KEGG   DRUG: Cythioate
Entry
D07768                      Drug                                   
Name
Cythioate (BAN);
Proban (TN)
Formula
C8H12NO5PS2
Exact mass
296.9894
Mol weight
297.2883
Structure
Simcomp
Efficacy
Insecticide (veterinary)
Comment
Organophosphorus insecticide
Other DBs
CAS: 115-93-5
PubChem: 51092060
LigandBox: D07768
NIKKAJI: J32.916I
KCF data

ATOM        17
            1   C8x C    21.7683  -16.8679
            2   C8y C    21.7683  -18.2677
            3   C8x C    22.9805  -18.9676
            4   C8x C    24.1929  -18.2677
            5   C8y C    24.1929  -16.8679
            6   C8x C    22.9805  -16.1680
            7   O2b O    25.4239  -16.1570
            8   P1a P    26.6289  -16.8526
            9   O2b O    27.8412  -17.5525
            10  O2b O    27.3139  -15.6651
            11  S0  S    25.9150  -18.0899
            12  S4a S    20.5560  -18.9676
            13  N1a N    19.3437  -19.6675
            14  O3c O    19.7866  -17.8133
            15  O3c O    21.3391  -20.1427
            16  C1a C    28.6974  -15.6648
            17  C1a C    29.0589  -16.8493
BOND        17
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 1
            11    8  11 2
            12    2  12 1
            13   12  13 1
            14   12  14 2
            15   12  15 2
            16   10  16 1
            17    9  17 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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