| Entry |
|
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| Name |
Oxycodone terephthalate (USP) |
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| Formula |
(C18H21NO4)2. C8H6O4
|
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| Exact mass |
796.3207
|
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| Mol weight |
796.86
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| Structure |
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| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
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| Remark |
| Product (DG00813): | D05312<US> D00847<US> D05462<JP> |
|
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| Efficacy |
Analgesic (narcotic), Opioid receptor agonist |
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| Comment |
Component of Percodan (TN)
Opium alkaloid
|
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| Target |
|
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]; CYP2D6 [HSA: 1565]
|
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| Interaction |
|
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| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02A OPIOIDS
N02AA Natural opium alkaloids
N02AA05 Oxycodone
D03783 Oxycodone terephthalate (USP)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG00813 Oxycodone
D03783 Oxycodone terephthalate
Analgesic
DG01984 Opioid analgesics
DG00813 Oxycodone
D03783 Oxycodone terephthalate
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00813 Oxycodone
D03783 Oxycodone terephthalate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00813 Oxycodone
D03783 Oxycodone terephthalate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D03783 Oxycodone terephthalate (USP)
OPRK1
D03783 Oxycodone terephthalate (USP)
OPRD1
D03783 Oxycodone terephthalate (USP)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D03783
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG00813 Oxycodone
Analgesic
DG01984 Opioid analgesics
DG00813 Oxycodone
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00813 Oxycodone
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00813 Oxycodone
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 58
1 C8y C 18.5189 -7.7038
2 C6a C 18.5189 -9.1090
3 C8x C 17.3246 -7.0013
4 C8x C 19.7133 -7.0013
5 O6a O 19.7836 -9.8116
6 O6a O 17.3246 -9.8116
7 C8x C 17.3246 -5.5961
8 C8x C 19.7133 -5.5961
9 C8y C 18.5189 -4.9638
10 C6a C 18.5189 -3.5586
11 O6a O 19.7836 -2.8560
12 O6a O 17.3246 -2.8560
13 C1z C 7.4981 -7.5172
14 C8y C 7.4921 -6.1668
15 C1z C 8.6630 -8.1838
16 C1y C 6.3447 -8.1954
17 C8y C 6.3272 -5.4945
18 C8y C 8.6572 -5.4945
19 C1y C 9.8223 -7.4999
20 C1x C 8.6687 -9.5168
21 O1a O 9.8223 -9.1229
22 O2x O 5.6433 -6.8626
23 C5x C 6.3505 -9.5284
24 C8y C 6.3272 -4.1499
25 C1x C 9.8223 -6.1609
26 C8x C 8.6572 -4.1499
27 N1y N 10.9813 -8.1721
28 C1x C 7.5154 -10.1950
29 O5x O 5.1739 -10.1891
30 C8x C 7.4921 -3.4777
31 O2a O 5.1566 -3.4777
32 C1a C 12.3259 -8.1721
33 C1x C 10.9813 -6.8498
34 C1x C 8.7035 -6.8912
35 C1a C 3.9257 -4.1923
36 C1z C 7.4981 -7.5172
37 C8y C 7.4921 -6.1668
38 C8y C 6.3272 -5.4945
39 C8y C 6.3272 -4.1499
40 C8x C 7.4921 -3.4777
41 C8x C 8.6572 -4.1499
42 C8y C 8.6572 -5.4945
43 C1x C 9.8223 -6.1609
44 C1y C 9.8223 -7.4999
45 C1z C 8.6630 -8.1838
46 C1x C 8.6687 -9.5168
47 C1x C 7.5154 -10.1950
48 C5x C 6.3505 -9.5284
49 C1y C 6.3447 -8.1954
50 O2x O 5.6433 -6.8626
51 O5x O 5.1739 -10.1891
52 O1a O 9.8223 -9.1229
53 N1y N 10.9813 -8.1721
54 C1a C 12.3259 -8.1721
55 C1x C 10.9813 -6.8498
56 C1x C 8.7035 -6.8912
57 O2a O 5.1566 -3.4777
58 C1a C 3.9257 -4.1923
BOND 66
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 4 8 1
8 7 9 1
9 9 10 1
10 10 11 1
11 10 12 2
12 8 9 2
13 13 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 14 18 2
18 15 19 1
19 15 20 1
20 15 21 1 #Up
21 16 22 1 #Down
22 16 23 1
23 17 24 2
24 18 25 1
25 18 26 1
26 19 27 1 #Up
27 20 28 1
28 23 29 2
29 24 30 1
30 24 31 1
31 27 32 1
32 17 22 1
33 19 25 1
34 23 28 1
35 26 30 2
36 27 33 1
37 13 34 1 #Up
38 34 33 1
39 31 35 1
40 36 37 1
41 36 45 1
42 36 49 1
43 37 38 1
44 37 42 2
45 45 44 1
46 45 46 1
47 45 52 1 #Up
48 49 50 1 #Down
49 49 48 1
50 38 39 2
51 42 43 1
52 42 41 1
53 44 53 1 #Up
54 46 47 1
55 48 51 2
56 39 40 1
57 39 57 1
58 53 54 1
59 38 50 1
60 44 43 1
61 48 47 1
62 41 40 2
63 53 55 1
64 36 56 1 #Up
65 56 55 1
66 57 58 1
BRACKET 1 2.1000 -11.0600 2.1000 -2.3100
1 14.2800 -2.3100 14.2800 -11.0600
1 2
ORIGINAL 1 13 14 17 24 30 26 18 25 19 15 20 28 23 16 22 29
1 21 27 32 33 34 31 35
REPEAT 1 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51
1 52 53 54 55 56 57 58
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