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CHEBI:186915 - 13-phenyl-9E-tridecenoic acid

ChEBI IDCHEBI:186915
ChEBI Name13-phenyl-9E-tridecenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28O2
Net Charge0
Average Mass288.431
Monoisotopic Mass288.20893
SMILESO=C(O)CCCCCCC/C=C/CCCc1ccccc1
InChIInChI=1S/C19H28O2/c20-19(21)17-13-8-6-4-2-1-3-5-7-10-14-18-15-11-9-12-16-18/h3,5,9,11-12,15-16H,1-2,4,6-8,10,13-14,17H2,(H,20,21)/b5-3+
InChIKeyPTHXJDIHJNGHDK-HWKANZROSA-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)
13-phenyl-9E-tridecenoic acid (CHEBI:186915) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(E)-13-phenyltridec-9-enoic acid
Manual XrefsDatabases
113368380ChemSpider
LMFA01140074LIPID MAPS