2K-4CH3-PENTANOATE

Metabolite 2K-4CH3-PENTANOATE

• smiles:
  • CC(C)CC(C([O-])=O)=O
• common name:
  • 4-methyl-2-oxopentanoate
• inchi key:
  • InChIKey=BKAJNAXTPSGJCU-UHFFFAOYSA-M
• molecular weight:
  • 129.135
• Synonym(s):
  • 2-keto-4-methyl-pentanoate
  • 2-oxoisocaproate
  • 2-oxo-4-methylpentanoate
  • α-ketoisocaproate
  • α-oxoisocaproate
  • 2-ketoisocaproate
  • ketoleucine
  • 4-methyl-2-oxopentanoic acid

Reaction(s) known to consume the compound

• RXN-17525
• KETOISOCAPROATE-RXN
• 2KETO-4METHYL-PENTANOATE-DEHYDROG-RXN

Reaction(s) known to produce the compound

• RXN-7800
• RXN-13158

Reaction(s) of unknown directionality

• BRANCHED-CHAINAMINOTRANSFERLEU-RXN
• LEUCINE-DEHYDROGENASE-RXN

External links

• CAS : 816-66-0
• METABOLIGHTS : MTBLC17865
• PUBCHEM:
  • 3527278
• HMDB : HMDB00695
• LIGAND-CPD:
  • C00233
• CHEMSPIDER:
  • 2766269
• CHEBI:
  • 17865
• BIGG : 34334

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