| Entry |
|
|---|
| Name |
Ornoprostil (JAN/INN);
Ronok (TN) |
|---|
| Formula |
C23H38O6
|
|---|
| Exact mass |
410.2668
|
|---|
| Mol weight |
410.5442
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01961 Prostaglandin derivative
DG01611 Prostaglandin E1 derivative
Gastrointestinal agent
DG01975 Agents for peptic ulcer
|
|---|
| Efficacy |
Anti-ulcerative, Prostaglandin E1 receptor agonist |
|---|
| Comment |
Prostaglandin derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07228 | Eicosanoid receptor agonists/antagonists |
|
|---|
| Brite |
Drug groups [BR:br08330]
Hormonal agent
DG01961 Prostaglandin derivative
DG01611 Prostaglandin E1 derivative
D01869 Ornoprostil
Gastrointestinal agent
DG01975 Agents for peptic ulcer
D01869 Ornoprostil
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Prostaglandin
PTGER1
D01869 Ornoprostil (JAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 29
1 C1y C 19.4600 -22.1900
2 C1y C 19.4600 -23.5900
3 C5x C 18.1300 -21.7700
4 C1b C 20.7200 -21.1400
5 C1y C 18.1300 -24.0800
6 C2b C 20.7200 -24.6400
7 C1x C 17.3600 -22.9600
8 O5x O 17.7100 -20.5100
9 O1a O 17.7100 -25.3400
10 C2b C 21.9100 -23.9400
11 C1c C 23.1000 -24.6400
12 C1b C 24.2900 -23.9400
13 C1c C 25.4800 -24.6400
14 C1b C 26.7400 -23.9400
15 C1b C 27.9300 -24.6400
16 C1b C 29.1200 -23.9400
17 C5a C 21.9100 -21.8400
18 C1b C 23.1000 -21.1400
19 C1b C 24.2900 -21.8400
20 C1b C 25.4800 -21.1400
21 C1b C 26.6700 -21.8400
22 C7a C 27.8600 -21.1400
23 O7a O 29.1200 -21.8400
24 O6a O 27.8600 -19.7400
25 C1a C 30.3100 -21.1400
26 O1a O 23.1000 -26.0400
27 C1a C 25.4628 -26.0399
28 C1a C 30.3381 -24.6301
29 O5a O 21.9100 -23.2400
BOND 29
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 2
8 5 9 1 #Down
9 6 10 2
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 5 7 1
17 4 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 22 24 2
25 23 25 1
26 11 26 1 #Down
27 13 27 1 #Down
28 16 28 1
29 17 29 2
|
|---|
