| Entry |
|
|---|
| Name |
Oxycodegol phosphate (USAN) |
|---|
| Formula |
C31H49NO10. H3PO4
|
|---|
| Exact mass |
693.3125
|
|---|
| Mol weight |
693.7166
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Analgesic (narcotic), Opioid receptor agonist |
|---|
| Comment |
Treatment of moderate to severe chronic low back pain
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D11425 Oxycodegol phosphate (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 47
1 C1z C 20.9685 -15.7789
2 C8y C 20.9685 -14.3763
3 C1z C 22.1607 -16.4100
4 C1y C 19.8465 -16.4100
5 C8y C 19.8465 -13.7452
6 C8y C 22.1607 -13.7452
7 C1y C 23.3529 -15.7088
8 C1x C 22.1607 -17.7425
9 O1a O 23.3529 -17.3918
10 O2x O 19.1452 -15.0776
11 C1y C 19.8465 -17.7425
12 C8y C 19.8465 -12.4127
13 C1x C 23.3529 -14.3763
14 C8x C 22.1607 -12.4127
15 N1y N 24.4749 -16.4100
16 C1x C 21.0387 -18.4438
17 C8x C 20.9685 -11.7816
18 O2a O 18.6543 -11.7816
19 C1a C 25.8074 -16.4100
20 C1x C 24.4749 -15.0776
21 C1x C 22.2308 -15.0776
22 C1a C 17.4621 -12.4829
23 O2a O 18.6543 -18.4438
24 C1b C 17.3920 -17.7425
25 C1b C 16.1998 -18.4438
26 C1b C 16.1998 -19.8463
27 O2a O 17.4621 -20.5476
28 C1b C 18.6543 -19.8463
29 O2a O 15.0076 -17.7425
30 C1b C 13.7453 -18.4438
31 O2a O 13.7453 -19.8463
32 C1b C 15.0076 -20.5476
33 C1b C 12.5531 -17.7425
34 O2a O 11.3609 -18.4438
35 C1b C 11.3609 -19.8463
36 C1b C 12.5531 -20.5476
37 C1b C 19.8465 -20.5476
38 O2a O 21.0387 -19.8463
39 C1b C 22.3010 -20.5476
40 C1b C 23.4931 -19.8463
41 O2a O 24.6853 -20.6178
42 C1a C 25.8775 -19.9165
43 P1b P 31.4300 -16.3100
44 O1c O 30.0300 -16.3100
45 O1c O 32.8300 -16.3100
46 O1c O 31.4300 -17.7100
47 O1c O 31.4300 -14.9100
BOND 50
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1 #Down
10 4 11 1
11 5 12 2
12 6 13 1
13 6 14 1
14 7 15 1 #Up
15 8 16 1
16 12 17 1
17 12 18 1
18 15 19 1
19 5 10 1
20 7 13 1
21 11 16 1
22 14 17 2
23 15 20 1
24 1 21 1 #Up
25 21 20 1
26 18 22 1
27 11 23 1 #Down
28 23 24 1
29 24 25 1
30 26 27 1
31 27 28 1
32 25 29 1
33 29 30 1
34 31 32 1
35 26 32 1
36 30 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 31 36 1
41 28 37 1
42 37 38 1
43 38 39 1
44 39 40 1
45 40 41 1
46 41 42 1
47 43 44 1
48 43 45 1
49 43 46 1
50 43 47 2
|
|---|
