KEGG   DRUG: EsaxerenoneHelp
Entry
D10892                      Drug                                   

Name
Esaxerenone (JAN/INN)
Formula
C22H21F3N2O4S
Exact mass
466.1174
Mol weight
466.4734
Structure
Mol fileKCF fileDB search
Efficacy
Antihypertensive, Aldosterone antagonist
Other DBs
CAS: 1632006-28-0
PubChem: 336445210
ChEMBL: CHEMBL2181932
LinkDB All DBs
KCF data Show

ATOM        32
            1   C8x C    18.6200  -15.8200
            2   C8y C    18.6200  -17.2200
            3   C8x C    19.8100  -17.9200
            4   C8x C    21.0700  -17.2200
            5   C8y C    21.0700  -15.8200
            6   C8x C    19.8100  -15.1200
            7   S4a S    22.2600  -15.1200
            8   C1a C    23.4500  -15.8200
            9   O3c O    21.0700  -14.4200
            10  O3c O    23.5200  -14.4200
            11  N1b N    17.4300  -17.9200
            12  C5a C    16.2400  -17.2200
            13  C8y C    15.0500  -17.9200
            14  O5a O    16.2400  -15.8200
            15  C8x C    13.9300  -17.0800
            16  N4y N    12.8100  -17.8500
            17  C8y C    13.1600  -19.1800
            18  C8y C    14.5600  -19.1800
            19  C1b C    11.6200  -17.1500
            20  C1b C    10.4300  -17.8500
            21  O1a O     9.2400  -17.1500
            22  C1a C    15.3300  -20.3700
            23  C8y C    12.3200  -20.3000
            24  C8x C     9.8700  -20.3000
            25  C8x C     9.8700  -21.7000
            26  C8x C    11.0600  -22.4000
            27  C8y C    12.3200  -21.7000
            28  C8x C    11.0600  -19.6000
            29  C1d C    13.5266  -22.4100
            30  X   F    14.7391  -23.1100
            31  X   F    14.2266  -21.1975
            32  X   F    12.8266  -23.6224
BOND        34
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     7   9 2
            10    7  10 2
            11    2  11 1
            12   11  12 1
            13   12  13 1
            14   12  14 2
            15   13  15 2
            16   15  16 1
            17   16  17 1
            18   17  18 2
            19   13  18 1
            20   19  16 1
            21   19  20 1
            22   20  21 1
            23   18  22 1
            24   17  23 1
            25   24  25 2
            26   25  26 1
            27   26  27 2
            28   27  23 1
            29   24  28 1
            30   23  28 2
            31   27  29 1
            32   29  30 1
            33   29  31 1
            34   29  32 1

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