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CHEBI:187100 - 11-tridecynoic acid

ChEBI IDCHEBI:187100
ChEBI Name11-tridecynoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O2
Net Charge0
Average Mass210.317
Monoisotopic Mass210.16198
SMILESCC#CCCCCCCCCCC(=O)O
InChIInChI=1S/C13H22O2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h4-12H2,1H3,(H,14,15)
InChIKeyJFCYIJIRIXJLFE-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)
11-tridecynoic acid (CHEBI:187100) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
tridec-11-ynoic acid
Manual XrefsDatabases
4472150ChemSpider
LMFA01030604LIPID MAPS