keto-phenylpyruvic acid (CHEBI:30851)

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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

Average Mass

164.15802

Monoisotopic Mass

164.04734

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.

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

Last Modified

10 November 2016