KEGG   DRUG: D03792Help
Entry
D03792                      Drug                                   

Name
Dicirenone (USAN)
Formula
C26H36O5
Exact mass
428.2563
Mol weight
428.561
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Hypotensive;
Aldosterone antagonist
Target
mineralocorticoid receptor antagonist [HSA:4306] [KO:K08555]
  Pathway
hsa04960  Aldosterone-regulated sodium reabsorption  
 
Structure map
Glucocorticoid and meneralocorticoid receptor agonists/antagonists
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    mineralocorticoid receptor
     Dicirenone
      D03792  Dicirenone (USAN)
BRITE hierarchy
Other DBs
CAS: 
41020-79-5
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        31
            1   C1z C    26.1100  -22.1200
            2   C1z C    24.8500  -22.8200
            3   C1x C    27.2300  -22.8200
            4   O7x O    27.2300  -21.3500
            5   C1x C    24.9900  -21.3500
            6   C1y C    24.8500  -24.1500
            7   C1x C    23.7300  -22.1200
            8   C1a C    24.2200  -21.2800
            9   C1x C    27.2300  -24.1500
            10  C7x C    26.8100  -20.0200
            11  C1x C    25.4100  -20.0200
            12  C1y C    23.7300  -24.8500
            13  C1x C    22.5400  -22.8200
            14  O6a O    27.5800  -18.9700
            15  C1y C    22.5400  -24.1500
            16  C1y C    23.7300  -26.2500
            17  C1z C    21.3500  -24.8500
            18  C1x C    22.5400  -26.8800
            19  C7a C    24.8500  -26.8800
            20  C2y C    21.3500  -26.1800
            21  C1x C    20.1600  -24.1500
            22  C1a C    21.3500  -23.4500
            23  O7a O    26.0400  -26.2500
            24  C2x C    20.1600  -26.8800
            25  C1x C    18.9700  -24.8500
            26  C1c C    27.2300  -26.8800
            27  C5x C    18.9700  -26.1800
            28  O5x O    17.7800  -26.8800
            29  O6a O    24.8322  -28.2799
            30  C1a C    28.4159  -26.1360
            31  C1a C    27.2114  -28.2791
BOND        35
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     1   5 1 #Down
            5     2   6 1
            6     2   7 1
            7     2   8 1 #Up
            8     3   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 1
            12    7  13 1
            13   10  14 2
            14   12  15 1
            15   12  16 1
            16   15  17 1
            17   16  18 1
            18   16  19 1 #Down
            19   17  20 1
            20   17  21 1
            21   17  22 1 #Up
            22   19  23 1
            23   20  24 2
            24   21  25 1
            25   23  26 1
            26   24  27 1
            27   27  28 2
            28    6   9 1
            29   10  11 1
            30   13  15 1
            31   18  20 1
            32   25  27 1
            33   19  29 2
            34   26  30 1
            35   26  31 1

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