KEGG   DRUG: Fluprednidene acetateHelp
Entry
D07980                      Drug                                   

Name
Fluprednidene acetate;
Fluprednidene 21-acetate;
Decoderm (TN)
Formula
C24H29FO6
Exact mass
432.1948
Mol weight
432.4819
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: D07AB07 D07XB03
Chemical structure group: DG00414
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
    D07AB Corticosteroids, moderately potent (group II)
     D07AB07 Fluprednidene
      D07980  Fluprednidene acetate
   D07X CORTICOSTEROIDS, OTHER COMBINATIONS
    D07XB Corticosteroids, moderately potent, other combinations
     D07XB03 Fluprednidene
      D07980  Fluprednidene acetate
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D07980  Fluprednidene acetate
BRITE hierarchy
Other DBs
CAS: 1255-35-2
PubChem: 96024675
ChEMBL: CHEMBL3187870
LigandBox: D07980
NIKKAJI: J17.129H
LinkDB All DBs
KCF data Show

ATOM        31
            1   C1z C    25.9000  -17.3600
            2   C1y C    25.9000  -18.7600
            3   C1x C    28.2800  -18.7600
            4   C2y C    28.2800  -17.3600
            5   C1z C    27.0900  -16.6600
            6   C1x C    24.7100  -16.6600
            7   C1y C    23.5200  -17.3600
            8   C1z C    23.5200  -18.7600
            9   C1y C    24.7100  -19.4600
            10  C1z C    22.3300  -19.4600
            11  C2y C    22.3300  -20.7900
            12  C1x C    23.5200  -21.4900
            13  C1x C    24.7100  -20.7900
            14  C2x C    21.1400  -18.7600
            15  C2x C    19.9500  -19.4600
            16  C5x C    19.9500  -20.7900
            17  C2x C    21.1400  -21.4900
            18  C2a C    29.6100  -17.0100
            19  C5a C    27.0900  -15.3300
            20  C1b C    28.0000  -14.3500
            21  O7a O    29.3300  -14.7000
            22  O1a O    28.2800  -16.0300
            23  C1a C    25.9000  -16.0300
            24  O1a O    22.3300  -16.6600
            25  C1a C    22.3300  -18.0600
            26  X   F    23.5200  -20.0900
            27  O5x O    18.7600  -21.4900
            28  O5a O    25.7600  -14.7700
            29  C7a C    30.3155  -13.7056
            30  C1a C    31.6677  -14.0615
            31  O6a O    29.9503  -12.3670
BOND        34
            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    4  18 2
            22    5  19 1 #Up
            23   19  20 1
            24   20  21 1
            25    5  22 1 #Down
            26    1  23 1 #Up
            27    7  24 1 #Up
            28   10  25 1 #Up
            29    8  26 1 #Down
            30   16  27 2
            31   19  28 2
            32   21  29 1
            33   29  30 1
            34   29  31 2

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