride|sodium fluoride http://purl.obolibrary.org/obo/CHEBI_28741 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28747 biolink:ChemicalEntity picolinic acid A pyridinemonocarboxylic acid in which the carboxy group is located at position 2. It is an intermediate in the metabolism of tryptophan. cas:98-98-6|gmelin:3318|hmdb:HMDB0002243|kegg.compound:C10164|knapsack:C00002063|metacyc.compound:PICOLINATE|pdb-ccd:6PC|pubmed:15206716|pubmed:15206793|pubmed:15290459|pubmed:16303883|pubmed:23630570|pubmed:24119749|pubmed:7064867|pubmed:7969932|reaxys:109595|wikipedia.en:Picolinic_acid Graph 2-Picolinic acid|2-Pyridinecarboxylic acid|2-carboxypyridine|PYRIDINE-2-CARBOXYLIC ACID|Picolinic acid|alpha-picolinic acid|alpha-pyridinecarboxylic acid|o-pyridinecarboxylic acid|pyridine-2-carboxylic acid PYRIDINE-2-CARBOXYLIC ACID|pyridine-2-carboxylic acid 2-Picolinic acid|2-Pyridinecarboxylic acid|2-carboxypyridine|PYRIDINE-2-CARBOXYLIC ACID|Picolinic acid|alpha-picolinic acid|alpha-pyridinecarboxylic acid|o-pyridinecarboxylic acid|pyridine-2-carboxylic acid http://purl.obolibrary.org/obo/CHEBI_28747 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28748 biolink:ChemicalEntity doxorubicin cas:23214-92-8|drugbank:DB00997|drugcentral:960|kegg.compound:C01661|kegg.drug:D03899|lincs.smallmolecule:LSM-4062|lipidmaps:LMPK13050001|pdb-ccd:DM2 Graph (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|(1S,3S)-3-glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|(8S-cis)-10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione|14-hydroxydaunomycin|14-hydroxydaunorubicine|Adriamycin|DOXORUBICIN|Doxorubicin|doxorubicin|doxorubicine|doxorubicinum (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|(1S,3S)-3-glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside|(8S-cis)-10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione|14-hydroxydaunomycin|14-hydroxydaunorubicine|Adriamycin|DOXORUBICIN|Doxorubicin|doxorubicin|doxorubicine|doxorubicinum http://purl.obolibrary.org/obo/CHEBI_28748 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28749 biolink:ChemicalEntity aryl beta-D-glucoside kegg.compound:C03097 Graph Aryl beta-D-glucoside|aryl beta-D-glucoside|aryl beta-D-glucosides Aryl beta-D-glucoside|aryl beta-D-glucoside|aryl beta-D-glucosides http://purl.obolibrary.org/obo/CHEBI_28749 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28750 biolink:ChemicalEntity 17alpha-hydroxypregnenolone A hydroxypregnenolone carrying an α-hydroxy group at position 17. cas:387-79-1|hmdb:HMDB0000363|kegg.compound:C05138|lipidmaps:LMST02030089|metacyc.compound:CPD66-23|pubmed:12213889|pubmed:20963882|pubmed:21787799|pubmed:23647561|reaxys:2337329|wikipedia.en:17-Hydroxypregnenolone Graph (3beta)-3,17-dihydroxypregn-5-en-20-one|17-alpha-hydroxypregnenolone|17-hydroxypregnenolone|17alpha-Hydroxypregnenolone|3beta,17-dihydroxypregn-5-en-20-one|5-pregnen-3beta,17alpha-diol-20-one 3beta,17-dihydroxypregn-5-en-20-one (3beta)-3,17-dihydroxypregn-5-en-20-one|17-alpha-hydroxypregnenolone|17-hydroxypregnenolone|17alpha-Hydroxypregnenolone|3beta,17-dihydroxypregn-5-en-20-one|5-pregnen-3beta,17alpha-diol-20-one http://purl.obolibrary.org/obo/CHEBI_28750 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28751 biolink:ChemicalEntity biochanin A 7-O-beta-D-glucoside A glycosyloxyisoflavone that is biochanin A attached to a β-D-glucopyranosyl residue at position 7 via glycosidic linkage. agr:IND44720943|cas:5928-26-7|hmdb:HMDB0033990|kegg.compound:C05376|pubmed:16650770|pubmed:22926873|pubmed:23030687|pubmed:23397722|reaxys:1302649 Graph 