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Auricolic acid

PropertiesImage
MNX_IDMNXM152470 Image of MNXM152470
referencechebi:186663
formulaC20H36O3
global charge0
mol weight324.505
InChIKeyGWEIHUNYMRRZJJ-MOAWTDCJSA-N
InChIInChI=1S/C20H36O3/c1-2-3-4-13-16-19(21)17-14-11-9-7-5-6-8-10-12-15-18-20(22)23/h3-4,11,14,19,21H,2,5-10,12-13,15-18H2,1H3,(H,22,23)/b4-3-,14-11-
SMILESCC/C=C\CCC(O)C/C=C\CCCCCCCCCC(=O)O
MNX internals
InChI (mnx)InChI=1/C20H36O3/c1-2-3-4-13-16-19(21)17-14-11-9-7-5-6-8-10-12-15-18-20(22)23/h3-4,11,14,19,21H,2,5-10,12-13,15-18H2,1H3,(H,22,23)/b4-3-,14-11-/t19? Image of MNXM152470
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:13][CH2:16][CH:19]([CH2:17]/[CH:14]=[CH:11]\[CH2:9][CH2:7][CH2:5][CH2:6][CH2:8][CH2:10][CH2:12][CH2:15][CH2:18][C:20](=[O:22])[OH:23])[OH:21]
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:186663
chebi:186663
GWEIHUNYMRRZJJ-MOAWTDCJSA-N
Auricolic acid
(11Z,17Z)-14-hydroxyicosa-11,17-dienoic acid

seed.compound:cpd32783
seedM:cpd32783
GWEIHUNYMRRZJJ-MOAWTDCJSA-M
(11Z,17Z)-14R-hydroxy-eicosa-11,17-dienoate
(11Z,17Z)-14R-hydroxy-icosa-11,17-dienoate

lipidmaps:LMFA01050431
lipidmapsM:LMFA01050431
GWEIHUNYMRRZJJ-MOAWTDCJSA-N
Auricolic acid
14-hydroxy-11Z,17Z-eicosadienoic acid
FA 20:2
O

metacyc.compound:CPD-17398
metacycM:CPD-17398
GWEIHUNYMRRZJJ-MOAWTDCJSA-M
auricolate
(11Z,17Z)-14R-hydroxy-eicosa-11,17-dienoate
(11Z,17Z)-14R-hydroxy-icosa-11,17-dienoate
auricolic acid

seedM:M_cpd32783
secondary/obsolete/fantasy identifier