KEGG   DRUG: Clopidogrel besilateHelp
Entry
D10824                      Drug                                   

Name
Clopidogrel besilate;
Clopidogrel besylate;
Clopidogrel (TN)
Formula
C16H16ClNO2S. C6H6O3S
Exact mass
479.0628
Mol weight
479.9968
Structure
Mol fileKCF fileDB search
Class
Cardiovascular agent
 DG01712  Antiplatelet agent
  DG01808  Thienopyridine
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
   DG01808  Thienopyridine
 DG01809  P2Y12 receptor antagonist
  DG01808  Thienopyridine
Metabolizing enzyme substrate
 DG01892  CYP1A2 substrate
 DG02919  CYP2B6 substrate
 DG01639  CYP2C19 substrate
 DG02913  CYP3A4 substrate
Metabolizing enzyme inhibitor
 DG01641  CYP2C8 inhibitor
Remark
ATC code: B01AC04
Chemical structure group: DG00155
Product (DG00155): D00769<JP/US>
Efficacy
Anticoagulant, Platelet aggregation inhibitor, Purinergic receptor P2Y12 antagonist
Comment
Thienopyridine derivative
Target
P2RY12 [HSA:64805] [KO:K04298]
Metabolism
Enzyme: CYP2C19 [HSA:1557]; CYP3A4 [HSA:1576], CYP1A2 [HSA:1544], CYP2B6 [HSA:1555]
Interaction
CYP inhibition: CYP2C8 [HSA:1558]
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 B BLOOD AND BLOOD FORMING ORGANS
  B01 ANTITHROMBOTIC AGENTS
   B01A ANTITHROMBOTIC AGENTS
    B01AC Platelet aggregation inhibitors excl. heparin
     B01AC04 Clopidogrel
      D10824  Clopidogrel besilate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Purine / pyrimidine
    P2RY12
     D10824  Clopidogrel besilate
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10824
BRITE hierarchy
Other DBs
CAS: 744256-69-7
PubChem: 319902624
LinkDB All DBs
KCF data Show

ATOM        31
            1   N1y N    18.7472  -15.8092
            2   C1c C    17.5580  -16.5087
            3   C1x C    19.9364  -16.5087
            4   C1x C    18.7472  -14.4102
            5   C8y C    16.3688  -15.8092
            6   C7a C    17.5580  -17.9078
            7   C8y C    21.1955  -15.8092
            8   C1x C    19.9364  -13.7106
            9   C8y C    16.3688  -14.4102
            10  C8x C    15.1097  -16.5087
            11  O7a O    16.3688  -18.6073
            12  O6a O    18.7472  -18.6073
            13  C8y C    21.1955  -14.4102
            14  C8x C    22.5246  -16.2289
            15  C8x C    15.1097  -13.7106
            16  X   Cl   17.5580  -13.7106
            17  C8x C    13.9205  -15.8092
            18  C1a C    15.1097  -17.9078
            19  S2x S    22.5246  -13.9905
            20  C8x C    23.3641  -15.1097
            21  C8x C    13.9205  -14.4102
            22  C8x C    25.4800  -17.2200
            23  C8x C    25.4800  -18.6200
            24  C8x C    26.6924  -19.3200
            25  C8x C    27.9049  -18.6200
            26  C8x C    27.9049  -17.2200
            27  C8y C    26.6924  -16.5200
            28  S4a S    26.6924  -15.1202
            29  O1d O    25.2924  -15.1202
            30  O1d O    28.0924  -15.1202
            31  O1d O    26.6924  -13.7202
BOND        33
            1     2   5 1
            2     2   6 1 #Down
            3     3   7 1
            4     4   8 1
            5     5   9 1
            6     5  10 2
            7     6  11 1
            8     6  12 2
            9     7  13 2
            10    7  14 1
            11    9  15 2
            12    9  16 1
            13   10  17 1
            14   11  18 1
            15   13  19 1
            16   14  20 2
            17   15  21 1
            18    8  13 1
            19   17  21 2
            20   19  20 1
            21    1   2 1
            22    1   3 1
            23    1   4 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   25  26 1
            28   26  27 2
            29   22  27 1
            30   27  28 1
            31   28  29 2
            32   28  30 2
            33   28  31 1

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