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|Biochanin A 7-O-beta-D-glucoside|Biochanin A-beta-D-glucoside|Sissotrin|biochanin A 7-O-beta-D-glucoside|sissotrin 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|Biochanin A 7-O-beta-D-glucoside|Biochanin A-beta-D-glucoside|Sissotrin|biochanin A 7-O-beta-D-glucoside|sissotrin http://purl.obolibrary.org/obo/CHEBI_28751 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28755 biolink:ChemicalEntity 2,4,6-trichlorophenol A trichlorophenol with phenolic substituents on positions 2, 4 and 6. cas:88-06-2|gmelin:3766|kegg.compound:C07098|metacyc.compound:TRICHLOROPHENOL|pdb-ccd:T6C|pubmed:21863115|pubmed:22748215|pubmed:23995979|pubmed:24078273|reaxys:776729|umbbd.compound:c0330|wikipedia.en:2,4,6-Trichlorophenol Graph 1,3,5-Trichloro-2-hydroxybenzene|2,4,6-TCP|2,4,6-Trichlorophenol|2,4,6-trichlorophenol 2,4,6-Trichlorophenol|2,4,6-trichlorophenol 1,3,5-Trichloro-2-hydroxybenzene|2,4,6-TCP|2,4,6-Trichlorophenol|2,4,6-trichlorophenol http://purl.obolibrary.org/obo/CHEBI_28755 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28757 biolink:ChemicalEntity fructose A ketohexose that is an isomer of glucose. cas:30237-26-4|drugbank:DB04173|kegg.compound:C01496|wikipedia.en:Fructose Graph Fru|Fruchtzucker|Fructose|Fruktose|arabino-Hexulose|arabino-hex-2-ulose|fructose Fructose|arabino-hex-2-ulose|fructose Fru|Fruchtzucker|Fructose|Fruktose|arabino-Hexulose|arabino-hex-2-ulose|fructose http://purl.obolibrary.org/obo/CHEBI_28757 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28761 biolink:ChemicalEntity N-acetyl-D-galactosaminide kegg.compound:C02848 Graph N-Acetyl-D-galactosaminide|N-acetyl-D-galactosaminides N-Acetyl-D-galactosaminide|N-acetyl-D-galactosaminides http://purl.obolibrary.org/obo/CHEBI_28761 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28763 biolink:ChemicalEntity 4,4'-dichlorodiphenylmethane A chlorophenylmethane that is methane in which two of the hydrogens have been replaced by p-chlorophenyl groups. beilstein:1873121|cas:101-76-8|gmelin:1851655|kegg.compound:C06641|umbbd.compound:c0503 Graph 1,1'-methylenebis(4-chlorobenzene)|1-chloro-4-(4-chlorobenzyl)benzene|4,4'-dichlorodiphenylmethane|Bis(4'-chlorophenyl)methane|DDM|bis(4-chlorophenyl)methane|bis(p-chlorophenyl)methane|bis-(4-chlorophenyl)-methane|di(4-chlorophenyl)methane|di(p-chlorophenyl)methane|p,p'-dichlorodiphenylmethane 1,1'-methylenebis(4-chlorobenzene) 1,1'-methylenebis(4-chlorobenzene)|1-chloro-4-(4-chlorobenzyl)benzene|4,4'-dichlorodiphenylmethane|Bis(4'-chlorophenyl)methane|DDM|bis(4-chlorophenyl)methane|bis(p-chlorophenyl)methane|bis-(4-chlorophenyl)-methane|di(4-chlorophenyl)methane|di(p-chlorophenyl)methane|p,p'-dichlorodiphenylmethane http://purl.obolibrary.org/obo/CHEBI_28763 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28765 biolink:ChemicalEntity phosphatidylinositol phosphate Any member of the phosphoinositide family of compounds, of which seven occur naturally. pubmed:16441841|pubmed:2538726 Graph phosphatidylinositol phosphates phosphatidylinositol phosphates http://purl.obolibrary.org/obo/CHEBI_28765 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28766 biolink:ChemicalEntity uroporphyrinogen I beilstein:605191|cas:1867-62-5|kegg.compound:C05766|metacyc.compound:CPD-11444|pubmed:17345569|pubmed:6724109|pubmed:9019298 Graph 3,8,13,18-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropionic acid|Uroporphyrinogen I|uro'gen I|uroporphyrinogen-I 3,8,13,18-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid 3,8,13,18-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropanoic