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CHEBI:32798 - 9-cis,11-trans-octadecadienoic acid

ChEBI IDCHEBI:32798
ChEBI Name9-cis,11-trans-octadecadienoic acid
Stars
ASCII Name9-cis,11-trans-octadecadienoic acid
DefinitionAn octadeca-9,11-dienoic acid having 9-cis,11-trans-stereochemistry.
Secondary ChEBI IDsCHEBI:2339, CHEBI:20825
Last Modified23 October 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC18H32O2
Net Charge0
Average Mass280.452
Monoisotopic Mass280.24023
SMILESCCCCCC/C=C/C=C\CCCCCCCC(=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/h7-10H,2-6,11-17H2,1H3,(H,19,20)/b8-7+,10-9-
InChIKeyJBYXPOFIGCOSSB-GOJKSUSPSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
9-cis,11-trans-octadecadienoic acid (CHEBI:32798) is a octadeca-9,11-dienoic acid (CHEBI:36025)
9-cis,11-trans-octadecadienoic acid (CHEBI:32798) is conjugate acid of 9-cis,11-trans-octadecadienoate (CHEBI:17539)
Incoming Relation(s)
(9Z,11E)-octadecadienoyl-CoA (CHEBI:74396) has functional parent 9-cis,11-trans-octadecadienoic acid (CHEBI:32798)
9-cis,11-trans-octadecadienoate (CHEBI:17539) is conjugate base of 9-cis,11-trans-octadecadienoic acid (CHEBI:32798)
IUPAC Name 
(9Z,11E)-octadeca-9,11-dienoic acid
Synonyms  Source
(9Z,11E)-Octadecadienoic acidKEGG COMPOUND
9(Z),11(E)-octadecadienoic acidChEBI
rumenic acidChEBI
9-cis-11-trans-linoleic acidChEBI
cis-9,trans-11 conjugated linoleic acidChEBI
cis-9,trans-11-CLAChEBI
Manual XrefsDatabases
C04056KEGG COMPOUND
LMFA01030118LIPID MAPS
Registry NumbersSources
Beilstein:1726545Beilstein
Reaxys:1726546Reaxys
Citations