KEGG   DRUG: Diflucortolone valerate
Entry
D01764                      Drug                                   

Name
Diflucortolone valerate (JP17);
Afusona (TN)
Formula
C27H36F2O5
Exact mass
478.2531
Mol weight
478.5685
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
Therapeutic category: 2646
ATC code: D07AC06 D07XC04
Chemical structure group: DG00417
Product (DG00417): D01764<JP>
Product (mixture): D04692<JP>
Efficacy
Anti-inflammatory, Glucocorticoid receptor agonist
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  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
      D01764  Diflucortolone valerate (JP17) <JP>
   D07X CORTICOSTEROIDS, OTHER COMBINATIONS
    D07XC Corticosteroids, potent, other combinations
     D07XC04 Diflucortolone
      D01764  Diflucortolone valerate (JP17) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  26  Epidermides
   264  Analgesics, anti-itchings, astringents, anti-inflammatory agents
    2646  Adrenocorticotropic hormones
     D01764  Diflucortolone valerate (JP17)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D01764  Diflucortolone valerate (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01764  Diflucortolone valerate
Topical steroids potency [br08317.html]
 Classification in Japan
  D01764
Other DBs
CAS: 59198-70-8
PubChem: 7848827
ChEBI: 31484
ChEMBL: CHEMBL2358130
LigandBox: D01764
NIKKAJI: J12.073A
LinkDB
KCF data

ATOM        34
            1   C1b C    31.8654  -12.1970
            2   O7a O    30.7091  -12.8841
            3   C7a C    29.5392  -12.2312
            4   C1b C    28.3829  -12.9181
            5   O6a O    29.5211  -10.8846
            6   C5a C    33.0353  -12.8500
            7   C2x C    26.0133  -17.3146
            8   C5x C    26.0133  -18.6613
            9   C2x C    27.1823  -19.3347
            10  C2x C    27.1823  -16.6413
            11  C1z C    28.3446  -17.3146
            12  C2y C    28.3387  -18.6613
            13  C1y C    29.5022  -19.3398
            14  C1x C    30.6714  -18.6713
            15  C1z C    29.5138  -16.6464
            16  C1y C    30.6714  -17.3275
            17  C1x C    30.6935  -14.6412
            18  C1y C    29.5247  -15.3033
            19  C1z C    31.8512  -15.3221
            20  C1y C    31.8351  -16.6614
            21  C1x C    34.1542  -16.6895
            22  C1y C    34.1706  -15.3504
            23  C1y C    33.0189  -14.6668
            24  C1a C    31.8422  -13.9751
            25  O1a O    28.3641  -14.6202
            26  C1a C    28.3325  -15.9679
            27  C1a C    35.3449  -14.6911
            28  X   F    29.5026  -17.9880
            29  X   F    29.4887  -20.6814
            30  O5x O    24.8473  -19.3354
            31  O5a O    34.2023  -12.1923
            32  C1b C    27.1512  -12.2268
            33  C1b C    25.9439  -12.9435
            34  C1a C    24.7458  -12.2709
BOND        37
            1     3   4 1
            2     1   2 1
            3     6   1 1
            4    15  16 1
            5    16  20 1
            6    19  17 1
            7    17  18 1
            8    18  15 1
            9     7   8 1
            10    8   9 1
            11    9  12 2
            12   11  10 1
            13   19  20 1
            14   21  22 1
            15   22  23 1
            16   23  19 1
            17   20  21 1
            18   23   6 1 #Up
            19   10   7 2
            20   19  24 1 #Up
            21    2   3 1
            22    3   5 2
            23   18  25 1 #Up
            24   11  26 1 #Up
            25   22  27 1 #Down
            26   11  12 1
            27   12  13 1
            28   15  28 1 #Down
            29   13  14 1
            30   13  29 1 #Down
            31   14  16 1
            32    8  30 2
            33   15  11 1
            34    6  31 2
            35    4  32 1
            36   32  33 1
            37   33  34 1

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