| Entry |
|
|---|
| Name |
Tramadol (INN);
Amanda (TN) |
|---|
| Formula |
C16H25NO2
|
|---|
| Exact mass |
263.1885
|
|---|
| Mol weight |
263.3752
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Product (DG00824): | D01355<JP/US> |
|
|---|
| Efficacy |
Analgesic, Opioid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP2D6 [HSA: 1565], CYP3A4 [HSA: 1576]
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02A OPIOIDS
N02AX Other opioids
N02AX02 Tramadol
D08623 Tramadol (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
DG00824 Tramadol
D08623 Tramadol
Analgesic
DG01984 Opioid analgesics
DG00824 Tramadol
D08623 Tramadol
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00824 Tramadol
D08623 Tramadol
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00824 Tramadol
D08623 Tramadol
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D08623 Tramadol (INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08623
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
DG00824 Tramadol
Analgesic
DG01984 Opioid analgesics
DG00824 Tramadol
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00824 Tramadol
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00824 Tramadol
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 19
1 C1z C 22.4000 -18.6200
2 C8y C 23.5900 -19.3200
3 C1y C 22.4000 -17.2200
4 C1x C 21.1400 -19.3200
5 O1a O 22.4000 -20.0200
6 C8x C 24.7800 -18.6200
7 C8x C 23.5900 -20.7200
8 C1x C 21.1400 -16.5200
9 C1b C 23.5900 -16.5200
10 C1x C 19.9500 -18.6200
11 C8y C 26.0400 -19.3200
12 C8x C 24.7800 -21.4200
13 C1x C 19.9500 -17.2200
14 N1c N 23.5900 -15.1200
15 C8x C 26.0400 -20.7200
16 O2a O 27.2300 -18.6200
17 C1a C 24.7800 -14.4200
18 C1a C 22.4000 -14.4200
19 C1a C 28.4200 -19.3200
BOND 20
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 1 #Down
9 4 10 1
10 6 11 1
11 7 12 2
12 8 13 1
13 9 14 1
14 11 15 2
15 11 16 1
16 14 17 1
17 14 18 1
18 16 19 1
19 10 13 1
20 12 15 1
|
|---|