acid|3,8,13,18-tetrakis(carboxymethyl)-5,10,15,20,22,24-hexahydroporphyrin-2,7,12,17-tetrapropionic acid|Uroporphyrinogen I|uro'gen I|uroporphyrinogen-I http://purl.obolibrary.org/obo/CHEBI_28766 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28768 biolink:ChemicalEntity p-cymene A monoterpene that is toluene substituted by an isopropyl group at position 4. bpdb:2018|cas:99-87-6|gmelin:305912|hmdb:HMDB0005805|kegg.compound:C06575|knapsack:C00003040|lipidmaps:LMPR0102090014|metacyc.compound:CPD-1001|pubmed:11341314|pubmed:15508832|pubmed:17826989|pubmed:19040104|pubmed:24023812|pubmed:24421258|reaxys:1903377|umbbd.compound:c0375|wikipedia.en:P-cymene Graph 1-isopropyl-4-methylbenzene|1-methyl-4-(1-methylethyl)benzene|1-methyl-4-(propan-2-yl)benzene|1-methyl-4-isopropylbenzene|4-Isopropyl-1-methylbenzene|4-Isopropyltoluene|4-Methyl-1-isopropylbenzene|4-cymene|4-methyl-1-(propan-2-yl)benzene|Cymene|Isopropyltoluene|Para-cymene|p-Cymene|p-cimene|p-cymene|p-cymol|p-isopropyltoluene|p-methylcumene|p-methylisopropylbenzene 4-methyl-1-(propan-2-yl)benzene 1-isopropyl-4-methylbenzene|1-methyl-4-(1-methylethyl)benzene|1-methyl-4-(propan-2-yl)benzene|1-methyl-4-isopropylbenzene|4-Isopropyl-1-methylbenzene|4-Isopropyltoluene|4-Methyl-1-isopropylbenzene|4-cymene|4-methyl-1-(propan-2-yl)benzene|Cymene|Isopropyltoluene|Para-cymene|p-Cymene|p-cimene|p-cymene|p-cymol|p-isopropyltoluene|p-methylcumene|p-methylisopropylbenzene http://purl.obolibrary.org/obo/CHEBI_28768 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2877 biolink:ChemicalEntity aspartame A dipeptide obtained by formal condensation of the α-carboxy group of L-aspartic acid with the amino group of methyl L-phenylalaninate. Commonly used as an artificial sweetener. cas:22839-47-0|drugbank:DB00168|hmdb:HMDB0001894|kegg.compound:C11045|kegg.drug:D02381|patent:US3492131|pdb-ccd:PME|pubmed:1771173|pubmed:2013754|pubmed:21150094|pubmed:21372000|pubmed:22354473|pubmed:24355796|pubmed:24925367|pubmed:24944748|pubmed:24965331|pubmed:25431414|pubmed:25543075|pubmed:25786106|pubmed:25951455|pubmed:25991916|pubmed:26015492|pubmed:26099025|pubmed:26159964|pubmed:26247507|pubmed:26308194|pubmed:26321723|pubmed:26377607|pubmed:26582819|pubmed:26593524|pubmed:26912665|pubmed:27015640|pubmed:27038223|pubmed:27088715|pubmed:27127997|pubmed:27216413|pubmed:27298583|pubmed:27492574|pubmed:27565676|pubmed:27614095|pubmed:27640132|pubmed:27699780|pubmed:27728881|pubmed:27840415|pubmed:27845306|pubmed:30000570|pubmed:37291632|pubmed:37297402|pubmed:37454665|reaxys:2223850|wikipedia.en:Aspartame Graph 1-methyl N-L-alpha-aspartyl-L-phenylalanate|3-Amino-N-(alpha-carboxyphenethyl)succinamic acid N-methyl ester|3-Amino-N-(alpha-methoxycarbonylphenethyl) succinamic acid|AminoSweet|Asp-phe-ome|Aspartame|Aspartylphenylalanine methyl ester|E 951|L-Aspartyl-L-phenylalanine methyl ester|NutraSweet|Sanecta|aspartam|aspartamo|aspartamum|methyl L-alpha-aspartyl-L-phenylalaninate methyl L-alpha-aspartyl-L-phenylalaninate 1-methyl N-L-alpha-aspartyl-L-phenylalanate|3-Amino-N-(alpha-carboxyphenethyl)succinamic acid N-methyl ester|3-Amino-N-(alpha-methoxycarbonylphenethyl) succinamic acid|AminoSweet|Asp-phe-ome|Aspartame|Aspartylphenylalanine methyl ester|E 951|L-Aspartyl-L-phenylalanine methyl ester|NutraSweet|Sanecta|aspartam|aspartamo|aspartamum|methyl L-alpha-aspartyl-L-phenylalaninate http://purl.obolibrary.org/obo/CHEBI_2877 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28770 biolink:ChemicalEntity norlaudanosoline beilstein:313061|cas:4747-99-3|kegg.compound:C06350 Graph (R,S)-Norlaudanosoline|1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|Norlaudanosoline|Tetrahydropapaveroline 1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol (R,S)-Norlaudanosoline|1-(3,4-dihydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol|Norlaudanosoline|Tetrahydropapaveroline http://purl.obolibrary.org/obo/CHEBI_28770 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28774 biolink:ChemicalEntity 3,3',5'-triiodothyronine beilstein:2823534|kegg.compound:C07639 Graph 3,3',5'-Triiodothyronine|3,3',5'-triiodothyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenylalanine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodotyrosine|Reverse triiodothyronine|Triiodothyronine, reverse 3,3',5'-Triiodothyronine|3,3',5'-triiodothyronine 3,3',5'-Triiodothyronine|3,3',5'-triiodothyronine|4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenylalanine|O-(4-hydroxy-3,5-diiodophenyl)-3-iodotyrosine|Reverse triiodothyronine|Triiodothyronine, reverse http://purl.obolibrary.org/obo/CHEBI_28774 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28776 biolink:ChemicalEntity gamma-glutamyl-Se-methylselenocysteine A dipeptide obtained by formal condensation of the γ-carboxy group of glutamic acid with the amino group of Se-methylselenocysteine. foodb.food:FDB027866|hmdb:HMDB0010716|kegg.compound:C05695|pubmed:10888499|pubmed:11306469|pubmed:14745183|pubmed:16161771|pubmed:16435092|pubmed:18320173|pubmed:20005330|pubmed:9570912 Graph 5-glutamyl-Se-methylselenocysteine|gamma-glutamyl-3-(methylselanyl)alanine|gamma-glutamyl-Se-methylselenocysteine|gamma-glutamyl-SeMC gamma-glutamyl-3-(methylselanyl)alanine 5-glutamyl-Se-methylselenocysteine|gamma-glutamyl-3-(methylselanyl)alanine|gamma-glutamyl-Se-methylselenocysteine|gamma-glutamyl-SeMC http://purl.obolibrary.org/obo/CHEBI_28776 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28777 biolink:ChemicalEntity liquiritigenin A dihydroxyflavanone compound having the two hydroxy substituents at the 4'- and 7-positions. Isolated from the root of Glycyrrhizae uralensis, it is a selective agonist for oestrogen receptor β. cas:578-86-9|hmdb:HMDB0029519|kegg.compound:C09762|knapsack:C00000977|lipidmaps:LMPK12140061|pdb-ccd:DFV|pubmed:17950610|pubmed:18177995|pubmed:21866899|reaxys:3593780|wikipedia.en:Liquiritigenin Graph (-)-liquiritigenin|(2S)-7-Hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one|(2S)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-liquiritigenin|4',7-Dihydroxyflavanone|7,4'-Dihydroxyflavanone|7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE|Liquiritigenin (2S)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one (-)-liquiritigenin|(2S)-7-Hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one|(2S)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one|(2S)-liquiritigenin|4',7-Dihydroxyflavanone|7,4'-Dihydroxyflavanone|7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE|Liquiritigenin http://purl.obolibrary.org/obo/CHEBI_28777 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28783 biolink:ChemicalEntity zinc protoporphyrin beilstein:4932319|beilstein:8184206|cas:15442-64-5|drugbank:DB03934|gmelin:403138|kegg.compound:C03184|pdb-ccd:ZNH Graph (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)zinc(II)|(protoporphyrinato)zinc(II)|PROTOPORPHYRIN IX CONTAINING ZN|ZPP|Zinc protoporphyrin|Zinc protoporphyrin-9|Zn(ppIX)|[Zn(ppIX)]|zinc-protoporphyrin IX (protoporphyrinato)zinc(II) (7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-dipropanoato)zinc(II)|(protoporphyrinato)zinc(II)|PROTOPORPHYRIN IX CONTAINING ZN|ZPP|Zinc protoporphyrin|Zinc protoporphyrin-9|Zn(ppIX)|[Zn(ppIX)]|zinc-protoporphyrin