| Entry |
|
|---|
| Name |
Atropine oxide (INN);
Apitropin (TN) |
|---|
| Formula |
C17H23NO4
|
|---|
| Exact mass |
305.1627
|
|---|
| Mol weight |
305.3688
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Antispasmodic, Muscarinic acetylcholine receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D07477 Atropine oxide (INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 22
1 C1x C 18.9000 -18.7600
2 C1x C 19.2500 -17.5700
3 C1y C 20.0900 -18.4800
4 C1y C 20.4400 -17.2900
5 N2y N 19.1800 -15.9600
6 C1x C 21.9800 -18.4800
7 C1x C 21.7000 -17.2900
8 C1y C 23.0300 -19.0400
9 O7a O 24.0800 -19.8800
10 C7a C 25.2700 -19.8800
11 C1c C 25.9000 -18.8300
12 O6a O 25.9000 -21.0700
13 C8y C 27.1600 -18.8300
14 C1b C 25.2700 -17.7800
15 O1a O 25.9000 -16.7300
16 C8x C 27.8600 -20.0900
17 C8x C 29.2600 -20.0900
18 C8x C 29.9600 -18.8300
19 C8x C 29.2600 -17.6400
20 C8x C 27.8600 -17.6400
21 C1a C 18.4100 -14.7700
22 O3a O 19.8800 -14.7476
BOND 24
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 3 6 1
6 4 7 1
7 6 8 1
8 8 9 1 #Down
9 9 10 1
10 10 11 1
11 10 12 2
12 11 13 1
13 11 14 1
14 14 15 1
15 4 5 1
16 7 8 1
17 13 16 2
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 13 20 1
23 5 21 1
24 5 22 2
|
|---|
