CHEBI:184540 - 5,6-Epoxyoctadeca-7,9-diynoic acid

ChEBI IDCHEBI:184540
ChEBI Name5,6-Epoxyoctadeca-7,9-diynoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26O3
Net Charge0
Average Mass290.403
Monoisotopic Mass290.18819
SMILESCCCCCCCCC#CC#CC1OC1CCCC(=O)O
InChIInChI=1S/C18H26O3/c1-2-3-4-5-6-7-8-9-10-11-13-16-17(21-16)14-12-15-18(19)20/h16-17H,2-8,12,14-15H2,1H3,(H,19,20)
InChIKeyXLDNBXDVNANPCY-UHFFFAOYSA-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)
5,6-Epoxyoctadeca-7,9-diynoic acid (CHEBI:184540) is a epoxy fatty acid (CHEBI:61498)
IUPAC Name 
4-(3-dodeca-1,3-diynyloxiran-2-yl)butanoic acid
Manual XrefsDatabases
24700173ChemSpider
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