IX http://purl.obolibrary.org/obo/CHEBI_28783 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28785 biolink:ChemicalEntity (+)-ureidoglycolic acid cas:103192-53-6|kegg.compound:C02766|knapsack:C00007465 Graph (+)-Ureidoglycolate|(+)-ureidoglycolate|(2R)-(carbamoylamino)(hydroxy)acetic acid|(R)-Ureidoglycolate (2R)-(carbamoylamino)(hydroxy)acetic acid (+)-Ureidoglycolate|(+)-ureidoglycolate|(2R)-(carbamoylamino)(hydroxy)acetic acid|(R)-Ureidoglycolate http://purl.obolibrary.org/obo/CHEBI_28785 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28787 biolink:ChemicalEntity nitroglycerin A nitroglycerol that is glycerol in which the hydrogen atoms of all three hydroxy groups are replaced by nitro groups. It acts as a prodrug, releasing nitric oxide to open blood vessels and so alleviate heart pain. cas:55-63-0|drugbank:DB00727|drugcentral:1952|gmelin:165859|kegg.compound:C07455|kegg.drug:D00515|pubmed:11016328|pubmed:11470751|pubmed:11943517|pubmed:22040938|pubmed:22675243|pubmed:23205544|pubmed:23301717|pubmed:9492718|reaxys:1802063|umbbd.compound:c0061|wikipedia.en:Glyceryl_trinitrate_(pharmacology)|wikipedia.en:Nitroglycerin Graph 1,2,3-propanetrioltrinitrate|1,2,3-propanetriyl nitrate|1,2,3-trinitrooxypropane|Glyceryl trinitrate|Minitran|NG|Natispray|Nitro-Dur|Nitroglycerin|Nitrolingual|Nitromist|Nitrostat|Rectogesic|Transderm Nitro|glycerin trinitrate|glycerol trinitrate|glycerol, nitric acid triester|nitroglycerin|nitroglycerine|nitroglycerol|propane-1,2,3-triyl trinitrate|trinitroglycerin|trinitroglycerol 1,2,3-trinitrooxypropane 1,2,3-propanetrioltrinitrate|1,2,3-propanetriyl nitrate|1,2,3-trinitrooxypropane|Glyceryl trinitrate|Minitran|NG|Natispray|Nitro-Dur|Nitroglycerin|Nitrolingual|Nitromist|Nitrostat|Rectogesic|Transderm Nitro|glycerin trinitrate|glycerol trinitrate|glycerol, nitric acid triester|nitroglycerin|nitroglycerine|nitroglycerol|propane-1,2,3-triyl trinitrate|trinitroglycerin|trinitroglycerol http://purl.obolibrary.org/obo/CHEBI_28787 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28788 biolink:ChemicalEntity quinoline-3,4-diol kegg.compound:C06330 Graph 3,4-Dihydroxyquinoline|3,4-dihydroxyquinoline|Quinoline-3,4-diol|quinoline-3,4-diol Quinoline-3,4-diol|quinoline-3,4-diol 3,4-Dihydroxyquinoline|3,4-dihydroxyquinoline|Quinoline-3,4-diol|quinoline-3,4-diol http://purl.obolibrary.org/obo/CHEBI_28788 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28789 biolink:ChemicalEntity L-glucitol The L-enantiomer of glucitol. cas:6706-59-8|ecmdb:ECMDB00247|gmelin:648560|kegg.compound:C01722|metacyc.compound:CPD-12810|pubmed:19695255|reaxys:1721906|ymdb:YMDB00724 Graph (2R,3S,4S,5S)-hexane-1,2,3,4,5,6-hexol|D-Gulitol|D-gulitol|L-Glucitol|L-Sorbitol|L-glucitol|L-sorbitol L-Glucitol|L-glucitol (2R,3S,4S,5S)-hexane-1,2,3,4,5,6-hexol|D-Gulitol|D-gulitol|L-Glucitol|L-Sorbitol|L-glucitol|L-sorbitol http://purl.obolibrary.org/obo/CHEBI_28789 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28790 biolink:ChemicalEntity serotonin A primary amino compound that is the 5-hydroxy derivative of tryptamine. cas:50-67-9|gmelin:1861995|hmdb:HMDB0000259|kegg.compound:C00780|knapsack:C00001429|lincs.smallmolecule:LSM-6589|metacyc.compound:SEROTONIN|pdb-ccd:SRO|pubmed:18593914|pubmed:22770225|pubmed:24136337|reaxys:143524|wikipedia.en:Serotonin Graph 3-(2-Aminoethyl)-1H-indol-5-ol|3-(2-aminoethyl)-1H-indol-5-ol|5-HT|5-Hydroxytryptamine|Enteramine|SEROTONIN|Serotonin|serotonine|thrombocytin|thrombotonin 3-(2-Aminoethyl)-1H-indol-5-ol|3-(2-aminoethyl)-1H-indol-5-ol 