KEGG   DRUG: Dacisteine
Entry
D07773                      Drug                                   
Name
Dacisteine (INN);
Mucothiol (TN)
Formula
C7H11NO4S
Exact mass
205.0409
Mol weight
205.23
Structure
Simcomp
Efficacy
Mucolytic
Comment
Cysteine derivative
Other DBs
CAS: 18725-37-6
PubChem: 96024471
LigandBox: D07773
NIKKAJI: J222.285J
LinkDB
KCF data

ATOM        13
            1   C1a C    22.2600  -15.4700
            2   C5a C    21.0700  -14.7700
            3   S2a S    19.8100  -15.4700
            4   C1b C    18.6200  -14.7700
            5   C1c C    17.4300  -15.4700
            6   C6a C    16.1700  -14.7700
            7   O6a O    14.9800  -15.4700
            8   N1b N    17.4300  -16.8700
            9   O6a O    16.1700  -13.3700
            10  O5a O    21.0700  -13.3700
            11  C5a C    18.6200  -17.5700
            12  C1a C    19.8100  -16.8700
            13  O5a O    18.6200  -18.9700
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     5   8 1 #Down
            8     6   9 2
            9     2  10 2
            10    8  11 1
            11   11  12 1
            12   11  13 2

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