KEGG   DRUG: Galdansetron hydrochlorideHelp
Entry
D04294                      Drug                                   

Name
Galdansetron hydrochloride (USAN)
Formula
C18H19N3O. HCl
Exact mass
329.1295
Mol weight
329.8239
Structure
Mol fileKCF fileDB search
Class
Gastrointestinal agent
 DG01762  Antiemetic
Efficacy
Anti-emetic, Serotonin 5-HT3 receptor antagonist
Target
  Pathway
hsa04726  Serotonergic synapse
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   Serotonin
    HTR3
     D04294  Galdansetron hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 156712-35-5
PubChem: 47206226
ChEMBL: CHEMBL2106790
LigandBox: D04294
LinkDB All DBs
KCF data Show

ATOM        23
            1   C8y C     6.1600  -22.9600
            2   C8y C     6.1600  -24.3600
            3   C1b C     7.3724  -25.0600
            4   C1y C     8.5849  -24.3600
            5   C1x C     8.5849  -22.9600
            6   C1a C     7.3724  -22.2600
            7   C5x C     9.7973  -25.0600
            8   C8y C    11.0097  -24.3600
            9   C8y C    11.0097  -22.9600
            10  C1x C     9.7973  -22.2600
            11  N4x N     4.8285  -22.5274
            12  C8x C     4.0056  -23.6600
            13  N5x N     4.8285  -24.7926
            14  C8y C    12.3412  -24.7926
            15  C8y C    13.1641  -23.6600
            16  N4y N    12.3412  -22.5274
            17  O5x O     9.7973  -26.4600
            18  C1a C    12.7679  -21.2136
            19  C8x C    14.5600  -23.6600
            20  C8x C    15.2600  -24.8724
            21  C8x C    14.5696  -26.0679
            22  C8x C    13.1603  -26.0680
            23  X   Cl   17.5700  -24.4300
BOND        25
            1     1   2 2
            2     2   3 1
            3     4   3 1 #Up
            4     4   5 1
            5     1   6 1
            6     4   7 1
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10    5  10 1
            11    1  11 1
            12   11  12 1
            13   12  13 2
            14    2  13 1
            15    8  14 1
            16   14  15 1
            17   15  16 1
            18    9  16 1
            19    7  17 2
            20   16  18 1
            21   15  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  14 2

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