| Entry |
|
|---|
| Name |
Oxilorphan (USAN/INN) |
|---|
| Formula |
C20H27NO2
|
|---|
| Exact mass |
313.2042
|
|---|
| Mol weight |
313.43
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01562 kappa-Opioid receptor agonist
|
|---|
| Efficacy |
Narcotic antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01562 kappa-Opioid receptor agonist
D05299 Oxilorphan
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRK1
D05299 Oxilorphan (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 C8y C 28.7000 -14.4900
2 C8x C 28.7000 -15.8200
3 C8y C 29.8900 -16.5200
4 C8y C 31.0800 -15.8200
5 C8x C 31.0800 -14.4900
6 C8x C 29.8900 -13.7900
7 O1a O 27.5800 -13.7900
8 C1z C 29.8900 -17.8500
9 C1z C 31.0800 -18.5500
10 C1y C 32.2700 -17.8500
11 C1x C 32.2700 -16.5200
12 C1x C 28.7000 -18.5500
13 C1x C 28.7000 -19.9500
14 C1x C 29.8900 -20.5800
15 C1x C 31.0800 -19.9500
16 N1y N 33.4600 -18.5500
17 C1x C 31.0800 -17.2200
18 C1x C 33.4600 -17.2200
19 O1a O 32.1300 -19.5300
20 C1b C 34.8600 -18.5500
21 C1y C 35.5600 -19.8100
22 C1x C 36.6921 -20.4181
23 C1x C 35.5691 -21.1307
BOND 27
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 3 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 4 11 1
13 8 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 9 15 1
18 10 16 1 #Up
19 8 17 1 #Up
20 16 18 1
21 17 18 1
22 9 19 1 #Up
23 16 20 1
24 20 21 1
25 22 21 1
26 21 23 1
27 22 23 1
|
|---|
