KEGG   DRUG: D01504Help
Entry
D01504                      Drug                                   

Name
Bufetolol hydrochloride (JP16);
Adobiol (TN)
Formula
C18H29NO4. HCl
Exact mass
359.1863
Mol weight
359.8881
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Therapeutic category: 
Drug group: 
Target
beta1-adrenergic receptor antagonist [HSA:153] [KO:K04141];
beta2-adrenergic receptor antagonist [HSA:154] [KO:K04142];
beta3-adrenergic receptor antagonist [HSA:155] [KO:K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes
hsa04970  Salivary secretion  
 
Interaction
Drug interaction
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   212  Antiarrhythmic agents
    2123  Beta blockers
     D01504  Bufetolol hydrochloride (JP16)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Bufetolol
      D01504  Bufetolol hydrochloride (JP16)
    beta2-adrenergic receptor
     Bufetolol
      D01504  Bufetolol hydrochloride (JP16)
    beta3-adrenergic receptor
     Bufetolol
      D01504  Bufetolol hydrochloride (JP16)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01504  Bufetolol hydrochloride
BRITE hierarchy
Other DBs
CAS: 
35108-88-4
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   X   Cl   24.7800  -25.8300
            2   C1d C    24.1500  -21.1400
            3   C1a C    25.3624  -21.8400
            4   N1b N    22.9376  -21.8400
            5   C1b C    21.7421  -21.1496
            6   C1c C    20.5547  -21.8351
            7   C1b C    19.3635  -21.1471
            8   O1a O    20.5545  -23.2398
            9   O2a O    18.1740  -21.8338
            10  C8y C    18.1740  -23.2338
            11  C8y C    16.9786  -23.9242
            12  C8x C    16.9789  -25.3242
            13  C8x C    18.1914  -26.0240
            14  C8x C    19.3868  -25.3336
            15  C8x C    19.3866  -23.9336
            16  O2a O    15.7964  -23.2420
            17  C1b C    14.6027  -23.9316
            18  C1y C    13.4143  -23.2457
            19  O2x O    13.4055  -21.8404
            20  C1x C    12.0688  -21.4150
            21  C1x C    11.2511  -22.5547
            22  C1x C    12.0824  -23.6846
            23  C1a C    24.1500  -19.7400
            24  C1a C    25.3624  -20.4400
BOND        24
            1     2   3 1
            2     2   4 1
            3     4   5 1
            4     5   6 1
            5     6   7 1
            6     6   8 1
            7     7   9 1
            8     9  10 1
            9    10  11 2
            10   11  12 1
            11   12  13 2
            12   13  14 1
            13   14  15 2
            14   10  15 1
            15   11  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   18  22 1
            23    2  23 1
            24    2  24 1

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