| Entry |
|
|---|
| Name |
Icosapent (INN);
Eicosapentaenoic acid |
|---|
| Formula |
C20H30O2
|
|---|
| Exact mass |
302.2246
|
|---|
| Mol weight |
302.451
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Anticoagulant, Platelet aggregation inhibitor |
|---|
| Structure map |
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 22
1 C2b C 21.4900 -18.2700
2 C2b C 22.8900 -18.2700
3 C1b C 20.2300 -18.9700
4 C1b C 24.0800 -18.9700
5 C2b C 19.0400 -18.2700
6 C2b C 25.2700 -18.2700
7 C2b C 17.6400 -18.2700
8 C2b C 26.6700 -18.2700
9 C1b C 16.4500 -18.9700
10 C1b C 27.9300 -18.9700
11 C1b C 15.1900 -18.2700
12 C2b C 29.1200 -18.2700
13 C1b C 14.0000 -18.9700
14 C2b C 30.5200 -18.2700
15 C6a C 12.8100 -18.2700
16 C1b C 31.7100 -18.9700
17 O6a O 11.5500 -18.9700
18 O6a O 12.8100 -16.8700
19 C2b C 32.9700 -18.2700
20 C2b C 34.3700 -18.2700
21 C1b C 35.5600 -18.9700
22 C1a C 36.7500 -18.2700
BOND 21
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 2
7 6 8 2
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 12 14 2
14 13 15 1
15 14 16 1
16 15 17 1
17 15 18 2
18 16 19 1
19 19 20 2
20 20 21 1
21 21 22 1
|
|---|
