KEGG   DRUG: D07976Help
Entry
D07976                      Drug                                   

Name
Flupentixol decanoate;
Fluanxol depot (TN)
Formula
C33H43F3N2O2S
Exact mass
588.2997
Mol weight
588.7669
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Neuroleptic
Remark
ATC code: 
Drug group: 
Target
dopamine D2-receptor antagonist [HSA:1813] [KO:K04145];
dopamine D1-receptor antagonist [HSA:1812] [KO:K04144]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04540  Gap junction  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AF Thioxanthene derivatives
     N05AF01 Flupentixol
      D07976  Flupentixol decanoate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D1-receptor
     Flupentixol
      D07976  Flupentixol decanoate
    dopamine D2-receptor
     Flupentixol
      D07976  Flupentixol decanoate
BRITE hierarchy
Other DBs
CAS: 
30909-51-4
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        41
            1   C8x C    18.1300  -20.3700
            2   C8x C    18.1300  -21.7700
            3   C8x C    19.3900  -22.4700
            4   C8x C    19.3900  -19.6700
            5   C8y C    20.5100  -20.3700
            6   C8y C    20.5100  -21.7700
            7   S2x S    21.7700  -22.4700
            8   C8y C    21.7700  -19.6700
            9   C8y C    22.9600  -20.3700
            10  C8y C    22.9600  -21.7700
            11  C8x C    24.1500  -22.4700
            12  C8x C    25.4100  -21.7700
            13  C8y C    25.4100  -20.3700
            14  C8x C    24.1500  -19.6700
            15  C2b C    21.7700  -18.2700
            16  C1b C    23.0300  -17.5700
            17  C1b C    23.0300  -16.1700
            18  N1y N    24.2200  -15.4700
            19  C1x C    25.4100  -16.1700
            20  C1x C    26.6000  -15.4700
            21  N1y N    26.6000  -14.0700
            22  C1x C    25.4100  -13.3700
            23  C1x C    24.2200  -14.0700
            24  C1b C    27.8600  -13.3700
            25  C1b C    29.0500  -14.0700
            26  O7a O    30.2400  -13.3700
            27  C1d C    26.6700  -19.6700
            28  X   F    27.8600  -18.9700
            29  X   F    25.9700  -18.4800
            30  X   F    27.3700  -20.8600
            31  C7a C    31.4581  -14.0601
            32  C1b C    32.6395  -13.3650
            33  O6a O    31.4698  -15.4694
            34  C1b C    33.8449  -14.0480
            35  C1b C    35.0161  -13.3591
            36  C1b C    36.2265  -14.0451
            37  C1b C    37.4466  -13.3271
            38  C1b C    38.6557  -14.0116
            39  C1b C    39.8554  -13.3052
            40  C1b C    41.0522  -13.9828
            41  C1a C    42.2272  -13.2911
BOND        44
            1     8   5 1
            2     1   2 1
            3     2   3 2
            4     3   6 1
            5     9  10 2
            6    10  11 1
            7    11  12 2
            8    12  13 1
            9    13  14 2
            10   14   9 1
            11    5   4 1
            12    8  15 2
            13    4   1 2
            14    5   6 2
            15    6   7 1
            16    7  10 1
            17    9   8 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   18  23 1
            27   21  24 1
            28   24  25 1
            29   25  26 1
            30   13  27 1
            31   27  28 1
            32   27  29 1
            33   27  30 1
            34   26  31 1
            35   31  32 1
            36   31  33 2
            37   32  34 1
            38   34  35 1
            39   35  36 1
            40   36  37 1
            41   37  38 1
            42   38  39 1
            43   39  40 1
            44   40  41 1

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