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CHEBI:187571 - Octadeca-9,16-dien-12,14-diynoic acid

ChEBI IDCHEBI:187571
ChEBI NameOctadeca-9,16-dien-12,14-diynoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O2
Net Charge0
Average Mass272.388
Monoisotopic Mass272.17763
SMILESC/C=C\C#CC#CC/C=C\CCCCCCCC(=O)O
InChIInChI=1S/C18H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-3,9-10H,8,11-17H2,1H3,(H,19,20)/b3-2-,10-9-
InChIKeyIGJLJPLDUJBVCQ-KUCYNYLMSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
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-9,16-dien-12,14-diynoic acid (CHEBI:187571) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(9Z,16Z)-octadeca-9,16-dien-12,14-diynoic acid
Manual XrefsDatabases
113368244ChemSpider
LMFA01031136LIPID MAPS