KEGG   DRUG: D02396Help
Entry
D02396                      Drug                                   

Name
Hexoprenaline sulfate (USAN);
Delaprem (TN)
Formula
C22H32N2O6. H2SO4
Exact mass
518.1934
Mol weight
518.5778
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Bronchodilator;
Tocolytic [DS:H00079]
Remark
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
     R03AC06 Hexoprenaline
      D02396  Hexoprenaline sulfate (USAN)
   R03C ADRENERGICS FOR SYSTEMIC USE
    R03CC Selective beta-2-adrenoreceptor agonists
     R03CC05 Hexoprenaline
      D02396  Hexoprenaline sulfate (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta2-adrenergic receptor
     Hexoprenaline
      D02396  Hexoprenaline sulfate (USAN)
BRITE hierarchy
Other DBs
CAS: 
32266-10-7
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        35
            1   C8y C    22.2069  -15.3036
            2   C1c C    23.4202  -16.0069
            3   C8x C    22.2069  -13.9028
            4   C8x C    20.9997  -16.0069
            5   C1b C    24.6394  -15.3036
            6   O1a O    23.4261  -17.4018
            7   C8y C    20.9997  -13.1995
            8   C8x C    19.7805  -15.3036
            9   N1b N    25.8525  -16.0012
            10  C8y C    19.7805  -13.9028
            11  O1a O    21.0288  -11.7930
            12  C1b C    27.0715  -15.2978
            13  O1a O    18.6200  -13.1995
            14  C1b C    28.2848  -16.0012
            15  C1b C    29.4913  -15.2985
            16  C1b C    30.7024  -15.9996
            17  C1b C    31.9133  -15.2985
            18  C1b C    33.1244  -15.9996
            19  N1b N    34.3396  -15.3000
            20  C1b C    35.5530  -16.0025
            21  C1c C    36.7682  -15.3029
            22  C8y C    38.0285  -16.0054
            23  O1a O    36.7699  -13.9006
            24  C8x C    38.0198  -17.4013
            25  C8y C    39.1867  -18.1037
            26  C8y C    40.4019  -17.4042
            27  C8x C    40.4034  -16.0020
            28  C8x C    39.1901  -15.2993
            29  O1a O    39.1849  -19.5060
            30  O1a O    41.6153  -18.1066
            31  S4a S    20.2744  -18.6383
            32  O1d O    18.8664  -18.6383
            33  O1d O    21.6822  -18.6383
            34  O1d O    20.2686  -17.2245
            35  O1d O    20.2686  -20.0461
BOND        35
            1    16  17 1
            2     1   3 1
            3    17  18 1
            4     1   4 2
            5    18  19 1
            6     2   5 1
            7    19  20 1
            8     2   6 1
            9    20  21 1
            10    3   7 2
            11   21  22 1
            12    4   8 1
            13   21  23 1
            14    5   9 1
            15    7  10 1
            16    7  11 1
            17    9  12 1
            18   10  13 1
            19   22  24 2
            20   24  25 1
            21   25  26 2
            22   26  27 1
            23   27  28 2
            24   28  22 1
            25   12  14 1
            26   25  29 1
            27    8  10 2
            28   26  30 1
            29   14  15 1
            30   15  16 1
            31    1   2 1
            32   31  32 1
            33   31  33 1
            34   31  34 2
            35   31  35 2

» Japanese version   » Back

DBGET integrated database retrieval system