| Entry |
|
|---|
| Name |
Xorphanol mesylate (USAN) |
|---|
| Formula |
C23H31NO. CH4SO3
|
|---|
| Exact mass |
433.2287
|
|---|
| Mol weight |
433.604
|
|---|
| Structure |
|
|---|
| Class |
Analgesic
DG01984 Opioid analgesics
|
|---|
| Efficacy |
Analgesic, Opioid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Analgesic
DG01984 Opioid analgesics
D06342 Xorphanol mesylate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D06342 Xorphanol mesylate (USAN)
OPRK1
D06342 Xorphanol mesylate (USAN)
OPRD1
D06342 Xorphanol mesylate (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C1z C 19.5201 -20.2859
2 C1y C 20.6827 -20.9661
3 C8y C 19.5201 -18.9315
4 C1x C 20.8047 -19.4140
5 C1x C 18.3400 -20.9486
6 C1y C 21.9387 -20.2336
7 C1y C 20.6827 -22.3149
8 C8y C 20.6886 -18.2572
9 C8x C 18.3341 -18.2572
10 C1x C 23.0487 -19.4081
11 C2y C 18.3283 -22.3032
12 N1y N 23.0487 -20.8905
13 C1x C 21.9326 -18.9432
14 C1x C 19.5025 -22.9776
15 C8x C 20.6886 -16.9025
16 C8y C 18.3341 -16.9025
17 C1b C 24.3974 -20.8905
18 C8x C 19.5258 -16.2225
19 O1a O 17.1656 -16.2225
20 C1y C 25.0775 -22.0648
21 C1x C 24.7288 -23.3729
22 C1x C 26.3973 -22.4077
23 C1x C 26.0426 -23.7157
24 C1a C 21.8791 -23.0156
25 C2a C 17.1094 -23.0017
26 O1d O 28.6718 -17.7224
27 S4a S 28.6718 -19.1180
28 C1a C 27.2764 -19.1180
29 O1d O 30.0676 -19.1180
30 O1d O 28.6718 -20.5135
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 2
8 3 9 1
9 4 10 1
10 5 11 1
11 6 12 1 #Up
12 6 13 1
13 7 14 1
14 8 15 1
15 9 16 2
16 12 17 1
17 15 18 2
18 16 19 1
19 17 20 1
20 20 21 1
21 20 22 1
22 21 23 1
23 8 13 1
24 12 10 1
25 11 14 1
26 16 18 1
27 22 23 1
28 7 24 1 #Up
29 11 25 2
30 26 27 2
31 27 28 1
32 27 29 1
33 27 30 2
|
|---|
