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CHEBI:186977 - 21:2(5Z,16Z)

ChEBI IDCHEBI:186977
ChEBI Name21:2(5Z,16Z)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H38O2
Net Charge0
Average Mass322.533
Monoisotopic Mass322.28718
SMILESCCCC/C=C\CCCCCCCCC/C=C\CCCC(=O)O
InChIInChI=1S/C21H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h5-6,16-17H,2-4,7-15,18-20H2,1H3,(H,22,23)/b6-5-,17-16-
InChIKeyWHODMRWGIAVEJR-RACUUBEBSA-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)
21:2(5Z,16Z) (CHEBI:186977) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(5Z,16Z)-henicosa-5,16-dienoic acid
Manual XrefsDatabases
113368178ChemSpider
LMFA01030868LIPID MAPS