KEGG   DRUG: D01315Help
Entry
D01315                      Drug                                   

Name
Methylbenactyzium bromide (JP16/INN)
Formula
C21H28NO3. Br
Exact mass
421.1253
Mol weight
422.3559
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Anticholinergic
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  
 
Interaction
Drug interaction
Structure map
Cholinergic and anticholinergic drugs
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor [HSA:1128 1129 1131 1132 1133] [KO:K04129 K04130 K04131 K04132 K04133]
     Methylbenactyzium
      D01315  Methylbenactyzium bromide (JP16/INN)
BRITE hierarchy
Other DBs
CAS: 
3166-62-9
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   X   Br   32.2377  -20.1863 #-
            2   C1a C    18.1468  -20.8172
            3   C1b C    19.3610  -20.1162
            4   N1d N    20.5753  -20.8172 #+
            5   C1b C    21.7895  -20.1162
            6   C1b C    23.0037  -20.8172
            7   O7a O    24.2180  -20.1162
            8   C7a C    25.4322  -20.8172
            9   C1d C    26.6464  -20.1162
            10  C8y C    27.8607  -20.8172
            11  C8y C    26.6464  -18.7142
            12  C8x C    27.8479  -18.0205
            13  C8x C    27.8478  -16.6184
            14  C8x C    26.6335  -15.9175
            15  C8x C    25.4321  -16.6112
            16  C8x C    25.4322  -18.0133
            17  C8x C    27.8607  -22.2190
            18  C8x C    29.0749  -22.9201
            19  C8x C    30.2892  -22.2190
            20  C8x C    30.2892  -20.8172
            21  C8x C    29.0749  -20.1162
            22  O6a O    25.4322  -22.2193
            23  C1b C    20.5753  -22.2193
            24  C1a C    19.3801  -22.9096
            25  C1a C    20.5753  -19.4152
            26  O1a O    27.8589  -19.4162
BOND        26
            1     2   3 1
            2     3   4 1
            3     4   5 1
            4     5   6 1
            5     6   7 1
            6     7   8 1
            7     8   9 1
            8     9  10 1
            9     9  11 1
            10   11  12 1
            11   12  13 2
            12   13  14 1
            13   14  15 2
            14   15  16 1
            15   11  16 2
            16   10  17 2
            17   17  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 2
            21   10  21 1
            22    8  22 2
            23    4  23 1
            24   23  24 1
            25    4  25 1
            26    9  26 1

» Japanese version   » Back

DBGET integrated database retrieval system