KEGG   COMPOUND: C13109
Entry
C13109                      Compound                               
Name
Hyoscyamine methylbromide;
Atropine methobromide;
Atropine methylbromide
Formula
C18H26NO3. Br
Exact mass
383.1096
Mol weight
384.3079
Structure
Remark
Same as: D01648
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)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01491  Muscarinic cholinergic receptor antagonist
   DG00053  Hyoscyamine
    D01648  Hyoscyamine methylbromide
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D01648  Hyoscyamine methylbromide (JAN)
Other DBs
CAS: 2870-71-5
PubChem: 585173
ChEBI: 31681
NIKKAJI: J355.230F
LinkDB
KCF data

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

» Japanese version

DBGET integrated database retrieval system