| Entry |
|
|---|
| Name |
Cimetropium bromide (JAN/INN);
Alginor (TN) |
|---|
| Formula |
C21H28NO4. Br
|
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| Exact mass |
437.1202
|
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| Mol weight |
438.3553
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Parasympatholytic, Muscarinic acetylcholine receptor antagonist |
|---|
| Comment |
Tropane derivative
|
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| Target |
|
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Interaction |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03B BELLADONNA AND DERIVATIVES, PLAIN
A03BB Belladonna alkaloids, semisynthetic, quaternary ammonium compounds
A03BB05 Cimetropium bromide
D07099 Cimetropium bromide (JAN/INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
D07099 Cimetropium bromide
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D07099 Cimetropium bromide (JAN/INN)
|
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| Other DBs |
|
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| KCF data |
ATOM 27
1 X Br 25.0936 -19.6490 #-
2 C1y C 14.6964 -16.1237
3 C1y C 14.0704 -17.1671
4 C1y C 15.6007 -15.7759
5 O2x O 13.1661 -16.1237
6 C1y C 15.3920 -16.6802
7 N2y N 14.9769 -14.5921 #+
8 C1x C 16.9223 -15.7759
9 C1x C 16.9223 -16.6802
10 C1a C 15.6747 -13.1300
11 C1y C 18.1744 -17.2367
12 O7a O 18.1683 -18.2819
13 C7a C 19.5498 -19.1348
14 O6a O 19.5135 -20.4723
15 C1c C 20.6422 -18.4735
16 C8y C 20.6785 -17.1360
17 C1b C 21.8536 -19.1576
18 O1a O 23.0407 -18.4700
19 C1b C 14.0030 -13.3383
20 C8x C 21.8657 -16.4484
21 C8x C 21.8663 -15.0503
22 C8x C 20.7249 -14.3662
23 C8x C 19.4771 -15.0196
24 C8x C 19.4672 -16.4519
25 C1y C 12.6119 -13.3383
26 C1x C 11.4051 -14.0305
27 C1x C 11.4201 -12.6587
BOND 30
1 2 3 1
2 2 4 1
3 2 5 1
4 3 6 1
5 4 7 1
6 4 8 1
7 6 9 1
8 7 10 1
9 8 11 1
10 3 5 1
11 6 7 1
12 9 11 1
13 12 13 1
14 13 14 2
15 13 15 1
16 15 16 1
17 11 12 1
18 15 17 1 #Up
19 17 18 1
20 7 19 1
21 16 20 2
22 20 21 1
23 21 22 2
24 22 23 1
25 23 24 2
26 16 24 1
27 19 25 1
28 26 25 1
29 25 27 1
30 27 26 1
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