3-(2-Aminoethyl)-1H-indol-5-ol|3-(2-aminoethyl)-1H-indol-5-ol|5-HT|5-Hydroxytryptamine|Enteramine|SEROTONIN|Serotonin|serotonine|thrombocytin|thrombotonin http://purl.obolibrary.org/obo/CHEBI_28790 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28792 biolink:ChemicalEntity erucic acid A docosenoic acid having a cis- double bond at C-13. It is found particularly in brassicas - it is a major component of mustard and rapeseed oils and is produced by broccoli, Brussels sprouts, kale, and wallflowers. cas:112-86-7|gmelin:177365|hmdb:HMDB0002068|kegg.compound:C08316|knapsack:C00001217|lipidmaps:LMFA01030089|metacyc.compound:CPD-14292|pubmed:1170010|pubmed:7847331|reaxys:1728049|wikipedia.en:Erucic_acid Graph (13Z)-13-docosenoic acid|(13Z)-Docosenoic acid|(13Z)-docos-13-enoic acid|(Z)-13-docosenoic acid|(Z)-docos-13-enoic acid|13-cis-docosenoic acid|22:1omega9|C22:1n-9|Erucasaeure|Erucic acid|cis-13-Docosenoic acid|cis-Delta(13)-docosenoic acid|cis-eruic acid|docos-13c-enoic acid (13Z)-docos-13-enoic acid (13Z)-13-docosenoic acid|(13Z)-Docosenoic acid|(13Z)-docos-13-enoic acid|(Z)-13-docosenoic acid|(Z)-docos-13-enoic acid|13-cis-docosenoic acid|22:1omega9|C22:1n-9|Erucasaeure|Erucic acid|cis-13-Docosenoic acid|cis-Delta(13)-docosenoic acid|cis-eruic acid|docos-13c-enoic acid http://purl.obolibrary.org/obo/CHEBI_28792 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28793 biolink:ChemicalEntity beta-D-glucan cas:9041-22-9|kegg.compound:C00551 Graph beta-D-Glucan|beta-D-glucans|beta-Glucan beta-D-Glucan|beta-D-glucans|beta-Glucan http://purl.obolibrary.org/obo/CHEBI_28793 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28794 biolink:ChemicalEntity coumarin A chromenone having the keto group located at the 2-position. cas:91-64-5|drugbank:DB04665|drugcentral:738|gmelin:165222|hmdb:HMDB0001218|kegg.compound:C05851|kegg.drug:D07751|knapsack:C00002460|lincs.smallmolecule:LSM-2519|metacyc.compound:COUMARIN|pdb-ccd:COU|pubmed:16086027|pubmed:16822524|pubmed:17988284|pubmed:19025869|pubmed:20206186|pubmed:21046436|pubmed:21462332|pubmed:21798343|pubmed:28166217|pubmed:8735869|reaxys:383644|wikipedia.en:Coumarin Graph 1,2-Benzopyrone|2-Propenoic acid, 3-(2-hydroxyphenyl)-, d-lactone|2-Propenoic acid, 3-(2-hydroxyphenyl)-, delta-lactone|2H-1-Benzopyran-2-one|2H-benzo[b]pyran-2-one|2H-chromen-2-one|5,6-Benzo-2-pyrone|Benzo-a-pyrone|Benzo-alpha-pyrone|Coumarine|Coumarinic anhydride|Cumarin|Rattex|Tonka bean camphor|cis-o-Coumarinic acid lactone|o-Hydroxycinnamic acid lactone|o-hydroxycinnamic acid delta-lactone 2H-chromen-2-one 1,2-Benzopyrone|2-Propenoic acid, 3-(2-hydroxyphenyl)-, d-lactone|2-Propenoic acid, 3-(2-hydroxyphenyl)-, delta-lactone|2H-1-Benzopyran-2-one|2H-benzo[b]pyran-2-one|2H-chromen-2-one|5,6-Benzo-2-pyrone|Benzo-a-pyrone|Benzo-alpha-pyrone|Coumarine|Coumarinic anhydride|Cumarin|Rattex|Tonka bean camphor|cis-o-Coumarinic acid lactone|o-Hydroxycinnamic acid lactone|o-hydroxycinnamic acid delta-lactone http://purl.obolibrary.org/obo/CHEBI_28794 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28796 biolink:ChemicalEntity fructan Polysaccharides composed of fructose residues. cas:9013-95-0|kegg.compound:C01355|kegg.compound:C06215|kegg.glycan:G10499|kegg.glycan:G10535 Graph (2,6-beta-D-Fructosyl)n|(2,6-beta-D-Fructosyl)n+1|2,6-beta-D-Fructan|Fructan|Levan|Levan n|beta-D-Fructan|fructan|fructans|polyfructose Fructan|fructan (2,6-beta-D-Fructosyl)n|(2,6-beta-D-Fructosyl)n+1|2,6-beta-D-Fructan|Fructan|Levan|Levan n|beta-D-Fructan|fructan|fructans|polyfructose http://purl.obolibrary.org/obo/CHEBI_28796 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28797 biolink:ChemicalEntity