KEGG   DRUG: Furegrelate sodium
Entry
D04276                      Drug                                   

Name
Furegrelate sodium (USAN)
Formula
C15H10NO3. Na. H2O
Exact mass
293.0664
Mol weight
293.2498
Structure
Class
Cardiovascular agent
 DG01712  Antiplatelet agent
  DG01516  Thromboxane A2 synthase inhibitor
 DG01950  Antithrombotic agent
  DG01712  Antiplatelet agent
   DG01516  Thromboxane A2 synthase inhibitor
 DG01516  Thromboxane A2 synthase inhibitor
Efficacy
Platelet aggregation inhibitor, Thromboxane A2 (TXA2) synthase inhibitor
Target
TBXAS1 (CYP5A1) [HSA:6916] [KO:K01832]
  Pathway
hsa00590  Arachidonic acid metabolism
hsa04611  Platelet activation
Interaction
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Isomerases (EC5)
   Thromboxane-A synthase
    TBXAS1 (CYP5A1)
     D04276  Furegrelate sodium (USAN)
Other DBs
CAS: 87463-91-0
PubChem: 47206210
ChEMBL: CHEMBL3989891
LigandBox: D04276
KCF data

ATOM        21
            1   C8x C    15.3300  -15.4700
            2   C8y C    15.3300  -16.8700
            3   C8x C    16.5900  -17.5700
            4   C8y C    17.7800  -16.8700
            5   C8y C    17.7800  -15.4700
            6   C8x C    16.5900  -14.7700
            7   C8x C    19.1100  -17.2900
            8   C8y C    19.9500  -16.1700
            9   O2x O    19.1100  -15.0500
            10  C6a C    21.2800  -16.1700
            11  O6a O    21.9800  -17.4300
            12  O6a O    21.9800  -14.9800 #-
            13  C1b C    14.1400  -17.5700
            14  C8y C    12.9500  -16.8700
            15  C8x C    12.9500  -15.4700
            16  N5x N    11.6900  -14.7700
            17  C8x C    10.5000  -15.4700
            18  C8x C    10.5000  -16.8700
            19  C8x C    11.6900  -17.5700
            20  Z   Na   23.8700  -14.9800 #+
            21  O0  O    25.1300  -17.4300
BOND        21
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12   10  11 2
            13   10  12 1
            14    2  13 1
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   14  19 1

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