KEGG   DRUG: EpanololHelp
Entry
D06646                      Drug                                   

Name
Epanolol (USAN/INN)
Formula
C20H23N3O4
Exact mass
369.1689
Mol weight
369.4143
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01653  Antiarrhythmics
  DG01806  Class II antiarrhythmic agent
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist
   DG01461  beta1-Adrenergic receptor antagonist
Remark
Same as: 
ATC code: 
Activity
Antihypertensive, Vasodilator, beta-Adrenergic receptor antagonist
Comment
Propranolol derivative
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C07 BETA BLOCKING AGENTS
   C07A BETA BLOCKING AGENTS
    C07AB Beta blocking agents, selective
     C07AB10 Epanolol
      D06646  Epanolol (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Epanolol
      D06646  Epanolol (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
86880-51-5
PubChem: 
ChEBI: 
ChEMBL: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        27
            1   C8x C    24.5000  -20.2300
            2   C8x C    24.5000  -18.7600
            3   C8x C    23.2400  -20.9300
            4   C8y C    23.2400  -18.0600
            5   C8x C    22.0500  -20.1600
            6   C8y C    22.0500  -18.7600
            7   C3b C    20.8600  -18.0600
            8   N3a N    19.6000  -17.4300
            9   O2a O    23.2400  -16.6600
            10  C1b C    24.5000  -15.9600
            11  C1c C    25.6900  -16.6600
            12  C1b C    26.8800  -15.9600
            13  N1b N    28.1400  -16.6600
            14  C1b C    29.3300  -16.0300
            15  C1b C    30.5200  -16.7300
            16  N1b N    31.7800  -16.0300
            17  C5a C    32.9700  -16.7300
            18  O5a O    34.1600  -16.0300
            19  C1b C    32.9700  -18.1300
            20  C8y C    31.7800  -18.8300
            21  C8x C    30.5200  -18.0600
            22  C8x C    29.3300  -18.7600
            23  C8y C    29.3300  -20.1600
            24  C8x C    30.5200  -20.8600
            25  C8x C    31.7800  -20.1600
            26  O1a O    28.1400  -20.8600
            27  O1a O    25.6900  -18.0600
BOND        28
            1     4   6 1
            2    13  14 1
            3     6   7 1
            4    14  15 1
            5     7   8 3
            6    15  16 1
            7     5   6 2
            8    16  17 1
            9    17  18 2
            10    4   9 1
            11   17  19 1
            12    1   2 1
            13   19  20 1
            14    9  10 1
            15    1   3 2
            16   10  11 1
            17    2   4 2
            18   11  12 1
            19   20  21 2
            20   21  22 1
            21   22  23 2
            22   23  24 1
            23   24  25 2
            24   25  20 1
            25    3   5 1
            26   23  26 1
            27   12  13 1
            28   27  11 1

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