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CHEBI:29024 - 4-methyl-3-oxopentanoic acid

ChEBI IDCHEBI:29024
ChEBI Name4-methyl-3-oxopentanoic acid
Stars
DefinitionA branched-chain fatty acid that is 4-methylpentanoic acid carrying an oxo substituent at C-3.
Secondary ChEBI IDsCHEBI:1621, CHEBI:18673
Last Modified6 February 2017
DownloadsMolfile
FormulaC6H10O3
Net Charge0
Average Mass130.143
Monoisotopic Mass130.06299
SMILESCC(C)C(=O)CC(=O)O
InChIInChI=1S/C6H10O3/c1-4(2)5(7)3-6(8)9/h4H,3H2,1-2H3,(H,8,9)
InChIKeyZXLSKTZECNUVIS-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-methyl-3-oxopentanoic acid (CHEBI:29024) has functional parent valeric acid (CHEBI:17418)
4-methyl-3-oxopentanoic acid (CHEBI:29024) is a 3-oxo fatty acid (CHEBI:134416)
4-methyl-3-oxopentanoic acid (CHEBI:29024) is a branched-chain fatty acid (CHEBI:35819)
4-methyl-3-oxopentanoic acid (CHEBI:29024) is conjugate acid of 4-methyl-3-oxopentanoate (CHEBI:62222)
Incoming Relation(s)
4-methyl-3-oxopentanoate (CHEBI:62222) is conjugate base of 4-methyl-3-oxopentanoic acid (CHEBI:29024)
IUPAC Name 
4-methyl-3-oxopentanoic acid
Synonyms  Source
3-Oxo-4-methylpentanoic acidKEGG COMPOUND
beta-Ketoisocaproic acidKEGG COMPOUND
beta-KetoisocaproateKEGG COMPOUND
β-oxo-4-methylcaproic aicdChEBI
β-oxo-4-methylpentanoic aicdChEBI
3-Oxo-4-methylpentanoateKEGG COMPOUND
Manual XrefsDatabases
C03467KEGG COMPOUND
LMFA01020276LIPID MAPS