| Entry |
|
|---|
| Name |
Prednylidene (INN) |
|---|
| Formula |
C22H28O5
|
|---|
| Exact mass |
372.1937
|
|---|
| Mol weight |
372.4547
|
|---|
| Structure |
|
|---|
| Simcomp |
|
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| Class |
|
|---|
| Remark |
|
|---|
| Efficacy |
Anti-inflammatory, Glucocorticoid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
H02 CORTICOSTEROIDS FOR SYSTEMIC USE
H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
H02AB Glucocorticoids
H02AB11 Prednylidene
D07230 Prednylidene (INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
D07230 Prednylidene
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D07230 Prednylidene (INN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 27
1 C1z C 28.6300 -17.8500
2 C1y C 28.6300 -19.2500
3 C1x C 31.0100 -19.2500
4 C2y C 31.0100 -17.8500
5 C1z C 29.8200 -17.1500
6 C1x C 27.4400 -17.1500
7 C1y C 26.2500 -17.8500
8 C1y C 26.2500 -19.2500
9 C1y C 27.4400 -19.9500
10 C1z C 25.0600 -19.9500
11 C2y C 25.0600 -21.2800
12 C1x C 26.2500 -21.9800
13 C1x C 27.4400 -21.2800
14 C2x C 23.8700 -19.2500
15 C2x C 22.6800 -19.9500
16 C5x C 22.6800 -21.2800
17 C2x C 23.8700 -21.9800
18 C5a C 29.8200 -15.8200
19 C1b C 30.7300 -14.8400
20 O1a O 32.0600 -15.1900
21 O1a O 31.0100 -16.5200
22 C1a C 28.6300 -16.5200
23 O1a O 25.0600 -17.1500
24 C1a C 25.0600 -18.5500
25 O5x O 21.4900 -21.9800
26 O5a O 28.4900 -15.2600
27 C2a C 32.3114 -17.3338
BOND 30
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1
7 6 7 1
8 7 8 1
9 8 9 1
10 9 2 1
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 9 1
16 10 14 1
17 14 15 2
18 15 16 1
19 16 17 1
20 17 11 2
21 5 18 1 #Up
22 18 19 1
23 19 20 1
24 5 21 1 #Down
25 1 22 1 #Up
26 7 23 1 #Up
27 10 24 1 #Up
28 16 25 2
29 18 26 2
30 4 27 2
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