| Entry |
|
|---|
| Name |
Gemeprost (JAN/USAN/INN);
Preglandin (TN) |
|---|
| Formula |
C23H38O5
|
|---|
| Exact mass |
394.2719
|
|---|
| Mol weight |
394.54
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01961 Prostaglandin derivative
DG01611 Prostaglandin E1 derivative
|
|---|
| Remark |
| Therapeutic category: | 2499 |
|
|---|
| Efficacy |
Oxytocic, Prostaglandin E1 receptor agonist |
|---|
| Comment |
Prostaglandin derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07228 | Eicosanoid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
G GENITO URINARY SYSTEM AND SEX HORMONES
G02 OTHER GYNECOLOGICALS
G02A UTEROTONICS
G02AD Prostaglandins
G02AD03 Gemeprost
D02073 Gemeprost (JAN/USAN/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
24 Hormones
249 Miscellaneous
2499 Others
D02073 Gemeprost (JAN/USAN/INN)
Drug groups [BR:br08330]
Hormonal agent
DG01961 Prostaglandin derivative
DG01611 Prostaglandin E1 derivative
D02073 Gemeprost
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Prostaglandin
PTGER1
D02073 Gemeprost (JAN/USAN/INN) <JP>
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 28
1 C1y C 17.2205 -14.2329
2 C1y C 17.2205 -15.6359
3 C5x C 15.8642 -13.8119
4 C1b C 18.4365 -13.1813
5 C1y C 15.8642 -16.1036
6 C2b C 18.4365 -16.6875
7 C1x C 15.0691 -14.9812
8 O5x O 15.4432 -12.5023
9 O1a O 15.4432 -17.4132
10 C2b C 19.6526 -15.9859
11 C1c C 20.8686 -16.6875
12 C1d C 22.0846 -15.9859
13 C1b C 23.3006 -16.6875
14 C1b C 24.5166 -15.9859
15 C1b C 25.7326 -16.6875
16 C1a C 26.9486 -15.9859
17 C1b C 19.6302 -13.8642
18 C1b C 20.8445 -13.1631
19 C1b C 22.0588 -13.8642
20 C2b C 23.2731 -13.1631
21 C2b C 24.4874 -13.8642
22 C7a C 25.7017 -13.1631
23 O7a O 26.9160 -13.8642
24 O1a O 20.8685 -18.0977
25 C1a C 23.0692 -15.0157
26 C1a C 21.1079 -15.0157
27 O6a O 25.7019 -11.7474
28 C1a C 28.1226 -13.1674
BOND 28
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 2
22 21 22 1
23 22 23 1
24 11 24 1 #Down
25 12 25 1
26 12 26 1
27 22 27 2
28 23 28 1
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|---|
