KEGG   COMPOUND: C04078
Entry
C04078                      Compound                               
Name
Methylmethionine sulfonium salt;
Methylmethionine sulfonium chloride;
Vitamin U
Formula
C6H14NO2S. Cl
Exact mass
199.0434
Mol weight
199.6989
Structure
Remark
Same as: D00177
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
     A02BX04 Methiosulfonium chloride
      D00177  Methylmethionine sulfonium chloride (JAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  23  Digestive organ agents
   232  Peptic ulcer agents
    2321  Methylmethionines
     D00177  Methylmethionine sulfonium chloride (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Methylmethionine sulfonium chloride
    D00177  Methylmethionine sulfonium chloride (JAN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01975  Agents for peptic ulcer
   DG02008  Gastric mucosal protectant
    D00177  Methylmethionine sulfonium chloride
Other DBs
CAS: 1115-84-0
PubChem: 6772
ChEBI: 6884
NIKKAJI: J246.885I
LinkDB
KCF data

ATOM        11
            1   C1c C    33.4422  -17.5350
            2   C1b C    32.3226  -16.8936
            3   C6a C    34.5558  -16.8936
            4   N1a N    33.4422  -18.8237
            5   C1b C    31.2147  -17.5350
            6   O6a O    35.6753  -17.5350
            7   O6a O    34.5558  -15.6050
            8   S0  S    29.7629  -16.7945 #+
            9   C1a C    28.4743  -17.5117
            10  C1a C    29.7629  -15.0219
            11  X   Cl   30.2178  -19.2726 #-
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     3   6 1
            6     3   7 2
            7     5   8 1
            8     8   9 1
            9     8  10 1

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