**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

(5S,8R,9Z,12Z)-5,8-dihydroxyoctadeca-9,12-dienoate

Properties Image MNX_ID MNXM5375 reference chebi:63217 formula C18H31O4 global charge -1 mol weight 311.442 InChIKey CVXOCQUHJDKXHR-JFKQHRMJSA-M InChI InChI=1S/C18H32O4/c1-2-3-4-5-6-7-8-9-11-16(19)14-15-17(20)12-10-13-18(21)22/h6-7,9,11,16-17,19-20H,2-5,8,10,12-15H2,1H3,(H,21,22)/p-1/b7-6-,11-9-/t16-,17-/m0/s1 SMILES CCCCC/C=C\C/C=C\[C@H](O)CC[C@@H](O)CCCC(=O)[O-] MNX internals InChI (mnx) InChI=1/C18H32O4/c1-2-3-4-5-6-7-8-9-11-16(19)14-15-17(20)12-10-13-18(21)22/h6-7,9,11,16-17,19-20H,2-5,8,10,12-15H2,1H3,(H,21,22)/b7-6-,11-9-/t16-,17-/m0/s1 SMILES (mnx) [C:1]([CH2:2][CH2:4][CH2:5][C@H:6]([CH2:7][CH2:9][O:20](/[CH:10]=[CH:11]/[CH2:12]/[CH:13]=[CH:14]\[CH2:15][CH2:16][CH2:17][CH2:18][OH:19])[OH:21])[OH:22])(=[CH2:3])[CH3:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1

Similar chemical compounds in external resources

Identifier	Description
CHEBI:63217 chebi:63217 CVXOCQUHJDKXHR-JFKQHRMJSA-M	(5S,8R,9Z,12Z)-5,8-dihydroxyoctadeca-9,12-dienoate 5(S),8(R)-DiHODE(1-)
metacyc.compound:CPD-13765 metacycM:CPD-13765 CVXOCQUHJDKXHR-JFKQHRMJSA-M	(5S,8R,9Z,12Z)-5,8-dihydroxy-9,12-octadecadienoate
CHEBI:63216 chebi:63216 CVXOCQUHJDKXHR-JFKQHRMJSA-N	5(S),8(R)-DiHODE (5S,8R)-5,8-dihydroxylinoleic acid (5S,8R,9Z,12Z)-5,8-dihydroxyoctadeca-9,12-dienoic acid
kegg.compound:C20186 keggC:C20186 CVXOCQUHJDKXHR-JFKQHRMJSA-N	5S,8R-DiHODE (5S,8R)-DiHODE (5S,8R,9Z,12Z)-5,8-Dihydroxyoctadeca-9,12-dienoate
seed.compound:cpd21419 seedM:cpd21419 CVXOCQUHJDKXHR-JFKQHRMJSA-M	5S,8R-DiHODE (5S,8R)-DiHODE (5S,8R,9Z,12Z)-5,8-Dihydroxyoctadeca-9,12-dienoate (5S,8R,9Z,12Z)-5,8-dihydroxy-9,12-octadecadienoate
lipidmaps:LMFA02000284 lipidmapsM:LMFA02000284 CVXOCQUHJDKXHR-JFKQHRMJSA-N	5S,8R-DiHODE 5S,8R-dihydroxy-9Z,12Z-octadecadienoic acid FA 18:2 O2
keggC:M_C20186 seedM:M_cpd21419	secondary/obsolete/fantasy identifier