KEGG   DRUG: Dibromsalan
Entry
D03780                      Drug                                   
Name
Dibromsalan (USAN)
Formula
C13H9Br2NO2
Exact mass
368.9
Mol weight
371.0241
Structure
Simcomp
Efficacy
Disinfectant
Other DBs
CAS: 87-12-7
PubChem: 17397869
LigandBox: D03780
NIKKAJI: J4.272B
KCF data

ATOM        18
            1   C8x C    20.9300  -18.4800
            2   C8x C    20.9300  -19.8800
            3   C8y C    22.1424  -20.5800
            4   C8y C    23.3549  -19.8800
            5   C8x C    23.3549  -18.4800
            6   C8y C    22.1424  -17.7800
            7   O1a O    22.1424  -21.9798
            8   X   Br   22.1424  -16.3802
            9   C5a C    24.5860  -20.5910
            10  N1b N    25.7912  -19.8953
            11  O5a O    24.5857  -21.9799
            12  C8y C    26.9735  -20.5781
            13  C8x C    26.9734  -21.9798
            14  C8x C    28.1858  -22.6799
            15  C8y C    29.3983  -21.9800
            16  C8x C    29.3984  -20.5783
            17  C8x C    28.1860  -19.8782
            18  X   Br   30.6119  -22.6809
BOND        19
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     3   7 1
            8     6   8 1
            9     4   9 1
            10    9  10 1
            11    9  11 2
            12   10  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   15  18 1

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  All links  
Drug (1)   
   LigandBox (1)   
Chemical substance (2)   
   PubChem (1)   
   NIKKAJI (1)   
All databases (3)   

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