KEGG   DRUG: D05020Help
Entry
D05020                      Drug                                   

Name
Mexrenoate potassium (USAN);
Mexrenoate potassium dihydrate
Formula
C24H33O6. 2H2O. K
Exact mass
492.2126
Mol weight
492.6441
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
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
     Mexrenoate
      D05020  Mexrenoate potassium (USAN)
BRITE hierarchy
Other DBs
CAS: 
43169-54-6
PubChem: 
LigandBox: 
KCF data Show

ATOM        33
            1   C1x C    19.8854  -20.0368
            2   C5x C    19.8854  -21.4380
            3   C2x C    21.0989  -22.1385
            4   C2y C    22.3124  -21.4380
            5   C1z C    22.3124  -20.0368
            6   C1x C    21.0989  -19.3362
            7   C1x C    23.5258  -22.1385
            8   C1y C    24.7392  -21.4380
            9   C1y C    24.7392  -20.0368
            10  C1y C    23.5258  -19.3362
            11  C1y C    25.9528  -19.3362
            12  C1z C    25.9528  -17.9350
            13  C1x C    24.7392  -17.2344
            14  C1x C    23.5258  -17.9350
            15  O5x O    18.6720  -22.1385
            16  C1a C    22.3124  -18.6356
            17  C1a C    25.9528  -16.5338
            18  C7a C    25.9379  -22.1300
            19  O7a O    27.1272  -21.4435
            20  C1a C    28.3190  -22.1316
            21  O6a O    25.9380  -23.5394
            22  C1x C    28.3777  -19.3362
            23  C1x C    28.3777  -17.9350
            24  C1z C    27.1652  -17.2350
            25  O1a O    28.3555  -16.4914
            26  C1b C    27.1781  -15.8201
            27  C1b C    28.3831  -15.1388
            28  C6a C    28.3264  -13.7208
            29  O6a O    27.1052  -13.0792
            30  O6a O    29.5270  -12.9619 #-
            31  Z   K    31.6554  -13.3810 #+
            32  O0  O    33.9501  -19.1801
            33  O0  O    33.9501  -19.1801
BOND        33
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            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    2  15 2
            18    5  16 1 #Up
            19   12  17 1 #Up
            20    8  18 1 #Down
            21   18  19 1
            22   19  20 1
            23   18  21 2
            24   11  22 1
            25   22  23 1
            26   23  24 1
            27   12  24 1
            28   24  25 1 #Up
            29   24  26 1 #Down
            30   26  27 1
            31   27  28 1
            32   28  29 2
            33   28  30 1
BRACKET     1    31.6400  -20.1600   31.6400  -18.1300
            1    34.8600  -18.1300   34.8600  -20.1600
            1  2
 ORIGINAL  1   35
 REPEAT    1   36

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