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13-oxo-(9Z,11E)-octadecadienoate

PropertiesImage
MNX_IDMNXM726010 Image of MNXM726010
referencechebi:90781
formulaC18H29O3
global charge-1
mol weight293.427
InChIKeyJHXAZBBVQSRKJR-BSZOFBHHSA-M
InChIInChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/p-1/b9-7-,15-12+
SMILESCCCCCC(=O)/C=C/C=C\CCCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+ Image of MNXM726010
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:11][CH2:14][C:17](/[CH:15]=[CH:12]/[CH:9]=[CH:7]\[CH2:5][CH2:4][CH2:6][CH2:8][CH2:10][CH2:13][CH2:16][C:18](=[O:20])[OH:21])=[O:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:90781
chebi:90781
JHXAZBBVQSRKJR-BSZOFBHHSA-M 		13-oxo-(9Z,11E)-octadecadienoate
(9Z,11E)-13-oxooctadeca-9,11-dienoate
(9Z,11E)-13-oxooctadecadienoate
(Z,E)-13-oxooctadeca-9,11-dienoate
13-oxo-9Z,11E-ODE(1-)

seed.compound:cpd10462
seedM:cpd10462
JHXAZBBVQSRKJR-BSZOFBHHSA-M 		13-KODE
(9Z,11E)-13-Oxooctadeca-9,11-dienoic acid
13-OxoODE

lipidmaps:LMFA02000454
lipidmapsM:LMFA02000454
JHXAZBBVQSRKJR-BSZOFBHHSA-N 		13-Oxo-ODE-d3
13-KODE-d3
13-keto-9Z,11E-9,10,12-d3-octadecadienoic acid
13-oxo-9Z,11E-9,10,12-d3-octadecadienoic acid

lipidmaps:LMFA02000016
lipidmapsM:LMFA02000016
JHXAZBBVQSRKJR-BSZOFBHHSA-N 		13-Oxo-ODE
13-KODE
13-keto-9Z,11E-octadecadienoic acid
FA 18:3
O
hmdb:HMDB0004668
JHXAZBBVQSRKJR-BSZOFBHHSA-N 		13-OxoODE
(9Z,11E)-13-Oxooctadeca-9,11-dienoate
(9Z,11E)-13-Oxooctadeca-9,11-dienoic acid
(9Z,11E)-13-oxooctadeca-9,11-dienoic acid
13-KODDA
13-KODE
13-Keto-9,11,-octadecadienoic acid
13-Keto-9Z,11E-octadecadienoate
13-Keto-9Z,11E-octadecadienoic acid
13-KetoODE
13-Oxo-ODE
13-Oxooctadecadienoic acid
13-oxo-9,11-Octadecadienoic acid
13-oxo-ODE

kegg.compound:C14765
keggC:C14765
JHXAZBBVQSRKJR-BSZOFBHHSA-N 		13-OxoODE
(9Z,11E)-13-Oxooctadeca-9,11-dienoic acid
13-KODE

SLM:000501294
slm:000501294
JHXAZBBVQSRKJR-BSZOFBHHSA-M 		13-oxo-(9Z,11E)-octadecadienoate
13-keto-(9Z,11E)-octadecadienoate

metacyc.compound:CPD-24626
metacycM:CPD-24626
JHXAZBBVQSRKJR-BSZOFBHHSA-M 		13-oxo-9Z,11E-ODE
(9Z,11E)-13-oxooctadeca-9,11-dienoate
(9Z,11E)-13-oxooctadecadienoate
(Z,E)-13-oxooctadeca-9,11-dienoate
13-KODE
13-keto-9,11-ODE
13-ketoODE
13-oxo-(9Z,11E)-octadecadienoate
13-oxoODE

CHEBI:68947
chebi:68947
JHXAZBBVQSRKJR-BSZOFBHHSA-N 		13-oxo-9Z,11E-ODE
(9Z,11E)-13-oxooctadeca-9,11-dienoic acid
13-KODE
13-Oxo-ODE
13-OxoODE
13-keto-9Z,11E-octadecadienoic acid
13-ketoODE
13-oxoODE

hmdb:HMDB04668
chebi:34155
keggC:M_C14765
seedM:M_cpd10462 		secondary/obsolete/fantasy identifier