KEGG   COMPOUND: C06002
Entry
C06002                      Compound                               
Name
(S)-Methylmalonate semialdehyde
Formula
C4H6O3
Exact mass
102.0317
Mol weight
102.09
Structure
Comment
Methylmalonate semialdehyde [CPD:C00349] (non-enzymatic racemization, see [RN:R11028])
Reaction
R00935 R03381 R03869 R03871 R03872 R04187 R04188 R05066
R09238 R11028
Pathway
map00280  Valine, leucine and isoleucine degradation
map00633  Nitrotoluene degradation
map00640  Propanoate metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
1.1.1.31        1.2.1.3         1.2.1.27        1.2.1.-         
1.2.3.1         2.6.1.18        2.6.1.22        3.7.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0106 Oxo fatty acids
    C06002  (S)-Methylmalonate semialdehyde
Other DBs
PubChem: 8276
LIPIDMAPS: LMFA01060190
NIKKAJI: J2.359.609A
LinkDB
KCF data

ATOM        7
            1   C1c C    28.0158  -19.8589
            2   C6a C    29.2295  -19.1587
            3   C4a C    26.8018  -19.1644
            4   C1a C    28.0099  -21.2596
            5   O6a O    30.4433  -19.8472
            6   O6a O    29.2936  -17.7521
            7   O4a O    26.7961  -17.7637
BOND        6
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     2   6 2
            6     3   7 2

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