KEGG   COMPOUND: C01180Help
Entry
C01180                      Compound                               
Name
4-Methylthio-2-oxobutanoic acid;
4-Methylthio-2-oxobutanoate;
2-Keto-4-methylthiobutyric acid;
2-Oxo-4-methylthiobutanoate;
2-Oxo-4-methylthiobutanoic acid
Formula
C5H8O3S
Exact mass
148.0194
Mol weight
148.1802
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Cysteine and methionine metabolism
Glucosinolate biosynthesis
Biosynthesis of plant secondary metabolites
Metabolic pathways
Biosynthesis of secondary metabolites
2-Oxocarboxylic acid metabolism
Enzyme
1.4.3.2         1.13.11.54      2.3.3.-         2.6.1.5         
2.6.1.41        2.6.1.57        2.6.1.73        2.6.1.88        
2.6.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0106 Oxo fatty acids
    C01180  2-Oxo-4-methylthiobutanoic acid
BRITE hierarchy
Other DBs
CAS: 
583-92-6
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        9
            1   C5a C    25.2000  -20.9300
            2   C6a C    24.0100  -20.3000
            3   C1b C    26.4600  -20.3000
            4   O5a O    25.2000  -22.3300
            5   O6a O    22.8200  -20.9300
            6   O6a O    24.0100  -18.8300
            7   C1b C    27.6500  -20.9300
            8   S2a S    28.8400  -20.3000
            9   C1a C    30.1000  -20.9300
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     7   8 1
            8     8   9 1

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