| Entry |
|
|---|
| Name |
Warfarin (INN);
Warfarine;
Choice (TN) |
|---|
| Formula |
C19H16O4
|
|---|
| Exact mass |
308.1049
|
|---|
| Mol weight |
308.33
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Blood modifier agent
DG01950 Antithrombotic agent
DG01708 Coumarin anticoagulant
DG01760 Warfarin and analog
Metabolizing enzyme substrate
DG01642 CYP2C9 substrate
|
|---|
| Remark |
| Product (DG00149): | D00564<US> D01280<JP> |
|
|---|
| Efficacy |
Anticoagulant, Vitamin K antagonist |
|---|
| Comment |
Coumarin derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa00130 | Ubiquinone and other terpenoid-quinone biosynthesis |
|
|---|
| Metabolism |
Enzyme: CYP2C9 [HSA: 1559]
|
|---|
| Interaction |
|
|---|
| Structure map |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
B BLOOD AND BLOOD FORMING ORGANS
B01 ANTITHROMBOTIC AGENTS
B01A ANTITHROMBOTIC AGENTS
B01AA Vitamin K antagonists
B01AA03 Warfarin
D08682 Warfarin (INN)
Drug groups [BR:br08330]
Blood modifier agent
DG01950 Antithrombotic agent
DG01708 Coumarin anticoagulant
DG01760 Warfarin and analog
DG00149 Warfarin
D08682 Warfarin
Metabolizing enzyme substrate
DG01642 CYP2C9 substrate
DG00149 Warfarin
D08682 Warfarin
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
NAD(P)H dehydrogenase
NQO1
D08682 Warfarin (INN)
Vitamin-K-epoxide reductase
VKORC1
D08682 Warfarin (INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08682
Drug groups [BR:br08330]
Blood modifier agent
DG01950 Antithrombotic agent
DG01708 Coumarin anticoagulant
DG01760 Warfarin and analog
DG00149 Warfarin
Metabolizing enzyme substrate
DG01642 CYP2C9 substrate
DG00149 Warfarin
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 C8y C 24.1500 -16.5900
2 C1c C 25.4100 -17.2900
3 C8y C 22.9600 -17.2900
4 C8y C 24.1500 -15.1900
5 C8y C 25.4100 -18.6200
6 C1b C 26.6000 -16.5900
7 C8y C 21.7700 -16.5900
8 O1a O 22.9600 -18.7600
9 O7x O 22.9600 -14.4200
10 O6a O 25.3400 -14.4900
11 C8x C 24.1500 -19.3200
12 C8x C 26.6000 -19.3200
13 C5a C 27.7900 -17.2200
14 C8y C 21.7700 -15.1900
15 C8x C 20.5100 -17.2900
16 C8x C 24.1500 -20.7200
17 C8x C 26.6000 -20.7200
18 C1a C 27.7900 -18.7600
19 O5a O 28.9800 -16.5900
20 C8x C 20.5100 -14.4900
21 C8x C 19.3200 -16.5900
22 C8x C 25.4100 -21.4200
23 C8x C 19.3200 -15.1900
BOND 25
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 2
11 5 12 1
12 6 13 1
13 7 14 2
14 7 15 1
15 11 16 1
16 12 17 2
17 13 18 1
18 13 19 2
19 14 20 1
20 15 21 2
21 16 22 2
22 20 23 2
23 9 14 1
24 17 22 1
25 21 23 1
|
|---|
