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CHEBI:186236 - 15-phenyl pentadecanoic acid

ChEBI IDCHEBI:186236
ChEBI Name15-phenyl pentadecanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H34O2
Net Charge0
Average Mass318.501
Monoisotopic Mass318.25588
SMILESO=C(O)CCCCCCCCCCCCCCc1ccccc1
InChIInChI=1S/C21H34O2/c22-21(23)19-15-10-8-6-4-2-1-3-5-7-9-12-16-20-17-13-11-14-18-20/h11,13-14,17-18H,1-10,12,15-16,19H2,(H,22,23)
InChIKeyBKXIGVQZLPZYLM-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)
15-phenyl pentadecanoic acid (CHEBI:186236) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
15-phenylpentadecanoic acid
Manual XrefsDatabases
2018796ChemSpider
LMFA01140068LIPID MAPS
Registry NumbersSources
CAS:40228-93-1ChemIDplus