KEGG   DRUG: Atropine methylbromide
Entry
D03814                      Drug                                   
Name
Atropine methylbromide (JAN)
Formula
C18H26NO3. Br
Exact mass
383.1096
Mol weight
384.3079
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Remark
ATC code: A03BB02
Chemical structure group: DG01242
Efficacy
Antispasmodic, Muscarinic acetylcholine receptor antagonist
Comment
Tropane derivative, Quaternary ammonium compound
Target
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
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
     A03BB02 Methylatropine
      D03814  Atropine methylbromide (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Methylatropine
    D03814  Atropine methylbromide (JAN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01491  Muscarinic cholinergic receptor antagonist
   DG01242  Methylatropine
    D03814  Atropine methylbromide
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D03814  Atropine methylbromide (JAN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01491  Muscarinic cholinergic receptor antagonist
   DG01242  Methylatropine
Other DBs
CAS: 2870-71-5
PubChem: 47205891
LigandBox: D03814
NIKKAJI: J355.230F
LinkDB
KCF data

ATOM        23
            1   C1x C    28.3406  -36.2137
            2   C1x C    28.6601  -35.0727
            3   C1y C    29.4815  -35.9399
            4   C1y C    29.8010  -34.7989
            5   N2y N    28.5688  -33.5210 #+
            6   C1x C    31.3070  -35.9399
            7   C1x C    31.0332  -34.7989
            8   C1y C    32.3111  -36.4875
            9   O7a O    33.3608  -37.3546
            10  C7a C    34.5474  -37.3546
            11  C1c C    35.1408  -36.3049
            12  O6a O    35.1408  -38.4499
            13  C8y C    36.3274  -36.3049
            14  C1b C    34.5474  -35.3009
            15  O1a O    35.1408  -34.2512
            16  C8x C    37.0151  -37.4965
            17  C8x C    38.3783  -37.4968
            18  C8x C    39.0602  -36.3163
            19  C8x C    38.3726  -35.1247
            20  C8x C    37.0093  -35.1244
            21  C1a C    27.8394  -32.3679
            22  C1a C    27.3718  -34.1176
            23  X   Br   32.2709  -32.5515 #-
BOND        24
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1
            6     4   7 1
            7     6   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12   11  13 1
            13   11  14 1
            14   14  15 1
            15    4   5 1
            16    7   8 1
            17   13  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   13  20 1
            23    5  21 1
            24    5  22 1

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