| Entry |
|
|---|
| Name |
Oxycodone hydrochloride hydrate (JP17) |
|---|
| Formula |
C18H21NO4. 3H2O. HCl
|
|---|
| Exact mass |
405.1554
|
|---|
| Mol weight |
405.8704
|
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| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Therapeutic category: | 8119 |
| Product (DG00813): | D00847<US> D05462<JP> |
| Product (mixture): | D11573<US> |
|
|---|
| Efficacy |
Analgesic (narcotic), Opioid receptor agonist |
|---|
| Comment |
Opium alkaloid
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]; CYP2D6 [HSA: 1565]
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02A OPIOIDS
N02AA Natural opium alkaloids
N02AA05 Oxycodone
D05462 Oxycodone hydrochloride hydrate (JP17) <JP>
USP drug classification [BR:br08302]
Analgesics
Opioid Analgesics, Long-acting
Oxycodone
D05462 Oxycodone hydrochloride hydrate (JP17)
Opioid Analgesics, Short-acting
Oxycodone
D05462 Oxycodone hydrochloride hydrate (JP17)
Therapeutic category of drugs in Japan [BR:br08301]
8 Narcotics
81 Alkaloidal narcotics
811 Opium alkaloids
8119 Others
D05462 Oxycodone hydrochloride hydrate (JP17)
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D05462 Oxycodone hydrochloride hydrate (JP17) <JP>
OPRK1
D05462 Oxycodone hydrochloride hydrate (JP17) <JP>
OPRD1
D05462 Oxycodone hydrochloride hydrate (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D05462 Oxycodone hydrochloride hydrate
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D05462
|
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 27
1 X Cl 16.4762 -9.1832
2 O0 O 17.1806 -11.8405
3 C1z C 7.4494 -10.6994
4 C8y C 7.4494 -9.3754
5 C1z C 8.6340 -11.3961
6 C1y C 6.3345 -11.3265
7 C1x C 8.6340 -10.0723
8 C8y C 6.3345 -8.7483
9 C8y C 8.6340 -8.7483
10 C1y C 9.7489 -10.6994
11 C1x C 8.6340 -12.6504
12 O2x O 5.0106 -10.0025
13 C5x C 6.3345 -12.6504
14 C1x C 10.8637 -10.0723
15 C8y C 6.3345 -7.4244
16 C1x C 9.7489 -9.4451
17 C8x C 8.6340 -7.4244
18 N1y N 10.8637 -11.3961
19 C1x C 7.4494 -13.3472
20 O5x O 5.2197 -13.3472
21 C8x C 7.5191 -6.7973
22 O2a O 5.2197 -6.7973
23 C1a C 4.0351 -7.4244
24 O1a O 9.8882 -12.3020
25 C1a C 12.2626 -11.3961
26 O0 O 17.1806 -11.8405
27 O0 O 17.1806 -11.8405
BOND 27
1 3 4 1
2 3 5 1
3 3 6 1
4 3 7 1 #Up
5 4 8 2
6 4 9 1
7 5 10 1
8 5 11 1
9 6 12 1 #Down
10 6 13 1
11 7 14 1
12 8 15 1
13 9 16 1
14 9 17 2
15 10 18 1 #Up
16 11 19 1
17 13 20 2
18 15 21 2
19 15 22 1
20 22 23 1
21 8 12 1
22 10 16 1
23 13 19 1
24 14 18 1
25 17 21 1
26 5 24 1 #Up
27 18 25 1
BRACKET 1 14.9100 -12.8100 14.9100 -10.8500
1 17.7100 -10.8500 17.7100 -12.8100
1 3
ORIGINAL 1 2
REPEAT 1 26 27
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