KEGG   DRUG: D08561Help
Entry
D08561                      Drug                                   

Name
Tandospirone (INN)
Formula
C21H29N5O2
Exact mass
383.2321
Mol weight
383.4873
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Tranquilizer
Remark
Drug group: 
Target
5-HT1A-receptor agonist [HSA:3350] [KO:K04153]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04726  Serotonergic synapse  
 
Metabolism
Enzyme: CYP3A4 [HSA:1576], CYP2D6 [HSA:1565]
Interaction
Drug interaction
Structure map
Anxiolytics
Serotonin receptor agonists/antagonists
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Serotonin
    5-HT1A-receptor
     Tandospirone
      D08561  Tandospirone (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP2D6
   Tandospirone
    D08561  Tandospirone (INN)
  CYP3A4
   Tandospirone
    D08561  Tandospirone (INN)
BRITE hierarchy
Other DBs
CAS: 
87760-53-0
PubChem: 
LigandBox: 
KCF data Show

ATOM        28
            1   C1b C    23.9400  -16.8700
            2   C1b C    22.7500  -16.1700
            3   C1b C    21.5600  -16.8700
            4   C1b C    20.3700  -16.1700
            5   N1y N    19.1100  -16.8700
            6   C1x C    19.1100  -18.2700
            7   C1x C    17.9200  -18.9000
            8   N1y N    16.7300  -18.2700
            9   C1x C    16.7300  -16.8700
            10  C1x C    17.9200  -16.1700
            11  C8y C    15.5400  -18.9000
            12  N5x N    15.5400  -20.3000
            13  C8x C    14.3500  -21.0000
            14  C8x C    13.0900  -20.3000
            15  C8x C    13.0900  -18.9000
            16  N5x N    14.3500  -18.2700
            17  C1x C    29.8200  -15.3300
            18  C1x C    29.8900  -16.7300
            19  C1y C    28.6300  -17.5000
            20  C1y C    27.4400  -16.8000
            21  C1y C    27.4400  -15.4000
            22  C1y C    28.6300  -14.7000
            23  C5x C    26.1100  -17.2200
            24  N1y N    25.2700  -16.1000
            25  C5x C    26.1100  -14.9100
            26  O5x O    25.6900  -13.5800
            27  O5x O    25.7600  -18.4800
            28  C1x C    28.2100  -16.0300
BOND        32
            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     7   8 1
            8     8   9 1
            9     9  10 1
            10    5  10 1
            11    8  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   15  16 2
            17   11  16 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   17  22 1
            24   23  24 1
            25   24  25 1
            26   21  25 1
            27   25  26 2
            28   23  27 2
            29   22  28 1 #Down
            30   19  28 1 #Down
            31   20  23 1
            32    1  24 1

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