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2-Hydroxylinolenic acid

PropertiesImage
MNX_IDMNXM116791 Image of MNXM116791
referencechebi:189773
formulaC18H30O3
global charge0
mol weight294.435
InChIKeyJQXGCBKGIBTCHY-FVCZIJCZSA-N
InChIInChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h3-4,6-7,9-10,17,19H,2,5,8,11-16H2,1H3,(H,20,21)/b4-3-,7-6-,10-9+
SMILESCC/C=C\C/C=C\C/C=C/CCCCCCC(O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h3-4,6-7,9-10,17,19H,2,5,8,11-16H2,1H3,(H,20,21)/b4-3-,7-6-,10-9+/t17? Image of MNXM116791
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]/[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH:17]([C:18](=[O:20])[OH:21])[OH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:189773
chebi:189773
JQXGCBKGIBTCHY-FVCZIJCZSA-N
2-Hydroxylinolenic acid
(9E,12Z,15Z)-2-hydroxyoctadeca-9,12,15-trienoic acid
hmdb:HMDB0031103
JQXGCBKGIBTCHY-FVCZIJCZSA-N
2-Hydroxylinolenic acid
(9E,12Z,15Z)-2-Hydroxyoctadeca-9,12,15-trienoate
(9E,12Z,15Z)-2-hydroxyoctadeca-9,12,15-trienoic acid
2-Hydroxylinolenate

hmdb:HMDB31103
secondary/obsolete/fantasy identifier