CHEBI:2424 - acetylpyruvic acid

ChEBI IDCHEBI:2424
ChEBI Nameacetylpyruvic acid
Stars
DefinitionA dioxo monocarboxylic acid that is pentanoic acid carrying two oxo groups at positions 2 and 4.
Last Modified11 June 2015
DownloadsMolfile
FormulaC5H6O4
Net Charge0
Average Mass130.099
Monoisotopic Mass130.02661
SMILESCC(=O)CC(=O)C(=O)O
InChIInChI=1S/C5H6O4/c1-3(6)2-4(7)5(8)9/h2H2,1H3,(H,8,9)
InChIKeyUNRQTHVKJQUDDF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas putida (ncbitaxon:303) - PubMed (1254564)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
acetylpyruvic acid (CHEBI:2424) has functional parent valeric acid (CHEBI:17418)
acetylpyruvic acid (CHEBI:2424) has role bacterial metabolite (CHEBI:76969)
acetylpyruvic acid (CHEBI:2424) is a dioxo monocarboxylic acid (CHEBI:35951)
acetylpyruvic acid (CHEBI:2424) is a β-diketone (CHEBI:67265)
acetylpyruvic acid (CHEBI:2424) is conjugate acid of acetylpyruvate (CHEBI:15360)
Incoming Relation(s)
5-hydroxy-2,4-dioxopentanoic acid (CHEBI:28679) has functional parent acetylpyruvic acid (CHEBI:2424)
acetylpyruvate (CHEBI:15360) is conjugate base of acetylpyruvic acid (CHEBI:2424)
IUPAC Name 
2,4-dioxopentanoic acid
Synonyms  Source
2,4-DioxopentanoateKEGG COMPOUND
2,4-dioxovaleric acidChemIDplus
AcetylpyruvateKEGG COMPOUND
Acetylpyruvic acidKEGG COMPOUND
Manual XrefsDatabases
C02132KEGG COMPOUND
CPD-612MetaCyc
Registry NumbersSources
Reaxys:1759444Reaxys
CAS:5699-58-1ChemIDplus
Citations