Feedback

all-trans-18-hydroxyretinoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM10629

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	5

formula

C₂₀H₂₇O₃

charge

-1

mass

315.19657

reference

chebi:139258

InChIKey

XSJOIRFEYHJNAW-FCKHSPHMSA-M

InChI

InChI=1S/C20H28O3/c1-15(7-5-8-16(2)13-19(22)23)10-11-18-17(14-21)9-6-12-20(18,3)4/h5,7-8,10-11,13,21H,6,9,12,14H2,1-4H3,(H,22,23)/p-1/b8-5+,11-10+,15-7+,16-13+

SMILES

CC(/C=C/C1=C(CO)CCCC1(C)C)=C\C=C\C(C)=C\C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:139258 chebi:139258	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 18-hydroxy-all-trans-retinoate 18-hydroxyretinoate
sabiork.compound:30579 sabiorkM:30579	18-Hydroxyretinoic acid
bigg.metabolite:CE2957 biggM:CE2957	18-hydroxy-all-trans-retinoate
seed.compound:cpd16477 seedM:cpd16477 kegg.compound:C16679 keggC:C16679	all-trans-18-Hydroxyretinoic acid
lipidmaps:LMPR01090054 lipidmapsM:LMPR01090054	all-trans-18-Hydroxyretinoic acid (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid
hmdb:HMDB0012452	all-trans-18-Hydroxyretinoic acid (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid 18-Hydroxy-all-trans-retinoate 18-Hydroxy-all-trans-retinoic acid 18-Hydroxyretinoate 18-Hydroxyretinoic acid all-trans-18-Hydroxyretinoate all-trans-9-(2-(Hydroxymethyl)-6,6-dimethyl-1-cyclohexen-1-yl)-3,7-dimethyl-2,4,6,8-nonatetraenoate all-trans-9-(2-(Hydroxymethyl)-6,6-dimethyl-1-cyclohexen-1-yl)-3,7-dimethyl-2,4,6,8-nonatetraenoic acid rac-18-Hydroxy-all-trans-retinoate rac-18-Hydroxy-all-trans-retinoic acid
CHEBI:80657 chebi:80657	all-trans-18-hydroxyretinoic acid (2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid 18-hydroxy-all-trans-retinoic acid 18-hydroxyretinoic acid all-trans-9-(2-(Hydroxymethyl)-6,6-dimethyl-1-cyclohexen-1-yl)-3,7-dimethyl-2,4,6,8-nonatetraenoic acid
hmdb:HMDB0061095 hmdb:HMDB12452 hmdb:HMDB61095 biggM:M_CE2957 keggC:M_C16679 seedM:M_cpd16477	secondary/obsolete/fantasy identifier