KEGG   COMPOUND: C00233Help
Entry
C00233                      Compound                               

Name
4-Methyl-2-oxopentanoate;
2-Oxoisocaproate
Formula
C6H10O3
Exact mass
130.063
Mol weight
130.1418
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00280  Valine, leucine and isoleucine degradation
map00290  Valine, leucine and isoleucine biosynthesis
map00966  Glucosinolate biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
Module
M00036  Leucine degradation, leucine => acetoacetate + acetyl-CoA
M00432  Leucine biosynthesis, 2-oxoisovalerate => 2-oxoisocaproate
Enzyme
1.1.1.85        1.2.1.25        1.2.4.4         1.2.7.7         
1.4.1.9         2.6.1.6         2.6.1.42        2.6.1.67
Brite
Compounds with biological roles [BR:br08001]
 Organic acids
  Carboxylic acids
   2-Oxocarboxylic acids
    C00233  2-Oxoisocaproate
BRITE hierarchy
Other DBs
CAS: 816-66-0
PubChem: 3532
ChEBI: 17865 48430
ChEMBL: CHEMBL445647
KNApSAcK: C00019677
PDB-CCD: COI[PDBj]
3DMET: B00066
NIKKAJI: J39.557I
LinkDB All DBs
KCF data Show

ATOM        9
            1   C5a C    22.7306  -15.8055
            2   C1b C    21.5143  -16.5070
            3   C6a C    23.9403  -16.5070
            4   O5a O    22.7306  -14.4727
            5   C1c C    20.3046  -15.8055
            6   O6a O    25.1501  -15.8055
            7   O6a O    23.9403  -18.1134
            8   C1a C    19.0947  -16.5070
            9   C1a C    20.3046  -14.4727
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 1
            6     3   7 2
            7     5   8 1
            8     5   9 1

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