KEGG   DRUG: Formocortal
Entry
D04244                      Drug                                   

Name
Formocortal (USAN/INN);
Deflamene (TN)
Formula
C29H38ClFO8
Exact mass
568.2239
Mol weight
569.0586
Structure
Simcomp
Class
Anti-inflammatory
 DG01955  Corticosteroid
  DG02068  Glucocorticoid
Remark
ATC code: S01BA12
Efficacy
Anti-inflammatory (ophthalmic), 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]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BA Corticosteroids, plain
     S01BA12 Formocortal
      D04244  Formocortal (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D04244  Formocortal (USAN/INN)
Other DBs
CAS: 2825-60-7
PubChem: 47206190
ChEMBL: CHEMBL1989587
LigandBox: D04244
NIKKAJI: J7.916B
LinkDB
KCF data

ATOM        39
            1   C1x C    18.8300  -28.6300
            2   C2y C    18.8300  -29.9600
            3   C2x C    20.0200  -30.6600
            4   C2y C    21.1400  -29.9600
            5   C1z C    21.1400  -28.6300
            6   C1x C    20.0200  -28.0000
            7   C2y C    22.3300  -30.6600
            8   C1x C    23.5200  -29.9600
            9   C1y C    23.5200  -28.6300
            10  C1z C    22.3300  -28.0000
            11  C1y C    24.5700  -28.0000
            12  C1z C    24.5700  -26.6700
            13  C1x C    23.5200  -25.9700
            14  C1y C    22.3300  -26.6700
            15  C1x C    26.8800  -28.0000
            16  C1y C    26.8800  -26.6700
            17  C1z C    25.6900  -25.9700
            18  O2a O    17.7100  -30.6600
            19  C1a C    21.1400  -27.3000
            20  X   F    22.3300  -29.2600
            21  O1a O    21.1400  -25.9700
            22  C1a C    24.5700  -25.2700
            23  C5a C    25.6900  -24.1500
            24  O2x O    27.0900  -25.0600
            25  O2x O    28.2800  -26.6700
            26  C1z C    28.4900  -25.0600
            27  C1a C    29.8200  -25.0600
            28  C1a C    28.4900  -23.8000
            29  C4a C    22.3300  -32.0600
            30  O5a O    26.8800  -23.4500
            31  C1b C    24.5000  -23.4500
            32  O7a O    23.3100  -24.1500
            33  O4a O    23.5424  -32.7600
            34  C1b C    16.4738  -30.0029
            35  C1b C    15.2572  -30.7629
            36  X   Cl   14.0098  -30.0999
            37  C7a C    22.0919  -23.4599
            38  C1a C    20.9105  -24.1550
            39  O6a O    22.1502  -22.0506
BOND        43
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 2
            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    2  18 1
            22    5  19 1 #Up
            23   10  20 1 #Down
            24   14  21 1 #Up
            25   12  22 1 #Up
            26   17  23 1 #Up
            27   17  24 1 #Down
            28   16  25 1 #Down
            29   24  26 1
            30   26  25 1
            31   26  27 1
            32   26  28 1
            33    7  29 1
            34   23  30 2
            35   23  31 1
            36   31  32 1
            37   29  33 2
            38   18  34 1
            39   34  35 1
            40   35  36 1
            41   32  37 1
            42   37  38 1
            43   37  39 2

» Japanese version   » Back

DBGET integrated database retrieval system