| Entry |
|
|---|
| Name |
Etomidoline (JAN/INN);
Smedolin (TN) |
|---|
| Formula |
C23H29N3O2
|
|---|
| Exact mass |
379.2260
|
|---|
| Mol weight |
379.49
|
|---|
| Structure |
|
|---|
| Class |
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
|
|---|
| 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
D01359 Etomidoline
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D01359 Etomidoline (JAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 C8x C 30.2592 -14.9592
2 C8x C 31.6577 -14.9592
3 C8y C 32.3569 -13.7481
4 C8x C 31.6577 -12.5372
5 C8x C 30.2592 -12.5372
6 C8y C 29.5600 -13.7481
7 O2a O 33.7553 -13.7481
8 C1b C 34.4545 -14.9592
9 C1b C 35.8529 -14.9592
10 N1y N 36.5521 -16.1703
11 C1x C 35.8480 -17.3742
12 C1x C 36.5472 -18.5852
13 C1x C 37.9456 -18.5852
14 C1x C 38.6448 -17.3742
15 C1x C 37.9456 -16.1631
16 C8x C 23.9568 -15.4811
17 C8x C 25.1783 -14.7937
18 C8x C 25.1474 -17.5968
19 C8x C 23.9412 -16.8825
20 C8y C 26.3688 -16.9093
21 C8y C 26.3794 -15.5000
22 C1y C 27.7231 -15.0749
23 N1y N 28.5425 -16.2213
24 C5x C 27.7056 -17.3549
25 C1b C 29.9409 -16.2321
26 C1a C 30.6308 -17.4485
27 O5x O 28.1277 -18.6882
28 N1b N 28.1655 -13.7485
BOND 31
1 12 13 1
2 13 14 1
3 14 15 1
4 15 10 1
5 1 2 2
6 7 8 1
7 2 3 1
8 8 9 1
9 3 4 2
10 9 10 1
11 4 5 1
12 5 6 2
13 6 1 1
14 20 21 2
15 21 22 1
16 22 23 1
17 23 24 1
18 24 20 1
19 16 17 2
20 17 21 1
21 20 18 1
22 18 19 2
23 19 16 1
24 23 25 1
25 3 7 1
26 25 26 1
27 10 11 1
28 24 27 2
29 11 12 1
30 22 28 1
31 28 6 1
|
|---|
