| Entry |
|
|---|
| Name |
Isomethadone (INN) |
|---|
| Formula |
C21H27NO
|
|---|
| Exact mass |
309.2093
|
|---|
| Mol weight |
309.4452
|
|---|
| Structure |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
|
|---|
| Efficacy |
Analgesic (narcotic), Opioid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
D12676 Isomethadone
Analgesic
DG01984 Opioid analgesics
D12676 Isomethadone
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D12676 Isomethadone (INN)
OPRD1
D12676 Isomethadone (INN)
Narcotics and psychotropics in Japan [br08308.html]
Narcotics by Control Act Article 2 Table 1 (74 substances)
D12676
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 C8x C 5.9051 -27.9496
2 C8x C 5.9051 -29.3456
3 C8x C 7.0219 -30.0436
4 C8x C 8.2084 -29.3456
5 C8y C 8.2084 -27.9496
6 C8x C 7.0219 -27.3214
7 C8x C 10.5117 -29.3456
8 C8y C 10.5117 -27.9496
9 C1d C 9.3252 -27.3214
10 C8x C 11.6285 -30.0436
11 C8x C 12.8151 -29.3456
12 C8x C 12.8151 -27.9496
13 C8x C 11.6285 -27.3214
14 C5a C 7.3008 -26.2045
15 O5a O 7.3008 -24.8085
16 C1b C 6.1841 -26.9025
17 C1a C 5.0673 -26.2045
18 C1c C 9.3252 -25.9214
19 C1b C 10.5353 -25.2227
20 C1a C 8.0920 -25.2097
21 N1c N 10.5353 -23.8227
22 C1a C 11.7836 -23.1021
23 C1a C 9.3397 -23.1319
BOND 24
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 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 9 14 1
16 14 15 2
17 14 16 1
18 16 17 1
19 9 18 1
20 18 19 1
21 18 20 1
22 19 21 1
23 21 22 1
24 21 23 1
|
|---|
