| Entry |
|
|---|
| Name |
Trimebutine (INN);
Trimebutina (TN) |
|---|
| Formula |
C22H29NO5
|
|---|
| Exact mass |
387.2046
|
|---|
| Mol weight |
387.4694
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Analgesic
DG01587 Opioid receptor agonist/antagonist
|
|---|
| Remark |
| Product (DG00031): | D01500<JP> |
|
|---|
| Efficacy |
Antispasmodic, Muscarinic acetylcholine receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03AA Synthetic anticholinergics, esters with tertiary amino group
A03AA05 Trimebutine
D08639 Trimebutine (INN)
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Trimebutine
D08639 Trimebutine (INN)
Drug groups [BR:br08330]
Analgesic
DG01587 Opioid receptor agonist/antagonist
DG00031 Trimebutine
D08639 Trimebutine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D08639 Trimebutine (INN)
OPRK1
D08639 Trimebutine (INN)
Drug groups [BR:br08330]
Analgesic
DG01587 Opioid receptor agonist/antagonist
DG00031 Trimebutine
|
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| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 C8y C 25.3400 -19.0400
2 C8x C 25.3400 -17.6400
3 C8y C 26.6000 -16.9400
4 C8y C 27.7900 -17.6400
5 C8y C 27.7900 -19.0400
6 C8x C 26.6000 -19.7400
7 O2a O 29.0500 -16.9400
8 C1a C 30.2400 -17.6400
9 O2a O 26.6000 -15.4700
10 C1a C 27.7900 -14.7700
11 O2a O 29.0500 -19.7400
12 C1a C 29.0500 -21.1400
13 C7a C 24.1500 -19.7400
14 O7a O 22.9600 -19.0400
15 C1b C 21.7000 -19.7400
16 O6a O 24.1500 -21.1400
17 C1d C 20.5100 -19.0400
18 N1c N 19.3200 -19.7400
19 C1a C 18.0600 -18.9700
20 C1a C 19.3200 -21.0700
21 C8y C 20.5100 -17.6400
22 C1b C 20.5100 -20.4400
23 C1a C 21.7000 -21.1400
24 C8x C 21.7700 -16.9400
25 C8x C 21.7700 -15.5400
26 C8x C 20.5100 -14.8400
27 C8x C 19.3200 -15.5400
28 C8x C 19.3200 -16.9400
BOND 29
1 1 2 2
2 2 3 1
3 4 7 1
4 3 4 2
5 7 8 1
6 5 11 1
7 11 12 1
8 4 5 1
9 1 13 1
10 3 9 1
11 13 14 1
12 5 6 2
13 14 15 1
14 9 10 1
15 6 1 1
16 13 16 2
17 15 17 1
18 17 18 1
19 18 19 1
20 18 20 1
21 17 21 1
22 17 22 1
23 22 23 1
24 21 24 1
25 24 25 2
26 25 26 1
27 26 27 2
28 27 28 1
29 21 28 2
|
|---|
