KEGG   DRUG: DiflucortoloneHelp
Entry
D03812                      Drug                                   

Name
Diflucortolone (USAN)
Formula
C22H28F2O4
Exact mass
394.1956
Mol weight
394.4521
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: D07AC06 D07XC04
Chemical structure group: DG00417
Product (DG00417): D01764<JP>
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug 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)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D03812  Diflucortolone (USAN)
BRITE hierarchy
Other DBs
CAS: 2607-06-9
PubChem: 17397900
ChEMBL: CHEMBL509924
LigandBox: D03812
NIKKAJI: J7.627I
LinkDB All DBs
KCF data Show

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

» Japanese version   » Back

DBGET integrated database retrieval system