KEGG   DRUG: Methscopolamine bromideHelp
Entry
D00715                      Drug                                   

Name
Methscopolamine bromide (USP);
Hyoscine methobromide (INN);
Pamine (TN)
Product
  Generic
Formula
C18H24NO4. Br
Exact mass
397.0889
Mol weight
398.2915
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01491  Muscarinic cholinergic receptor antagonist
Activity
Antispasmodic, Muscarinic acetylcholine receptor antagonist
Comment
Toropane derivative
Target
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Cholinergic synapse
Salivary secretion
Gastric acid secretion
Interaction
Drug interaction
Structure map
Cholinergic and anticholinergic drugs
Brite
USP drug classification [BR:br08302]
 Gastrointestinal Agents
  Antispasmodics, Gastrointestinal
   Methscopolamine
    D00715  Methscopolamine bromide (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor
     Hyoscine
      D00715  Methscopolamine bromide (USP)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from ornithine
   Tropane alkaloids
    D00715  Hyoscine methobromide (INN)
BRITE hierarchy
Other DBs
CAS: 
155-41-9
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   X   Br   39.7175  -18.0800 #-
            2   C1y C    27.7900  -17.2900
            3   C1y C    27.1600  -18.3400
            4   C1y C    28.7000  -16.9400
            5   O2x O    26.2500  -17.2900
            6   C1y C    28.4900  -17.8500
            7   N2y N    27.7200  -15.8900 #+
            8   C1x C    30.1700  -16.9400
            9   C1x C    30.1000  -17.8500
            10  C1a C    28.0700  -14.6300
            11  C1a C    26.4600  -15.1900
            12  C1y C    31.4300  -18.4100
            13  O7a O    32.4100  -19.1800
            14  C7a C    33.8100  -19.1800
            15  O6a O    34.4400  -20.3700
            16  C1c C    34.4400  -18.0600
            17  C8y C    35.7700  -18.0600
            18  C1b C    33.8100  -16.8700
            19  O1a O    34.4400  -15.6800
            20  C8x C    36.4700  -19.2500
            21  C8x C    37.8000  -19.2500
            22  C8x C    38.5000  -18.0600
            23  C8x C    37.8000  -16.8700
            24  C8x C    36.4700  -16.8700
BOND        26
            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     7  11 1
            10    8  12 1
            11   12  13 1 #Down
            12    3   5 1
            13    6   7 1
            14    9  12 1
            15   13  14 1
            16   14  15 2
            17   14  16 1
            18   16  17 1 #Down
            19   16  18 1
            20   18  19 1
            21   17  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   17  24 1

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