KEGG   DRUG: D00541Help
Entry
D00541                      Drug                                   

Name
Hycanthone (USAN/INN)
Formula
C20H24N2O2S
Exact mass
356.1558
Mol weight
356.4818
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antischistosomal
Other DBs
CAS: 
3105-97-3
PubChem: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        25
            1   C8x C    22.7639  -13.1070
            2   C8x C    22.7639  -11.7075
            3   C8x C    21.5511  -11.0078
            4   C8y C    20.3382  -11.7075
            5   C8y C    20.3382  -13.1070
            6   C8x C    21.5511  -13.8067
            7   S2x S    19.1253  -11.0078
            8   C8y C    17.9125  -11.7075
            9   C8y C    17.9125  -13.1070
            10  C8y C    19.1253  -13.8067
            11  C8y C    16.6997  -11.0078
            12  C8x C    15.4867  -11.7075
            13  C8x C    15.4867  -13.1070
            14  C8y C    16.6997  -13.8067
            15  O5x O    19.1253  -15.2061
            16  C1b C    16.6997   -9.6083
            17  O1a O    15.4867   -8.9086
            18  N1b N    16.6997  -15.2061
            19  C1b C    15.4867  -15.9059
            20  C1b C    14.2739  -15.2061
            21  N1c N    13.0611  -15.9059
            22  C1b C    11.8482  -15.2061
            23  C1b C    13.0611  -17.3053
            24  C1a C    10.6354  -15.9059
            25  C1a C    11.8482  -18.0050
BOND        27
            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     4   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17   10  15 2
            18   11  16 1
            19   16  17 1
            20   14  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   21  23 1
            26   22  24 1
            27   23  25 1

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