| Entry |
|
|---|
| Name |
Butaprost (USAN/INN) |
|---|
| Formula |
C24H40O5
|
|---|
| Exact mass |
408.2876
|
|---|
| Mol weight |
408.5714
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01961 Prostaglandin derivative
DG01611 Prostaglandin E1 derivative
|
|---|
| Efficacy |
Bronchodilator, Prostaglandin E2 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
D03187 Butaprost
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Prostaglandin
PTGER2
D03187 Butaprost (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 29
1 C1y C 7.2903 -9.7199
2 C1y C 7.2838 -11.1299
3 C5x C 5.9512 -9.2800
4 C1b C 8.5193 -8.3277
5 C1y C 5.9384 -11.5569
6 C2b C 8.5000 -12.5351
7 C1x C 5.1235 -10.4184
8 O5x O 5.5179 -7.9411
9 C1b C 9.7353 -9.0328
10 O1a O 5.4920 -12.6781
11 C2b C 9.7158 -11.8299
12 C1b C 10.9385 -12.5351
13 C1c C 12.1544 -11.8299
14 C1z C 13.3770 -12.5351
15 C1b C 14.5930 -11.8299
16 C1b C 15.8091 -12.5351
17 C1a C 17.0316 -11.8299
18 O1a O 12.1528 -10.4303
19 C1x C 12.3871 -13.5250
20 C1x C 13.3770 -14.5150
21 C1x C 14.3670 -13.5250
22 C1b C 10.9463 -8.3367
23 C1b C 12.1347 -9.0260
24 C1b C 13.3282 -8.3400
25 C1b C 14.5138 -9.0276
26 C7a C 15.7086 -8.3408
27 O7a O 16.8936 -9.0280
28 C1a C 18.0887 -8.3409
29 O6a O 15.7115 -6.9304
BOND 30
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 4 9 1
9 5 10 1 #Down
10 6 11 2
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 5 7 1
18 13 18 1 #Up
19 14 19 1
20 19 20 1
21 20 21 1
22 14 21 1
23 9 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 26 27 1
29 27 28 1
30 26 29 2
|
|---|
