KEGG   DRUG: D07534Help
Entry
D07534                      Drug                                   

Name
Bitolterol (INN)
Formula
C28H31NO5
Exact mass
461.2202
Mol weight
461.5494
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Bronchodilator [DS:H00079]
Remark
Same as: 
ATC code: 
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
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03A ADRENERGICS, INHALANTS
    R03AC Selective beta-2-adrenoreceptor agonists
     R03AC17 Bitolterol
      D07534  Bitolterol (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta2-adrenergic receptor
     Bitolterol
      D07534  Bitolterol (INN)
BRITE hierarchy
Other DBs
CAS: 
30392-40-6
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        34
            1   C8y C    25.9700  -17.5700
            2   C1c C    27.1600  -18.2700
            3   C1b C    28.4200  -17.5700
            4   N1b N    29.6100  -18.2700
            5   C1d C    30.8000  -17.5700
            6   C8x C    25.9700  -16.1700
            7   C8x C    24.7800  -15.4700
            8   C8y C    23.5200  -16.1700
            9   C8y C    23.5200  -17.5700
            10  C8x C    24.7800  -18.2700
            11  O1a O    27.1600  -19.6700
            12  C1a C    32.0600  -16.8700
            13  O7a O    22.3300  -15.4700
            14  O7a O    22.3300  -18.2700
            15  C7a C    21.1400  -16.1700
            16  C8y C    19.9500  -15.4700
            17  C8x C    19.9500  -14.0700
            18  C8x C    18.6900  -13.3700
            19  C8y C    17.5000  -14.0700
            20  C8x C    17.5000  -15.4700
            21  C8x C    18.6900  -16.1700
            22  C1a C    16.3100  -13.3700
            23  O6a O    21.1400  -17.5700
            24  C7a C    22.3300  -19.6700
            25  C8y C    21.1400  -20.3700
            26  O6a O    23.5200  -20.3700
            27  C8x C    19.9500  -19.6700
            28  C8x C    18.6900  -20.3700
            29  C8y C    18.6900  -21.7700
            30  C8x C    19.8800  -22.4700
            31  C8x C    21.1400  -21.7700
            32  C1a C    17.5000  -22.4700
            33  C1a C    30.1000  -16.3800
            34  C1a C    31.5700  -18.7600
BOND        36
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   6 2
            6     6   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    1  10 1
            11    2  11 1
            12    5  12 1
            13    8  13 1
            14    9  14 1
            15   13  15 1
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   16  21 1
            23   19  22 1
            24   15  23 2
            25   14  24 1
            26   24  25 1
            27   24  26 2
            28   25  27 2
            29   27  28 1
            30   28  29 2
            31   29  30 1
            32   30  31 2
            33   25  31 1
            34   29  32 1
            35    5  33 1
            36    5  34 1

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