KEGG   DRUG: SufotidineHelp
Entry
D05939                      Drug                                   

Name
Sufotidine (USAN/INN)
Formula
C20H31N5O3S
Exact mass
421.2148
Mol weight
421.5568
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Gastrointestinal agent
 DG01481  Histamine receptor H2 antagonist
 DG01975  Agents for peptic ulcer
  DG01481  Histamine receptor H2 antagonist
Activity
Anti-ulcerative, H2 receptor antagonist
Target
HRH2 [HSA:3274] [KO:K04150]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Gastric acid secretion
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    H2-receptor
     Sufotidine
      D05939  Sufotidine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
80343-63-1
PubChem: 
LigandBox: 
KCF data Show

ATOM        29
            1   C1x C    23.9903  -26.1180
            2   C1x C    23.9903  -27.5276
            3   C1x C    25.2109  -28.2324
            4   N1y N    26.4317  -27.5276
            5   C1x C    26.4317  -26.1180
            6   C1x C    25.2109  -25.4132
            7   C1b C    27.6712  -28.2434
            8   C8y C    28.8847  -27.5430
            9   C8x C    30.0751  -28.2305
            10  C8y C    31.2959  -27.5259
            11  C8x C    31.2961  -26.1163
            12  C8x C    30.1056  -25.4288
            13  C8x C    28.8848  -26.1334
            14  O2a O    32.5353  -28.2417
            15  C1b C    33.7472  -27.5423
            16  C1b C    34.9383  -28.2302
            17  C1b C    36.1402  -27.5363
            18  N1b N    37.3363  -28.2272
            19  C8y C    38.5356  -27.5348
            20  N5x N    39.7982  -28.0971
            21  C8y C    40.7232  -27.0701
            22  N5x N    40.0323  -25.8730
            23  N4y N    38.6802  -26.1603
            24  C1b C    42.1327  -27.0701
            25  S4a S    42.8452  -28.3032
            26  C1a C    43.5500  -29.5239
            27  O3c O    44.0907  -27.5835
            28  O3c O    41.6500  -28.9939
            29  C1a C    37.6662  -25.2470
BOND        31
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15   10  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   19  23 1
            26   21  24 1
            27   24  25 1
            28   25  26 1
            29   25  27 2
            30   25  28 2
            31   23  29 1

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