KEGG   DRUG: Ozagrel hydrochloride hydrate
Entry
D01683                      Drug                                   
Name
Ozagrel hydrochloride hydrate (JAN);
Ozagrel hydrochloride;
Ozagrel (TN)
Formula
C13H12N2O2. HCl. H2O
Exact mass
282.0771
Mol weight
282.7228
Structure
Simcomp
Class
Blood modifier agent
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
   DG01516  Thromboxane A2 synthase inhibitor
Remark
Therapeutic category: 4490
Chemical structure group: DG01256
Product (DG01256): D01683<JP> D01684<JP>
Efficacy
Antiasthmatic, Airway hyperreactivity inhibitor, Thromboxane A2 (TXA2) synthase inhibitor
Target
TBXAS1 (CYP5A1) [HSA:6916] [KO:K01832]
  Pathway
hsa00590  Arachidonic acid metabolism
hsa04611  Platelet activation
Interaction
Structure map
map07034  Eicosanoids
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  44  Allergic agents
   449  Miscellaneous
    4490  Miscellaneous
     D01683  Ozagrel hydrochloride hydrate (JAN)
Drug groups [BR:br08330]
 Blood modifier agent
  DG01950  Antithrombotic agent
   DG01712  Antiplatelet agent
    DG01516  Thromboxane A2 synthase inhibitor
     DG01256  Ozagrel
      D01683  Ozagrel hydrochloride hydrate
Target-based classification of drugs [BR:br08310]
 Enzymes
  Isomerases (EC5)
   Thromboxane-A synthase
    TBXAS1 (CYP5A1)
     D01683  Ozagrel hydrochloride hydrate (JAN) <JP>
Drug groups [BR:br08330]
 Blood modifier agent
  DG01950  Antithrombotic agent
   DG01712  Antiplatelet agent
    DG01516  Thromboxane A2 synthase inhibitor
     DG01256  Ozagrel
Other DBs
PubChem: 7848746
LigandBox: D01683
KCF data

ATOM        19
            1   N4y N    24.8993  -15.9855
            2   C8x C    25.3377  -17.3182
            3   C8x C    26.0391  -15.1496
            4   C1b C    23.6718  -15.2958
            5   N5x N    26.7405  -17.3182
            6   C8x C    27.1789  -15.9855
            7   C8y C    22.4677  -16.0206
            8   C8x C    22.4911  -17.4291
            9   C8x C    21.2343  -15.3366
            10  C8x C    21.2811  -18.1482
            11  C8x C    20.0771  -16.0614
            12  C8y C    20.1122  -17.4643
            13  C2b C    18.9022  -18.1831
            14  C2b C    17.6826  -17.4992
            15  C6a C    16.4802  -18.2135
            16  O6a O    15.2604  -17.5294
            17  O6a O    16.4278  -19.6118
            18  X   Cl   29.7155  -16.9975
            19  O0  O    33.1850  -16.9854
BOND        18
            1     2   5 2
            2     3   6 2
            3     4   7 1
            4     7   8 2
            5     7   9 1
            6     8  10 1
            7     9  11 2
            8    10  12 2
            9    12  13 1
            10    5   6 1
            11   11  12 1
            12   13  14 2
            13   14  15 1
            14    1   2 1
            15   15  16 1
            16    1   3 1
            17   15  17 2
            18    1   4 1

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