KEGG   DRUG: D02066Help
Entry
D02066                      Drug                                   

Name
Isoprenaline sulfate (JAN);
Isoproterenol sulfate (USP);
Luf-Iso (TN);
Medihaler-Iso (TN)
Formula
(C11H17NO3)2. H2SO4. 2H2O
Exact mass
556.2302
Mol weight
556.6242
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Bronchodilator [DR:D07690]
Remark
Therapeutic category: 
ATC code: 
Drug group: 
Comment
Component of Stmerin-D (TN)
Target
beta1-adrenergic receptor agonist [HSA:153] [KO:K04141];
beta2-adrenergic receptor agonist [HSA:154] [KO:K04142];
beta3-adrenergic receptor agonist [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
Structure map
beta-Adrenergic receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03A ADRENERGICS, INHALANTS
    R03AB Non-selective beta-adrenoreceptor agonists
     R03AB02 Isoprenaline
      D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
   R03C ADRENERGICS FOR SYSTEMIC USE
    R03CB Non-selective beta-adrenoreceptor agonists
     R03CB01 Isoprenaline
      D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  22  Respiratory organ agents
   225  Bronchodilators
    2252  Isoprenalines
     D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Isoprenaline
      D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
    beta2-adrenergic receptor
     Isoprenaline
      D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
    beta3-adrenergic receptor
     Isoprenaline
      D02066  Isoprenaline sulfate (JAN); Isoproterenol sulfate (USP)
BRITE hierarchy
Other DBs
CAS: 
6700-39-6
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        37
            1   S4a S    30.7719  -15.7400
            2   O1d O    30.8348  -14.3399
            3   O1d O    30.8348  -17.1400
            4   O1d O    32.1719  -15.7400
            5   O1d O    29.3719  -15.7400
            6   O0  O    36.8252  -15.6939
            7   C8y C    18.4800  -16.2400
            8   C8x C    17.2900  -15.4700
            9   C8x C    18.4800  -17.6400
            10  C8y C    16.1000  -16.1700
            11  C8x C    17.2200  -18.2700
            12  C8y C    16.1000  -17.5000
            13  O1a O    14.9100  -15.4000
            14  O1a O    14.9100  -18.2000
            15  C1c C    19.7400  -15.5400
            16  C1b C    20.9300  -16.2400
            17  N1b N    22.1200  -15.5400
            18  C1c C    23.3800  -16.2400
            19  C1a C    24.5700  -15.5400
            20  O1a O    19.7400  -14.1400
            21  C1a C    23.3800  -17.6400
            22  O0  O    36.8252  -15.6939
            23  C8y C    18.4800  -16.2400
            24  C8x C    17.2900  -15.4700
            25  C8y C    16.1000  -16.1700
            26  C8y C    16.1000  -17.5000
            27  O1a O    14.9100  -18.2000
            28  C8x C    17.2200  -18.2700
            29  C8x C    18.4800  -17.6400
            30  O1a O    14.9100  -15.4000
            31  C1c C    19.7400  -15.5400
            32  C1b C    20.9300  -16.2400
            33  N1b N    22.1200  -15.5400
            34  C1c C    23.3800  -16.2400
            35  C1a C    24.5700  -15.5400
            36  C1a C    23.3800  -17.6400
            37  O1a O    19.7400  -14.1400
BOND        34
            1     1   3 2
            2     1   4 1
            3     1   5 1
            4     1   2 2
            5     7   8 1
            6     7   9 2
            7     8  10 2
            8     9  11 1
            9    10  12 1
            10   10  13 1
            11   12  14 1
            12   11  12 2
            13    7  15 1
            14   15  16 1
            15   16  17 1
            16   17  18 1
            17   18  19 1
            18   15  20 1
            19   18  21 1
            20   23  24 1
            21   23  29 2
            22   24  25 2
            23   29  28 1
            24   25  26 1
            25   25  30 1
            26   26  27 1
            27   28  26 2
            28   23  31 1
            29   31  32 1
            30   32  33 1
            31   33  34 1
            32   34  35 1
            33   31  37 1
            34   34  36 1
BRACKET     1    35.0000  -16.3800   35.0000  -14.8400
            1    37.2400  -14.8400   37.2400  -16.3800
            1  2
 ORIGINAL  1    6
 REPEAT    1   22
            2    13.6500  -19.4600   13.6500  -12.1800
            2    26.3200  -12.1800   26.3200  -19.4600
            2  2
 ORIGINAL  2    7   8  10  12  14  11   9  13  15  16  17  18  19  21  20
 REPEAT    2   23  24  25  26  27  28  29  30  31  32  33  34  35  36  37

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