CHEBI:30851 - keto-phenylpyruvic acid

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ChEBI Name keto-phenylpyruvic acid
ChEBI ID CHEBI:30851
ChEBI ASCII Name keto-phenylpyruvic acid
Definition A 2-oxo monocarboxylic acid that is 3-phenylpropanoic acid substituted by an oxo group at position 2. It is an intermediate metabolite in the phenylalanine pathway.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45005, CHEBI:8105, CHEBI:26009
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Formula C9H8O3
Net Charge 0
Average Mass 164.15802
Monoisotopic Mass 164.047
InChI InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)
InChIKey BTNMPGBKDVTSJY-UHFFFAOYSA-N
SMILES OC(=O)C(=O)Cc1ccccc1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): EC 6.4.1.1 (pyruvate carboxylase) inhibitor
An EC 6.4.1.* (carboxylase) inhibitor that interferes with the action of pyruvate carboxylase (EC 6.4.1.1).
fundamental metabolite
Any metabolite produced by all living cells.
Application(s): chromogenic compound
Colourless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into coloured compounds. They are used in biochemical assays and in diagnosis as indicators, particularly in the form of enzyme substrates.
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ChEBI Ontology
Outgoing keto-phenylpyruvic acid (CHEBI:30851) has functional parent pyruvic acid (CHEBI:32816)
keto-phenylpyruvic acid (CHEBI:30851) has role chromogenic compound (CHEBI:75050)
keto-phenylpyruvic acid (CHEBI:30851) has role EC 6.4.1.1 (pyruvate carboxylase) inhibitor (CHEBI:90318)
keto-phenylpyruvic acid (CHEBI:30851) has role fundamental metabolite (CHEBI:78675)
keto-phenylpyruvic acid (CHEBI:30851) is a 2-oxo monocarboxylic acid (CHEBI:35910)
keto-phenylpyruvic acid (CHEBI:30851) is conjugate acid of keto-phenylpyruvate (CHEBI:18005)
keto-phenylpyruvic acid (CHEBI:30851) is tautomer of enol-phenylpyruvic acid (CHEBI:32815)
Incoming phenylpyruvic acid oxime (CHEBI:131386) has functional parent keto-phenylpyruvic acid (CHEBI:30851)
keto-phenylpyruvate (CHEBI:18005) is conjugate base of keto-phenylpyruvic acid (CHEBI:30851)
enol-phenylpyruvic acid (CHEBI:32815) is tautomer of keto-phenylpyruvic acid (CHEBI:30851)
IUPAC Name
2-oxo-3-phenylpropanoic acid
Synonyms Sources
3-Phenyl-2-oxopropanoate KEGG COMPOUND
3-phenyl-2-oxopropanoic acid NIST Chemistry WebBook
3-PHENYLPYRUVIC ACID PDBeChem
3-phenylpyruvic acid HMDB
alpha-Ketohydrocinnamic acid KEGG COMPOUND
α-oxo-benzenepropanoic acid ChemIDplus
β-phenylpyruvic acid NIST Chemistry WebBook
keto-Phenylpyruvate KEGG COMPOUND
Phenylbrenztraubensäure ChEBI
Phenylpyruvate KEGG COMPOUND
Phenylpyruvic acid KEGG COMPOUND
Database Links Databases
C00000751 KNApSAcK
C00166 KEGG COMPOUND
DB03884 DrugBank
ECMDB00205 ECMDB
HMDB0000205 HMDB
Phenylpyruvic_acid Wikipedia
PPY PDBeChem
YMDB00786 YMDB
View more database links
Registry Numbers Types Sources
156-06-9 CAS Registry Number KEGG COMPOUND
156-06-9 CAS Registry Number NIST Chemistry WebBook
156-06-9 CAS Registry Number ChemIDplus
2207312 Reaxys Registry Number Reaxys
2207312 Beilstein Registry Number Beilstein
972243 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
132040 PubMed citation Europe PMC
153583 PubMed citation Europe PMC
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20504690 PubMed citation Europe PMC
2291475 PubMed citation Europe PMC
4025205 PubMed citation Europe PMC
719897 PubMed citation Europe PMC
8216688 PubMed citation Europe PMC
9869358 PubMed citation Europe PMC
Last Modified
10 November 2016