| Entry |
|
|---|
| Name |
Cortancyl;
Prednisone 21-acetate;
21-Acetoxy-17alpha-hydroxypregna-1,4-diene-3,11,20-trione
|
|---|
| Formula |
C23H28O6
|
|---|
| Exact mass |
400.1886
|
|---|
| Mol weight |
400.4648
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A07 ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
A07E INTESTINAL ANTIINFLAMMATORY AGENTS
A07EA Corticosteroids acting locally
A07EA03 Prednisone
D08416 Prednisone acetate
H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
H02 CORTICOSTEROIDS FOR SYSTEMIC USE
H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
H02AB Glucocorticoids
H02AB07 Prednisone
D08416 Prednisone acetate
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG00094 Prednisone
D08416 Prednisone acetate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D08416 Prednisone acetate
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 C2x C 21.0487 -21.3705
2 C5x C 21.0487 -22.7321
3 C2x C 22.2278 -23.4128
4 C2y C 23.4068 -22.7321
5 C1z C 23.4068 -21.3705
6 C2x C 22.2278 -20.6898
7 C1x C 24.5860 -23.4128
8 C1x C 25.7650 -22.7321
9 C1y C 25.7650 -21.3705
10 C1y C 24.5860 -20.6898
11 C1y C 26.9442 -20.6898
12 C1z C 26.9442 -19.3284
13 C1x C 25.7650 -18.6477
14 C5x C 24.5860 -19.3284
15 C1x C 29.3022 -20.6898
16 C1x C 29.3022 -19.3284
17 C1z C 28.1231 -18.6477
18 C1a C 26.9712 -17.9670
19 C5a C 28.1283 -17.2862
20 C1a C 23.4038 -19.9699
21 C1b C 29.3127 -16.6085
22 O5x O 19.8448 -23.4274
23 O7a O 30.5270 -17.3160
24 O1a O 29.4700 -18.2700
25 O5a O 26.9290 -16.5875
26 O5x O 23.3579 -18.6194
27 C7a C 31.7480 -16.6177
28 C1a C 32.9687 -17.3295
29 O6a O 31.7533 -15.1903
BOND 32
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 12 18 1 #Up
22 17 19 1 #Up
23 5 20 1 #Up
24 19 21 1
25 2 22 2
26 21 23 1
27 17 24 1 #Down
28 19 25 2
29 14 26 2
30 23 27 1
31 27 28 1
32 27 29 2
|
|---|
