EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78705 - (6Z,9Z)-octadecadienoate

ChEBI IDCHEBI:78705
ChEBI Name(6Z,9Z)-octadecadienoate
Stars
ASCII Name(6Z,9Z)-octadecadienoate
DefinitionAn octadecadienoate obtained by deprotonation of the carboxy group of (6Z,9Z)-octadecadienoic acid; major species at pH 7.3.
Last Modified20 August 2014
Submitternhn
DownloadsMolfile
FormulaC18H31O2
Net Charge-1
Average Mass279.444
Monoisotopic Mass279.23295
SMILESCCCCCCCC/C=C\C/C=C\CCCCC(=O)[O-]
InChIInChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10,12-13H,2-8,11,14-17H2,1H3,(H,19,20)/p-1/b10-9-,13-12-
InChIKeyZMKDEQUXYDZSNN-UTJQPWESSA-M
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(6Z,9Z)-octadecadienoate (CHEBI:78705) is a octadecadienoate (CHEBI:25626)
(6Z,9Z)-octadecadienoate (CHEBI:78705) is conjugate base of (6Z,9Z)-octadecadienoic acid (CHEBI:82749)
Incoming Relation(s)
(6Z,9Z)-octadecadienoic acid (CHEBI:82749) is conjugate acid of (6Z,9Z)-octadecadienoate (CHEBI:78705)
IUPAC Name 
(6Z,9Z)-octadeca-6,9-dienoate
Synonyms  Source
C18:2(ω-9), all-cisSUBMITTER
octadeca-6,9-dienoateMetaCyc
6,9-linoleateMetaCyc
UniProt Name  Source
(6Z,9Z)-octadecadienoateUniProt
Manual XrefsDatabases
CPD-8478MetaCyc
Citations