KEGG   COMPOUND: C08276
Entry
C08276                      Compound                               
Name
3-(Methylthio)propanoate;
3-(Methylthio)propionic acid;
3-Methylthiopropionate;
3-(Methylsulfanyl)propanoate;
3-Methylthiopropanoic acid
Formula
C4H8O2S
Exact mass
120.0245
Mol weight
120.17
Structure
Reaction
Pathway
map00270  Cysteine and methionine metabolism
map00920  Sulfur metabolism
map01100  Metabolic pathways
Module
M00990  Dimethylsulfoniopropionate (DMSP) degradation, demethylation pathway, DMSP => methanethiol
Enzyme
1.13.11.53      2.1.1.269       6.2.1.44
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0113 Thia fatty acids
    C08276  3-Methylthiopropanoic acid
Other DBs
CAS: 646-01-5
PubChem: 10474
ChEBI: 1438
LIPIDMAPS: LMFA01130006
KNApSAcK: C00001194
PDB-CCD: A8C[PDBj]
NIKKAJI: J22.485E
LinkDB
KCF data

ATOM        7
            1   C1b C    25.9050  -21.6025
            2   C6a C    24.6943  -20.9006
            3   C1b C    27.1155  -20.9006
            4   O6a O    23.4777  -21.6025
            5   O6a O    24.6943  -19.5027
            6   S2a S    28.3262  -21.6025
            7   C1a C    29.5369  -20.9006
BOND        6
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1
            6     6   7 1

ยป Japanese version

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