KEGG   DRUG: D01648Help
Entry
D01648                      Drug                                   

Name
Hyoscyamine methylbromide (JAN)
Formula
C18H26NO3. Br
Exact mass
383.1096
Mol weight
384.3079
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
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  
 
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
    A03BA Belladonna alkaloids, tertiary amines
     A03BA03 Hyoscyamine
      D01648  Hyoscyamine methylbromide (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Hyoscyamine methylbromide
    D01648  Hyoscyamine methylbromide (JAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor
     Hyoscyamine
      D01648  Hyoscyamine methylbromide (JAN)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from ornithine
   Tropane alkaloids
    D01648  Hyoscyamine methylbromide (JAN)
BRITE hierarchy
Other DBs
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        23
            1   C1x C    28.3306  -36.1582
            2   C1x C    28.6501  -35.0172
            3   C1y C    29.4716  -35.8843
            4   C1y C    29.7911  -34.7434
            5   N2y N    28.5589  -33.4655 #+
            6   C1x C    31.2971  -35.8843
            7   C1x C    31.0233  -34.7434
            8   C1y C    32.3012  -36.4320
            9   O7a O    33.3509  -37.2991
            10  C7a C    34.5375  -37.2991
            11  C1c C    35.1308  -36.2494
            12  O6a O    35.1308  -38.3944
            13  C8y C    36.3175  -36.2494
            14  C1b C    34.5375  -35.2453
            15  O1a O    35.1308  -34.1957
            16  C8x C    37.0052  -37.4410
            17  C8x C    38.3684  -37.4413
            18  C8x C    39.0503  -36.2608
            19  C8x C    38.3627  -35.0692
            20  C8x C    36.9994  -35.0689
            21  C1a C    27.8294  -32.3124
            22  C1a C    27.3618  -34.0621
            23  X   Br   32.2610  -32.4960 #-
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 #Down
            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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