D-alpha-aminobutyric acid An optically active form of α-aminobutyric acid having D-configuration. cas:2623-91-8|drugbank:DB04454|gmelin:984641|hmdb:HMDB0000650|kegg.compound:C02261|lipidmaps:LMFA01100043|metacyc.compound:CPD0-1952|pdb-ccd:DBB|pubmed:23407|pubmed:6110424|pubmed:6148943|reaxys:1720934 Graph (2R)-2-aminobutanoic acid|(2R)-2-aminobutyric acid|(R)-2-Aminobutanoic acid|(R)-2-aminobutyric acid|D-(-)-2-aminobutyric acid|D-2-Aminobutanoic acid|D-2-Aminobuttersaeure|D-2-Aminobutyrate|D-2-Aminobutyric acid|alpha-aminobutyric acid (2R)-2-aminobutanoic acid (2R)-2-aminobutanoic acid|(2R)-2-aminobutyric acid|(R)-2-Aminobutanoic acid|(R)-2-aminobutyric acid|D-(-)-2-aminobutyric acid|D-2-Aminobutanoic acid|D-2-Aminobuttersaeure|D-2-Aminobutyrate|D-2-Aminobutyric acid|alpha-aminobutyric acid http://purl.obolibrary.org/obo/CHEBI_28797 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28800 biolink:ChemicalEntity N-acetylgalactosamine cas:1811-31-0|kegg.compound:C01074 Graph 2-Acetamido-2-deoxygalactose|2-acetamido-2-deoxygalactose|GalNAc|N-Acetylchondrosamine|N-Acetylgalactosamine 2-Acetamido-2-deoxygalactose|2-acetamido-2-deoxygalactose 2-Acetamido-2-deoxygalactose|2-acetamido-2-deoxygalactose|GalNAc|N-Acetylchondrosamine|N-Acetylgalactosamine http://purl.obolibrary.org/obo/CHEBI_28800 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28802 biolink:ChemicalEntity flavonols Any hydroxyflavone in which is the ring hydrogen at position 3 of the heterocyclic ring is replaced by a hydroxy group. metacyc.compound:Flavonols|wikipedia.en:Flavonol Graph 3-hydroxyflavones|a flavonol 3-hydroxyflavones|a flavonol http://purl.obolibrary.org/obo/CHEBI_28802 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28803 biolink:ChemicalEntity pyridoxine 5'-phosphate beilstein:233737|cas:447-05-2|drugbank:DB02209|kegg.compound:C00627|knapsack:C00007505|pdb-ccd:PXP Graph PYRIDOXINE-5'-PHOSPHATE|Pyridoxine 5'-phosphate|Pyridoxine 5-phosphate|Pyridoxine phosphate|Pyridoxol 5'-phosphate|[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl dihydrogen phosphate|pyridoxine 5'-(dihydrogen phosphate)|pyridoxol 5-phosphate|pyridoxyl-5-phosphate [5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl dihydrogen phosphate PYRIDOXINE-5'-PHOSPHATE|Pyridoxine 5'-phosphate|Pyridoxine 5-phosphate|Pyridoxine phosphate|Pyridoxol 5'-phosphate|[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl dihydrogen phosphate|pyridoxine 5'-(dihydrogen phosphate)|pyridoxol 5-phosphate|pyridoxyl-5-phosphate http://purl.obolibrary.org/obo/CHEBI_28803 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28804 biolink:ChemicalEntity D-2-aminopentanoic acid A 2-aminopentanoic acid that has R-configuration. cas:2013-12-9|kegg.compound:C01799|patent:CN101007774|pubmed:31071709|pubmed:35625327|reaxys:1721161 Graph (2R)-2-aminopentanoic acid|(R)-norvaline|D-2-Aminopentanoic acid|D-2-Aminovaleric acid|D-Ape|D-Norvaline|D-Nva (2R)-2-aminopentanoic acid (2R)-2-aminopentanoic acid|(R)-norvaline|D-2-Aminopentanoic acid|D-2-Aminovaleric acid|D-Ape|D-Norvaline|D-Nva http://purl.obolibrary.org/obo/CHEBI_28804 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28805 biolink:ChemicalEntity cis-1,2-dichloroethene beilstein:1071208|cas:156-59-2|gmelin:122694|kegg.compound:C06792|umbbd.compound:c0357 Graph (Z)-1,2-dichloroethene|(Z)-1,2-dichloroethylene|cis-1,2-Dichloroethene|cis-1,2-dichloroethylene|cis-Acetylene dichloride|cis-dichloroethylene (Z)-1,2-dichloroethene (Z)-1,2-dichloroethene|(Z)-1,2-dichloroethylene|cis-1,2-Dichloroethene|cis-1,2-dichloroethylene|cis-Acetylene dichloride|cis-dichloroethylene