| Entry |
|
|---|
| Name |
Pipethanate (INN);
Piperilate |
|---|
| Formula |
C21H25NO3
|
|---|
| Exact mass |
339.1834
|
|---|
| Mol weight |
339.4281
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Antispasmodic, Muscarinic acetylcholine receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
DG01255 Pipethanate
D08384 Pipethanate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D08384 Pipethanate (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
DG01255 Pipethanate
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 25
1 C1x C 19.3200 -18.6200
2 N1y N 20.5100 -19.3200
3 C1b C 21.7700 -18.6200
4 C1b C 22.9600 -19.3200
5 O7a O 24.1500 -18.6200
6 C7a C 25.4100 -19.3200
7 C1d C 26.6000 -18.6200
8 C8y C 27.7900 -19.3200
9 C8x C 28.9800 -18.6200
10 C1x C 18.1300 -19.3200
11 C1x C 18.1300 -20.7200
12 C1x C 19.3200 -21.4200
13 C1x C 20.5100 -20.7200
14 C8y C 26.6000 -17.2200
15 C8x C 27.7900 -16.5200
16 C8x C 27.7900 -15.1200
17 C8x C 26.6000 -14.4200
18 C8x C 25.4100 -15.1200
19 C8x C 25.4100 -16.5200
20 C8x C 27.7900 -20.7200
21 C8x C 28.9800 -21.4200
22 C8x C 30.2400 -20.7200
23 C8x C 30.2400 -19.3200
24 O1a O 27.7900 -17.9200
25 O6a O 25.4100 -20.7200
BOND 27
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 1 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 2 1
14 7 14 1
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 14 19 2
21 8 20 2
22 20 21 1
23 21 22 2
24 22 23 1
25 23 9 2
26 7 24 1
27 6 25 2
|
|---|
