KEGG   DRUG: D07099Help
Entry
D07099                      Drug                                   

Name
Cimetropium bromide (INN);
Alginor (TN)
Formula
C21H28NO4. Br
Exact mass
437.1202
Mol weight
438.3553
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Parasympatholytic
Remark
ATC code: 
Drug group: 
Target
muscarinic cholinergic receptor antagonist [HSA:1128 1129 1131 1132 1133] [KO:K04129 K04130 K04131 K04132 K04133]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04970  Salivary secretion
hsa04971  Gastric acid secretion
hsa04972  Pancreatic secretion  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
   A03B BELLADONNA AND DERIVATIVES, PLAIN
    A03BB Belladonna alkaloids, semisynthetic, quaternary ammonium compounds
     A03BB05 Cimetropium bromide
      D07099  Cimetropium bromide (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor
     Cimetropium bromide
      D07099  Cimetropium bromide (INN)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from ornithine
   Tropane alkaloids
    D07099  Cimetropium bromide (INN)
BRITE hierarchy
Other DBs
CAS: 
51598-60-8
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        27
            1   X   Br   25.0936  -19.6490 #-
            2   C1y C    14.6964  -16.1237
            3   C1y C    14.0704  -17.1671
            4   C1y C    15.6007  -15.7759
            5   O2x O    13.1661  -16.1237
            6   C1y C    15.3920  -16.6802
            7   N2y N    14.9769  -14.5921 #+
            8   C1x C    16.9223  -15.7759
            9   C1x C    16.9223  -16.6802
            10  C1a C    15.6747  -13.1300
            11  C1y C    18.1744  -17.2367
            12  O7a O    18.1683  -18.2819
            13  C7a C    19.5498  -19.1348
            14  O6a O    19.5135  -20.4723
            15  C1c C    20.6422  -18.4735
            16  C8y C    20.6785  -17.1360
            17  C1b C    21.8536  -19.1576
            18  O1a O    23.0407  -18.4700
            19  C1b C    14.0030  -13.3383
            20  C8x C    21.8657  -16.4484
            21  C8x C    21.8663  -15.0503
            22  C8x C    20.7249  -14.3662
            23  C8x C    19.4771  -15.0196
            24  C8x C    19.4672  -16.4519
            25  C1y C    12.6119  -13.3383
            26  C1x C    11.4051  -14.0305
            27  C1x C    11.4201  -12.6587
BOND        30
            1     2   3 1
            2     2   4 1
            3     2   5 1
            4     3   6 1
            5     4   7 1
            6     4   8 1
            7     6   9 1
            8     7  10 1
            9     8  11 1
            10    3   5 1
            11    6   7 1
            12    9  11 1
            13   12  13 1
            14   13  14 2
            15   13  15 1
            16   15  16 1
            17   11  12 1
            18   15  17 1 #Up
            19   17  18 1
            20    7  19 1
            21   16  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   16  24 1
            27   19  25 1
            28   26  25 1
            29   25  27 1
            30   27  26 1

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