EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:36331 - octadeca-10,12-dienoic acid

ChEBI IDCHEBI:36331
ChEBI Nameoctadeca-10,12-dienoic acid
Stars
DefinitionA conjugated linoleic acid having double bonds at positions 10 and 12.
Last Modified11 February 2011
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H32O2
Net Charge0
Average Mass280.452
Monoisotopic Mass280.24023
SMILES[H]C(=CCCCCC)C=C([H])CCCCCCCCC(=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/h6-9H,2-5,10-17H2,1H3,(H,19,20)
InChIKeyGKJZMAHZJGSBKD-UHFFFAOYSA-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)
octadeca-10,12-dienoic acid (CHEBI:36331) is a conjugated linoleic acid (CHEBI:61159)
Incoming Relation(s)
(10E,12Z)-octadecadienoic acid (CHEBI:44526) is a octadeca-10,12-dienoic acid (CHEBI:36331)
IUPAC Name 
octadeca-10,12-dienoic acid
Synonyms  Source
10,12-octadecadienoic acidChEBI
C18:2, n-6,8ChEBI
18:2, n-6,8ChEBI
10,12-18:2ChEBI
Registry NumbersSources
Reaxys:9276105Reaxys
Citations