| Entry |
|
|---|
| Name |
Prostalene (USAN);
Synchrocept (TN) |
|---|
| Formula |
C22H36O5
|
|---|
| Exact mass |
380.2563
|
|---|
| Mol weight |
380.52
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
Oxytocic |
|---|
| Comment |
Prostaglandin F2 alpha analogue
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Prostaglandin
PTGFR
D05642 Prostalene (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 27
1 C1y C 21.4180 -21.2459
2 C1y C 21.4407 -19.8725
3 C1y C 20.0286 -19.5591
4 C1x C 19.3158 -20.7387
5 C1y C 20.2173 -21.7811
6 O1a O 19.4982 -18.3002
7 O1a O 19.9066 -23.1114
8 C2b C 22.6670 -22.3034
9 C2b C 23.8583 -21.6473
10 C1d C 25.0369 -22.3597
11 C1b C 26.2344 -21.6999
12 O1a O 24.0547 -23.5502
13 C1a C 26.0191 -23.4113
14 C1b C 27.4301 -22.4224
15 C1b C 28.6400 -21.7560
16 C1b C 29.8091 -22.4629
17 C1a C 31.0226 -21.7946
18 C1b C 22.6324 -19.1800
19 C2b C 23.8449 -19.8800
20 C0 C 25.2449 -19.8800
21 C2b C 26.6449 -19.8800
22 C1b C 27.8824 -19.1800
23 C1b C 29.0949 -19.8800
24 C7a C 30.3073 -19.1800
25 O7a O 31.5197 -19.8800
26 C1a C 32.7322 -19.1800
27 O6a O 30.3073 -17.7800
BOND 27
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 3 6 1 #Down
7 5 7 1 #Down
8 8 9 2
9 9 10 1
10 10 11 1
11 1 8 1 #Up
12 10 12 1 #Up
13 10 13 1 #Down
14 11 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 2 18 1 #Down
19 18 19 1
20 19 20 2
21 20 21 2
22 21 22 1
23 22 23 1
24 23 24 1
25 24 25 1
26 25 26 1
27 24 27 2
|
|---|
