KEGG   DRUG: TecarfarinHelp
Entry
D09676                      Drug                                   

Name
Tecarfarin (USAN/INN)
Formula
C21H14F6O5
Exact mass
460.0745
Mol weight
460.3233
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01708  Coumarin anticoagulant
  DG01760  Warfarin and analog
 DG01950  Antithrombotic agent
  DG01708  Coumarin anticoagulant
   DG01760  Warfarin and analog
Remark
Chemical structure group: DG01390
Efficacy
Anticoagulant
Comment
coumarin derivative
Target
VKORC1 [HSA:79001] [KO:K05357]
  Pathway
hsa00130  Ubiquinone and other terpenoid-quinone biosynthesis
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Vitamin-K-epoxide reductase
    VKORC1
     D09676  Tecarfarin (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 867257-26-9
PubChem: 124490416
ChEMBL: CHEMBL2105664
LigandBox: D09676
LinkDB All DBs
KCF data Show

ATOM        32
            1   C8x C    13.6500  -23.1700
            2   C8x C    13.6500  -24.5700
            3   C8x C    14.8624  -25.2700
            4   C8y C    16.0749  -24.5700
            5   C8y C    16.0749  -23.1700
            6   C8x C    14.8624  -22.4700
            7   C8y C    17.2873  -25.2700
            8   C8y C    18.4997  -24.5700
            9   C8y C    18.4997  -23.1700
            10  O7x O    17.2873  -22.4700
            11  C1b C    19.6973  -25.2615
            12  C8y C    20.8856  -24.5755
            13  C8x C    22.0764  -25.2631
            14  C8x C    23.2889  -24.5633
            15  C8y C    23.2890  -23.1633
            16  C8x C    22.0982  -22.4756
            17  C8x C    20.8857  -23.1755
            18  C7a C    24.5142  -22.4559
            19  O7a O    25.7220  -23.1532
            20  C1d C    26.9032  -22.4713
            21  O6a O    24.5140  -21.0701
            22  C1d C    26.9032  -21.0713
            23  X   F    28.0987  -20.3809
            24  X   F    25.6729  -20.3609
            25  X   F    26.9032  -19.6713
            26  C1d C    28.3032  -22.4713
            27  C1a C    26.9032  -23.8713
            28  X   F    28.9966  -23.6727
            29  X   F    28.9978  -21.2680
            30  X   F    29.7032  -22.4713
            31  O6a O    19.6973  -22.4785
            32  O1a O    17.2873  -26.6700
BOND        34
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   12  17 1
            20   15  18 1
            21   18  19 1
            22   19  20 1
            23   18  21 2
            24   20  22 1
            25   22  23 1
            26   22  24 1
            27   22  25 1
            28   20  26 1
            29   20  27 1
            30   26  28 1
            31   26  29 1
            32   26  30 1
            33    9  31 2
            34    7  32 1

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