| Entry |
|
|---|
| Name |
Diphenoxylate hydrochloride (USP) |
|---|
| Formula |
C30H32N2O2. HCl
|
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| Exact mass |
488.2231
|
|---|
| Mol weight |
489.0482
|
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| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
|
|---|
| Remark |
| Product (mixture): | D00301<US> |
|
|---|
| Efficacy |
Antidiarrheal, Antiperistaltic, Opioid receptor agonist |
|---|
| Comment |
Component of Colonaid (TN)
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A07 ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
A07D ANTIPROPULSIVES
A07DA Antipropulsives
A07DA01 Diphenoxylate
D03860 Diphenoxylate hydrochloride (USP)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
DG00090 Diphenoxylate
D03860 Diphenoxylate hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D03860 Diphenoxylate hydrochloride (USP)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
DG00090 Diphenoxylate
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 35
1 C8x C 4.2700 -21.9800
2 C8x C 4.2700 -23.3800
3 C8x C 5.4824 -24.0800
4 C8x C 6.6949 -23.3800
5 C8y C 6.6949 -21.9800
6 C8x C 5.4824 -21.2800
7 C8x C 9.1197 -23.3800
8 C8y C 9.1197 -21.9800
9 C1d C 7.9073 -21.2800
10 C8x C 10.3322 -24.0800
11 C8x C 11.5446 -23.3800
12 C8x C 11.5446 -21.9800
13 C8x C 10.3322 -21.2800
14 C1b C 7.9073 -19.8800
15 C1b C 9.1197 -19.1800
16 C3b C 6.6949 -20.5800
17 N3a N 5.4824 -19.8800
18 N1y N 9.1197 -17.7800
19 C1x C 10.3173 -17.0885
20 C1x C 10.3172 -15.6885
21 C1z C 9.1047 -14.9886
22 C1x C 7.9071 -15.6801
23 C1x C 7.9072 -17.0801
24 C7a C 9.1046 -13.5800
25 O6a O 7.8887 -12.8781
26 O7a O 10.3135 -12.8819
27 C8y C 6.8422 -13.7286
28 C8x C 6.8422 -12.3286
29 C8x C 5.6298 -11.6286
30 C8x C 4.4174 -12.3286
31 C8x C 4.4174 -13.7286
32 C8x C 5.6298 -14.4286
33 C1b C 11.5074 -13.5713
34 C1a C 12.6955 -12.8853
35 X Cl 12.7400 -19.2500
BOND 37
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 9 14 1
16 15 14 1
17 9 16 1
18 16 17 3
19 15 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 18 23 1
26 21 24 1
27 24 25 2
28 24 26 1
29 21 27 1
30 27 28 2
31 28 29 1
32 29 30 2
33 30 31 1
34 31 32 2
35 27 32 1
36 26 33 1
37 33 34 1
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