| Entry |
|
|---|
| Name |
Nalbuphine (INN);
Intapan (TN) |
|---|
| Formula |
C21H27NO4
|
|---|
| Exact mass |
357.1940
|
|---|
| Mol weight |
357.44
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
|
|---|
| Remark |
| Product (DG00822): | D00843<US> |
|
|---|
| Efficacy |
Antidote, Narcotic antagonist, Opioid receptor agonist/antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02A OPIOIDS
N02AF Morphinan derivatives
N02AF02 Nalbuphine
D08246 Nalbuphine (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG00822 Nalbuphine
D08246 Nalbuphine
Analgesic
DG01984 Opioid analgesics
DG00822 Nalbuphine
D08246 Nalbuphine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D08246 Nalbuphine (INN)
OPRK1
D08246 Nalbuphine (INN)
OPRD1
D08246 Nalbuphine (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG00822 Nalbuphine
Analgesic
DG01984 Opioid analgesics
DG00822 Nalbuphine
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 26
1 C1z C 21.9100 -18.1300
2 C8y C 21.9100 -16.8000
3 C1z C 23.1000 -18.8300
4 C1y C 20.7900 -18.7600
5 C1x C 23.1000 -17.5000
6 C8y C 20.7900 -16.1700
7 C8y C 23.1000 -16.1700
8 C1y C 24.2200 -18.1300
9 C1x C 23.1000 -20.0900
10 O2x O 19.5300 -17.4300
11 C1y C 20.7900 -20.0900
12 C1x C 25.3400 -17.5000
13 C8y C 20.7900 -14.8400
14 C1x C 24.2200 -16.8700
15 C8x C 23.1000 -14.8400
16 N1y N 25.3400 -18.8300
17 C1x C 21.9100 -20.7900
18 O1a O 19.7400 -20.7900
19 C8x C 21.9800 -14.2100
20 O1a O 19.7400 -14.2100
21 O1a O 24.3600 -19.7400
22 C1b C 26.7400 -18.8300
23 C1y C 27.4400 -20.0200
24 C1x C 27.0900 -21.3500
25 C1x C 28.4200 -21.7000
26 C1x C 28.7700 -20.3700
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1 #Down
10 4 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 7 15 2
15 8 16 1 #Up
16 9 17 1
17 11 18 1 #Down
18 13 19 2
19 13 20 1
20 6 10 1
21 8 14 1
22 11 17 1
23 12 16 1
24 15 19 1
25 3 21 1 #Up
26 16 22 1
27 22 23 1
28 23 24 1
29 24 25 1
30 25 26 1
31 23 26 1
|
|---|
