15-phenyl pentadecanoic acid (CHEBI:186236)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	15-phenyl pentadecanoic acid

ChEBI ID	CHEBI:186236

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H34O2

Net Charge

Average Mass

318.501

Monoisotopic Mass

318.25588

InChI

InChI=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)

InChIKey

BKXIGVQZLPZYLM-UHFFFAOYSA-N

SMILES

OC(=O)CCCCCCCCCCCCCCC1=CC=CC=C1

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	15-phenyl pentadecanoic acid (CHEBI:186236) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

15-phenylpentadecanoic acid

Registry Number	Type	Source
40228-93-1	CAS Registry Number	ChemIDplus