KEGG   DRUG: D06646Help
Entry
D06646                      Drug                                   

Name
Epanolol (USAN/INN)
Formula
C20H23N3O4
Exact mass
369.1689
Mol weight
369.4143
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
ATC code: 
Drug group: 
Target
beta1-adrenergic receptor antagonist [HSA:153] [KO:K04141]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04970  Salivary secretion  
 
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: 
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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