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CHEBI:15999 - (4-hydroxyphenyl)pyruvic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (4-hydroxyphenyl)pyruvic acid
ChEBI ID CHEBI:15999
Definition An oxo carboxylic acid that is pyruvic acid in which one of the methyl hydrogens is substituted by a 4-hydroxyphenyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:20426, CHEBI:42422, CHEBI:1431
Supplier Information
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Formula C9H8O4
Net Charge 0
Average Mass 180.15742
Monoisotopic Mass 180.042
InChI InChI=1S/C9H8O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,10H,5H2,(H,12,13)
InChIKey KKADPXVIOXHVKN-UHFFFAOYSA-N
SMILES OC(=O)C(=O)Cc1ccc(O)cc1
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): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (4-hydroxyphenyl)pyruvic acid (CHEBI:15999) has functional parent pyruvic acid (CHEBI:32816)
(4-hydroxyphenyl)pyruvic acid (CHEBI:15999) has role human metabolite (CHEBI:77746)
(4-hydroxyphenyl)pyruvic acid (CHEBI:15999) is a oxo carboxylic acid (CHEBI:25754)
(4-hydroxyphenyl)pyruvic acid (CHEBI:15999) is a phenols (CHEBI:33853)
(4-hydroxyphenyl)pyruvic acid (CHEBI:15999) is conjugate acid of 3-(4-hydroxyphenyl)pyruvate (CHEBI:36242)
Incoming 3-(4-hydroxyphenyl)pyruvate (CHEBI:36242) is conjugate base of (4-hydroxyphenyl)pyruvic acid (CHEBI:15999)
IUPAC Name
3-(4-hydroxyphenyl)-2-oxopropanoic acid
Synonyms Sources
(p-hydroxyphenyl)pyruvic acid NIST Chemistry WebBook
3-(4-HYDROXY-PHENYL)PYRUVIC ACID PDBeChem
3-(4-hydroxyphenyl)pyruvic acid ChEBI
3-(p-hydroxyphenyl)-2-oxopropanoic acid NIST Chemistry WebBook
4-hydroxy α-oxobenzenepropanoic acid ChemIDplus
4-hydroxyphenylpyruvic acid ChEBI
p-Hydroxyphenylpyruvic acid KEGG COMPOUND
Database Links Databases
C00007512 KNApSAcK
C01179 KEGG COMPOUND
DB07718 DrugBank
ENO PDBeChem
HMDB00707 HMDB
P-HYDROXY-PHENYLPYRUVATE MetaCyc
View more database links
Registry Numbers Types Sources
156-39-8 CAS Registry Number NIST Chemistry WebBook
156-39-8 CAS Registry Number ChemIDplus
2691632 Reaxys Registry Number Reaxys
2691632 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
11073718 PubMed citation Europe PMC
9106023 PubMed citation Europe PMC
Last Modified
23 October 2015