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phenylglyoxylic acid (CHEBI:18280)

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ChEBI Name phenylglyoxylic acid
ChEBI ID CHEBI:18280
Last Modified 17 October 2009
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10323, CHEBI:25993, CHEBI:39582, CHEBI:190585

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InChI
InChI=1/C8H6O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H,(H,10,11)/f/h10H
InChIKey
InChIKey=FAQJJMHZNSSFSM-KZFATGLACS
SMILES
OC(=O)C(=O)c1ccccc1
Formula Source
C8H6O3 KEGG COMPOUND
Charge 0
Mass 150.13144
ChEBI Ontology
Tree view
Outgoing phenylglyoxylic acid (CHEBI:18280) has functional parent glyoxylic acid (CHEBI:16891)
phenylglyoxylic acid (CHEBI:18280) is conjugate acid of phenylglyoxylate (CHEBI:36656)
Incoming phenylglyoxylyl-CoA (CHEBI:50117) has functional parent phenylglyoxylic acid (CHEBI:18280)
phenylglyoxylate (CHEBI:36656) is conjugate base of phenylglyoxylic acid (CHEBI:18280)
IUPAC Name
oxo(phenyl)acetic acid
Synonyms Sources
2-oxo-2-phenylacetic acid ChemIDplus
2-phenylethanoic acid ChemIDplus
α-ketophenylacetic acid NIST Chemistry WebBook
alpha-Oxo-benzeneacetic acid KEGG COMPOUND
benzeneglyoxylic acid ChemIDplus
BENZOYL-FORMIC ACID MSDchem
Benzoylformate KEGG COMPOUND
Benzoylformic acid KEGG COMPOUND
Phenylglyoxylate KEGG COMPOUND
Phenylglyoxylic acid KEGG COMPOUND
Database Links Databases
173 MSDchem
C02137 KEGG COMPOUND
190585 ChEMBL
Registry Numbers Types Sources
102031 Gmelin Registry Number Gmelin
606718 Beilstein Registry Number Beilstein
611-73-4 CAS Registry Number ChemIDplus
611-73-4 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
11459664 PubMed citation ChEMBL
7265127 PubMed citation ChEMBL

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