KEGG   DRUG: ThiethylperazineHelp
Entry
D02354                      Drug                                   

Name
Thiethylperazine (USAN/INN)
Formula
C22H29N3S2
Exact mass
399.1803
Mol weight
399.6158
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C07132
ATC code: R06AD03
Chemical structure group: DG01102
Efficacy
Anti-emetic, Antipsychotic, Dopamine D2 receptor antagonist
Comment
Phenothiazine derivative
Target
DRD2 [HSA:1813] [KO:K04145]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
Interaction
Drug interaction
Structure map
map07029  Antipsychotics - phenothiazines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R06 ANTIHISTAMINES FOR SYSTEMIC USE
   R06A ANTIHISTAMINES FOR SYSTEMIC USE
    R06AD Phenothiazine derivatives
     R06AD03 Thiethylperazine
      D02354  Thiethylperazine (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D02354  Thiethylperazine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 1420-55-9
PubChem: 7849413
ChEBI: 9544
ChEMBL: CHEMBL1378
DrugBank: DB00372
LigandBox: D02354
NIKKAJI: J3.667F
LinkDB All DBs
KCF data Show

ATOM        27
            1   C8y C    28.6440  -19.9600
            2   N1y N    29.8570  -19.2568
            3   C8y C    28.6440  -21.3490
            4   C8x C    27.4310  -19.2568
            5   C8y C    31.0642  -19.9600
            6   S2x S    29.8570  -22.0579
            7   C8x C    27.4310  -22.0579
            8   C8x C    26.2179  -19.9600
            9   C8y C    31.0642  -21.3490
            10  C8x C    32.2714  -19.2568
            11  C8x C    26.2179  -21.3490
            12  C8x C    32.2714  -22.0579
            13  C8y C    33.4785  -19.9600
            14  C8x C    33.4785  -21.3490
            15  S2a S    34.6953  -19.2606
            16  C1b C    35.9177  -19.9698
            17  C1a C    37.1220  -19.2783
            18  C1b C    29.8580  -17.8253
            19  C1b C    31.0922  -17.1137
            20  C1b C    32.2806  -17.8001
            21  N1y N    33.4938  -17.1000
            22  C1x C    34.6721  -17.7806
            23  C1x C    35.8847  -17.0809
            24  N1y N    35.8849  -15.6809
            25  C1x C    34.7066  -15.0003
            26  C1x C    33.4941  -15.7000
            27  C1a C    37.1166  -14.9699
BOND        30
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 2
            9     5  10 1
            10    7  11 2
            11    9  12 1
            12   10  13 2
            13   12  14 2
            14    6   9 1
            15    8  11 1
            16   13  14 1
            17   13  15 1
            18   15  16 1
            19   16  17 1
            20    2  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   21  26 1
            30   24  27 1

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