http://purl.obolibrary.org/obo/CHEBI_28805 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28806 biolink:ChemicalEntity 2'-deoxyinosine-5'-monophosphate A deoxyinosine phosphate that is 5'-inosinic acid in which the hydroxy group at position 2' by a hydrogen atom. cas:3393-18-8|hmdb:HMDB0006555|kegg.compound:C06196|metacyc.compound:DIMP|pdb-ccd:DI|pubmed:10684927|pubmed:20542141|pubmed:22817898|pubmed:23385455|pubmed:98523|reaxys:583139|wikipedia.en:Deoxyinosine_monophosphate Graph 2'-Deoxyinosine 5'-monophosphate|2'-Deoxyinosine 5'-monophosphoric acid|2'-Deoxyinosine 5'-phosphate|2'-deoxy-5'-inosinic acid|9-(2-Deoxy-5-O-phosphono-beta-delta-erythro-pentofuranosyl)-9H-purin-6-ol|9-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-9H-purin-6-ol|Deoxyinosine monophosphate|[(2R,3S,4R,5R)-3-hydroxy-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate|dIMP 2'-deoxy-5'-inosinic acid|[(2R,3S,4R,5R)-3-hydroxy-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate 2'-Deoxyinosine 5'-monophosphate|2'-Deoxyinosine 5'-monophosphoric acid|2'-Deoxyinosine 5'-phosphate|2'-deoxy-5'-inosinic acid|9-(2-Deoxy-5-O-phosphono-beta-delta-erythro-pentofuranosyl)-9H-purin-6-ol|9-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-9H-purin-6-ol|Deoxyinosine monophosphate|[(2R,3S,4R,5R)-3-hydroxy-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate|dIMP http://purl.obolibrary.org/obo/CHEBI_28806 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28807 biolink:ChemicalEntity dITP A deoxyinosine phosphate compound having a triphosphate group at the 5'-position. beilstein:7401361|kegg.compound:C01345 Graph 2'-Deoxyinosine 5'-triphosphate|2'-Deoxyinosine-5'-triphosphate|2'-deoxyinosine 5'-(tetrahydrogen triphosphate)|deoxyinosine 5'-triphosphate 2'-deoxyinosine 5'-(tetrahydrogen triphosphate) 2'-Deoxyinosine 5'-triphosphate|2'-Deoxyinosine-5'-triphosphate|2'-deoxyinosine 5'-(tetrahydrogen triphosphate)|deoxyinosine 5'-triphosphate http://purl.obolibrary.org/obo/CHEBI_28807 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28808 biolink:ChemicalEntity mannan cas:52002-03-6|kegg.compound:C00464|kegg.glycan:G10542|wikipedia.en:Mannan Graph Mannan|Mannoglycan|mannan|mannans Mannan|mannan Mannan|Mannoglycan|mannan|mannans http://purl.obolibrary.org/obo/CHEBI_28808 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:2881 biolink:ChemicalEntity asperuloside A iridoid monoterpenoid glycoside isolated from Galium verum. cas:14259-45-1|kegg.compound:C09769|knapsack:C00003072|patent:JP2009209088|pubmed:14220867|pubmed:14220877|pubmed:14915952|pubmed:17396882|pubmed:4391591|pubmed:5815526|reaxys:1302815 Graph [(2aS,4aS,5S,7bS)-5-(beta-D-glucopyranosyloxy)-1-oxo-2a,4a,5,7b-tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-yl]methyl acetate [(2aS,4aS,5S,7bS)-5-(beta-D-glucopyranosyloxy)-1-oxo-2a,4a,5,7b-tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-yl]methyl acetate [(2aS,4aS,5S,7bS)-5-(beta-D-glucopyranosyloxy)-1-oxo-2a,4a,5,7b-tetrahydro-1H-2,6-dioxacyclopenta[cd]inden-4-yl]methyl acetate http://purl.obolibrary.org/obo/CHEBI_2881 http://purl.obolibrary.org/obo/chebi/3_STAR
CHEBI:28811 biolink:ChemicalEntity digalactosylceramide kegg.compound:C06126|kegg.glycan:G00497 Graph Digalactosylceramide|Gal-alpha1->4Gal-beta1->1'Cer|digalactocerebroside|digalactosylceramide|digalactosylceramides Digalactosylceramide|Gal-alpha1->4Gal-beta1->1'Cer|digalactocerebroside|digalactosylceramide|digalactosylceramides http://purl.obolibrary.org/obo/CHEBI_28811 http://purl.obolibrary.org/obo/chebi/1_STAR
CHEBI:28813 biolink:ChemicalEntity sinapyl alcohol