| Entry |
|
|---|
| Name |
Diflucortolone (USAN) |
|---|
| Formula |
C22H28F2O4
|
|---|
| Exact mass |
394.1956
|
|---|
| Mol weight |
394.4521
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
|
|---|
| Remark |
| Product (DG00417): | D01764<JP> |
|
|---|
| Efficacy |
Anti-inflammatory, Glucocorticoid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
D DERMATOLOGICALS
D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
D07A CORTICOSTEROIDS, PLAIN
D07AC Corticosteroids, potent (group III)
D07AC06 Diflucortolone
D03812 Diflucortolone (USAN)
D07X CORTICOSTEROIDS, OTHER COMBINATIONS
D07XC Corticosteroids, potent, other combinations
D07XC04 Diflucortolone
D03812 Diflucortolone (USAN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG00417 Diflucortolone
D03812 Diflucortolone
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D03812 Diflucortolone (USAN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG00417 Diflucortolone
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 C1b C 35.8096 -14.4584
2 O1a O 34.6382 -15.1545
3 C5a C 36.9948 -15.1199
4 C2x C 29.8809 -19.4442
5 C5x C 29.8809 -20.8086
6 C2x C 31.0652 -21.4907
7 C2x C 31.0652 -18.7620
8 C1z C 32.2428 -19.4442
9 C2y C 32.2368 -20.8086
10 C1y C 33.4154 -21.4959
11 C1x C 34.6001 -20.8187
12 C1z C 33.4272 -18.7672
13 C1y C 34.6001 -19.4573
14 C1x C 34.6224 -16.7357
15 C1y C 33.4383 -17.4065
16 C1z C 35.7952 -17.4256
17 C1y C 35.7789 -18.7824
18 C1x C 38.1285 -18.7409
19 C1y C 38.1450 -17.4542
20 C1y C 36.9783 -16.7616
21 C1a C 35.7861 -16.0609
22 O1a O 32.2625 -16.7145
23 C1a C 32.2305 -18.0798
24 C1a C 39.3347 -16.7863
25 X F 33.4858 -20.1264
26 X F 33.4019 -22.8551
27 O5x O 28.6996 -21.4914
28 O5a O 38.1771 -14.4536
BOND 31
1 1 2 1
2 3 1 1
3 12 13 1
4 13 17 1
5 16 14 1
6 14 15 1
7 15 12 1
8 4 5 1
9 5 6 1
10 6 9 2
11 8 7 1
12 16 17 1
13 18 19 1
14 19 20 1
15 20 16 1
16 17 18 1
17 20 3 1 #Up
18 7 4 2
19 16 21 1 #Up
20 15 22 1 #Up
21 8 23 1 #Up
22 19 24 1 #Down
23 8 9 1
24 9 10 1
25 12 25 1 #Down
26 10 11 1
27 10 26 1 #Down
28 11 13 1
29 5 27 2
30 12 8 1
31 3 28 2
|
|---|
