3-KETOBUTYRATE

Metabolite 3-KETOBUTYRATE

• smiles:
  • CC(=O)CC([O-])=O
• common name:
  • acetoacetate
• inchi key:
  • InChIKey=WDJHALXBUFZDSR-UHFFFAOYSA-M
• molecular weight:
  • 101.082
• Synonym(s):
  • 3-ketobutyrate
  • 3-oxobutanate
  • oxobutyrate
  • acetoacetic acid
  • 3-oxobutyric acid
  • 3-oxobutanoic acid
  • diacetic acid
  • β-ketobutyric acid

Reaction(s) known to consume the compound

• ACETOACETATE-DECARBOXYLASE-RXN
• ACETOACETATE--COA-LIGASE-RXN

Reaction(s) known to produce the compound

• HYDROXYMETHYLGLUTARYL-COA-LYASE-RXN
• FUMARYLACETOACETASE-RXN

Reaction(s) of unknown directionality

• RXNI-2
• 3-HYDROXYBUTYRATE-DEHYDROGENASE-RXN

External links

• UM-BBD-CPD : c0069
• CAS : 541-50-4
• METABOLIGHTS : MTBLC13705
• PUBCHEM:
  • 6971017
• HMDB : HMDB00060
• LIGAND-CPD:
  • C00164
• CHEMSPIDER:
  • 5341896
• CHEBI:
  • 13705
• BIGG : 1485291

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