KEGG   DRUG: Bismuth subcitrate potassiumHelp
Entry
D09739                      Drug                                   

Name
Bismuth subcitrate potassium (USAN)
Formula
(C6H5O7)2. Bi. 5K
Exact mass
781.806
Mol weight
782.6713
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
ATC code: A02BX05
Chemical structure group: DG00027
Product (mixture): D10245<US>
Efficacy
Antibacterial, Anti-ulcerative
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
     A02BX05 Bismuth subcitrate
      D09739  Bismuth subcitrate potassium (USAN)
BRITE hierarchy
Other DBs
CAS: 880149-29-1
PubChem: 124490479
LigandBox: D09739
LinkDB All DBs
KCF data Show

ATOM        32
            1   Z   Bi   30.3800  -17.8500 #3+
            2   C1d C    23.9400  -19.8800
            3   C1b C    22.7500  -20.5800
            4   C1b C    25.1300  -20.5800
            5   C6a C    24.6400  -18.6900
            6   O1a O    23.2400  -18.6900
            7   C6a C    21.5600  -19.9500
            8   C6a C    25.1300  -21.9800
            9   O6a O    23.9400  -17.5000 #-
            10  O6a O    26.0400  -18.6900
            11  O6a O    20.3000  -20.6500 #-
            12  O6a O    21.5600  -18.5500
            13  O6a O    26.3900  -22.6800 #-
            14  O6a O    23.9400  -22.6800
            15  Z   K    29.8900  -19.6700 #+
            16  Z   K    31.5000  -19.6000 #+
            17  Z   K    29.8900  -21.2100 #+
            18  Z   K    31.5700  -21.2100 #+
            19  Z   K    30.7300  -22.6800 #+
            20  C1d C    23.9400  -19.8800
            21  C1b C    22.7500  -20.5800
            22  C6a C    21.5600  -19.9500
            23  O6a O    20.3000  -20.6500 #-
            24  O6a O    21.5600  -18.5500
            25  C1b C    25.1300  -20.5800
            26  C6a C    25.1300  -21.9800
            27  O6a O    26.3900  -22.6800 #-
            28  O6a O    23.9400  -22.6800
            29  C6a C    24.6400  -18.6900
            30  O6a O    23.9400  -17.5000 #-
            31  O6a O    26.0400  -18.6900
            32  O1a O    23.2400  -18.6900
BOND        24
            1     2   3 1
            2     2   4 1
            3     2   5 1
            4     2   6 1
            5     3   7 1
            6     4   8 1
            7     5   9 1
            8     5  10 2
            9     7  11 1
            10    7  12 2
            11    8  13 1
            12    8  14 2
            13   20  21 1
            14   20  25 1
            15   20  29 1
            16   20  32 1
            17   21  22 1
            18   25  26 1
            19   29  30 1
            20   29  31 2
            21   22  23 1
            22   22  24 2
            23   26  27 1
            24   26  28 2
BRACKET     1    19.3900  -23.7300   19.3900  -16.5200
            1    27.5100  -16.5200   27.5100  -23.7300
            1  2
 ORIGINAL  1    2   3   7  11  12   4   8  13  14   5   9  10   6
 REPEAT    1   20  21  22  23  24  25  26  27  28  29  30  31  32

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