KEGG   DRUG: D07481Help
Entry
D07481                      Drug                                   

Name
Azasetron (INN)
Formula
C17H20ClN3O3
Exact mass
349.1193
Mol weight
349.812
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antiemetic;
Serotonin antagonist
Remark
Drug group: 
Target
5-HT3-receptor antagonist [HSA:3359 9177 170572 200909 285242] [KO:K04819]
Structure map
Serotonin receptor agonists/antagonists
Other DBs
CAS: 
123040-69-7
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C1y C    21.7700  -18.9000
            2   N1b N    22.8200  -19.7400
            3   C5a C    24.0100  -19.7400
            4   C8y C    24.7100  -18.6200
            5   O5a O    24.7100  -20.9300
            6   C8y C    26.0400  -18.6200
            7   O2x O    26.7400  -19.9500
            8   C1x C    28.1400  -19.9500
            9   C5x C    28.8400  -18.6200
            10  N1y N    28.1400  -17.4300
            11  C8y C    26.7400  -17.4300
            12  C1x C    21.0700  -19.9500
            13  N1y N    19.6000  -19.0400
            14  C1x C    19.6000  -17.7800
            15  C1x C    18.0600  -19.8800
            16  C1y C    20.3700  -17.9900
            17  C1x C    20.3700  -17.0100
            18  C1x C    18.7600  -18.6900
            19  C8x C    26.0400  -16.1700
            20  C8y C    24.7100  -16.1700
            21  C8x C    23.9400  -17.3600
            22  X   Cl   23.9400  -14.9100
            23  O5x O    30.3100  -18.6200
            24  C1a C    28.8400  -16.2400
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 2
            5     4   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11    6  11 2
            12   12  13 1
            13   12   1 1
            14   13  14 1
            15   13  15 1
            16    1  16 1
            17   14  17 1
            18   15  18 1
            19   16  17 1
            20   16  18 1
            21   11  19 1
            22   19  20 2
            23   20  21 1
            24    4  21 2
            25   20  22 1
            26    9  23 2
            27   10  24 1

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