CHEBI:40131 - 5-phenylpentanoic acid

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ChEBI Name 5-phenylpentanoic acid
ChEBI ID CHEBI:40131
Definition A monocarboxylic acid that is valeric acid substituted by a phenyl group at the δ-position.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C11H14O2
Net Charge 0
Average Mass 178.22770
Monoisotopic Mass 178.099
InChI InChI=1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13)
InChIKey BYHDDXPKOZIZRV-UHFFFAOYSA-N
SMILES OC(=O)CCCCc1ccccc1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 5-phenylpentanoic acid (CHEBI:40131) has functional parent valeric acid (CHEBI:17418)
5-phenylpentanoic acid (CHEBI:40131) is a benzenes (CHEBI:22712)
5-phenylpentanoic acid (CHEBI:40131) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
5-phenylpentanoic acid
Synonyms Sources
5-PHENYLVALERIC ACID PDBeChem
Benzenepentanoic-acid NIST Chemistry WebBook
δ-phenylvaleric acid NIST Chemistry WebBook
Phenylpentanoic acid ChemIDplus
Phenylvaleric acid ChemIDplus
Manual Xrefs Databases
5PV PDBeChem
HMDB0002043 HMDB
View more database links
Registry Numbers Types Sources
2049062 Reaxys Registry Number Reaxys
2270-20-4 CAS Registry Number NIST Chemistry WebBook
2270-20-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
22223342 PubMed citation Europe PMC
6101142 PubMed citation Europe PMC
Last Modified
13 May 2014