KEGG   DRUG: D01589Help
Entry
D01589                      Drug                                   

Name
Mabuterol hydrochloride (JAN);
Broncholin (TN)
Formula
C13H18ClF3N2O. HCl
Exact mass
346.0827
Mol weight
347.204
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Therapeutic category: 
Drug group: 
Target
beta2-adrenergic receptor agonist [HSA:154] [KO:K04142]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04144  Endocytosis
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
  22  Respiratory organ agents
   225  Bronchodilators
    2259  Others
     D01589  Mabuterol hydrochloride (JAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta2-adrenergic receptor
     Mabuterol
      D01589  Mabuterol hydrochloride (JAN)
BRITE hierarchy
Other DBs
CAS: 
54240-36-7
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C8y C    15.8900  -12.1800
            2   C8y C    15.8900  -13.5800
            3   C8x C    17.1024  -14.2800
            4   C8y C    18.3149  -13.5800
            5   C8x C    18.3149  -12.1800
            6   C8y C    17.1024  -11.4800
            7   N1a N    14.6776  -11.4800
            8   X   Cl   14.6776  -14.2800
            9   C1d C    17.1024  -10.0800
            10  X   F    17.1024   -8.6800
            11  X   F    15.6800  -10.0800
            12  X   F    18.4800  -10.0800
            13  C1c C    19.5460  -14.2910
            14  C1b C    20.7512  -13.5953
            15  O1a O    19.5457  -15.6799
            16  N1b N    21.9335  -14.2781
            17  C1d C    23.1275  -13.5888
            18  C1a C    24.3399  -12.8888
            19  C1a C    22.4171  -12.3578
            20  C1a C    23.8165  -14.7828
            21  X   Cl   28.6300  -14.0000
BOND        20
            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     1   7 1
            8     2   8 1
            9     6   9 1
            10    9  10 1
            11    9  11 1
            12    9  12 1
            13    4  13 1
            14   13  14 1
            15   13  15 1
            16   14  16 1
            17   16  17 1
            18   17  18 1
            19   17  19 1
            20   17  20 1

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