7-phenyl heptanoic acid (CHEBI:193307)

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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	7-phenyl heptanoic acid

ChEBI ID	CHEBI:193307

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H18O2

Net Charge

Average Mass

206.285

Monoisotopic Mass

206.13068

InChI

InChI=1S/C13H18O2/c14-13(15)11-7-2-1-4-8-12-9-5-3-6-10-12/h3,5-6,9-10H,1-2,4,7-8,11H2,(H,14,15)

InChIKey

ZVSXKFNTWOIGJI-UHFFFAOYSA-N

SMILES

OC(=O)CCCCCCC1=CC=CC=C1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). 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	7-phenyl heptanoic acid (CHEBI:193307) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

7-phenylheptanoic acid