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CHEBI:171733 - (E,E)-11,13-Octadecadien-9-ynoic acid

ChEBI IDCHEBI:171733
ChEBI Name(E,E)-11,13-Octadecadien-9-ynoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O2
Net Charge0
Average Mass276.420
Monoisotopic Mass276.20893
SMILESCCCC/C=C/C=C\C#CCCCCCCCC(=O)O
InChIInChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-8H,2-4,11-17H2,1H3,(H,19,20)/b6-5+,8-7-
InChIKeyONYHYSLZNLJFHX-MDAAKZFYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(E,E)-11,13-Octadecadien-9-ynoic acid (CHEBI:171733) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(11Z,13E)-octadeca-11,13-dien-9-ynoic acid
Manual XrefsDatabases
30777053ChemSpider
HMDB0034382HMDB
LMFA01030511LIPID MAPS