KEGG   DRUG: Malotilate
Entry
D01770                      Drug                                   
Name
Malotilate (JAN/USAN/INN);
Kantec (TN)
Formula
C12H16O4S2
Exact mass
288.049
Mol weight
288.383
Structure
Simcomp
Efficacy
Liver function improving agent
Other DBs
CAS: 59937-28-9
PubChem: 7848833
ChEBI: 31798
LigandBox: D01770
NIKKAJI: J18.323G
KCF data

ATOM        18
            1   S2x S    23.3648  -22.1463
            2   C8y C    23.7989  -20.8137
            3   S2x S    22.6675  -19.9907
            4   C8x C    21.5291  -20.8137
            5   C8x C    21.9630  -22.1463
            6   C2c C    25.0059  -20.1106
            7   C7a C    26.2175  -20.8079
            8   O7a O    27.4290  -20.1106
            9   C1c C    28.6404  -20.8079
            10  C1a C    29.8520  -20.1106
            11  C7a C    25.0059  -18.7160
            12  O7a O    26.2175  -18.0115
            13  C1c C    26.2175  -16.6169
            14  C1a C    27.4290  -15.9196
            15  O6a O    26.2804  -22.2095
            16  C1a C    28.6335  -22.2095
            17  O6a O    23.7874  -18.0115
            18  C1a C    24.9990  -15.9196
BOND        18
            1     8   9 1
            2     4   5 2
            3     9  10 1
            4     5   1 1
            5     6  11 1
            6    11  12 1
            7     2   6 2
            8    12  13 1
            9     1   2 1
            10   13  14 1
            11    6   7 1
            12    7  15 2
            13    2   3 1
            14    9  16 1
            15    7   8 1
            16   11  17 2
            17    3   4 1
            18   13  18 1

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  All links  
Drug (1)   
   LigandBox (1)   
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (1)   
All databases (4)   

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