| Entry |
|
|---|
| Name |
Resocortol (INN) |
|---|
| Formula |
C22H32O4
|
|---|
| Exact mass |
360.2301
|
|---|
| Mol weight |
360.4871
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
|
|---|
| Remark |
|
|---|
| Efficacy |
Anti-inflammatory, Glucocorticoid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG01545 Resocortol
D08476 Resocortol
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D08476 Resocortol (INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG01545 Resocortol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 26
1 C1z C 24.0100 -17.2200
2 C1y C 24.0100 -18.6200
3 C1z C 25.2000 -16.5200
4 C1x C 22.8200 -16.5200
5 C1y C 22.8900 -19.2500
6 C1x C 26.3900 -18.6200
7 C1x C 26.3900 -17.2200
8 C5a C 25.2000 -15.1900
9 O1a O 26.5300 -16.2400
10 C1y C 21.6300 -17.2200
11 C1y C 21.6300 -18.6200
12 C1x C 22.8900 -20.6500
13 C1b C 26.3900 -14.4900
14 O5a O 23.9400 -14.4900
15 O1a O 20.4400 -16.5200
16 C1z C 20.5100 -19.2500
17 C1x C 21.7000 -21.3500
18 C1a C 27.6500 -15.2600
19 C2y C 20.5100 -20.6500
20 C1x C 19.3200 -18.6200
21 C2x C 19.3200 -21.3500
22 C1x C 18.1300 -19.3200
23 C5x C 18.1300 -20.7200
24 O5x O 16.9400 -21.3500
25 C1a C 23.9400 -15.9600
26 C1a C 20.5800 -17.9900
BOND 29
1 3 8 1 #Up
2 3 9 1 #Down
3 4 10 1
4 5 11 1
5 5 12 1
6 8 13 1
7 8 14 2
8 10 15 1 #Up
9 11 16 1
10 12 17 1
11 13 18 1
12 16 19 1
13 16 20 1
14 19 21 2
15 20 22 1
16 21 23 1
17 23 24 2
18 6 7 1
19 10 11 1
20 17 19 1
21 22 23 1
22 1 2 1
23 1 3 1
24 1 4 1
25 2 5 1
26 2 6 1
27 1 25 1 #Up
28 3 7 1
29 16 26 1 #Up
|
|---|
