KEGG   DRUG: D04190Help
Entry
D04190                      Drug                                   

Name
Flestolol sulfate (USAN)
Formula
C15H22FN3O4. H2SO4
Exact mass
425.1268
Mol weight
425.4298
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Anti-adrenergic [beta-receptor]
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
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Flestolol
      D04190  Flestolol sulfate (USAN)
    beta2-adrenergic receptor
     Flestolol
      D04190  Flestolol sulfate (USAN)
    beta3-adrenergic receptor
     Flestolol
      D04190  Flestolol sulfate (USAN)
BRITE hierarchy
Other DBs
CAS: 
88844-73-9
PubChem: 
LigandBox: 
KCF data Show

ATOM        28
            1   C8x C     3.6400   -5.2500
            2   C8x C     3.6400   -6.6500
            3   C8x C     4.8524   -7.3500
            4   C8x C     6.0649   -6.6500
            5   C8y C     6.0649   -5.2500
            6   C8y C     4.8524   -4.5500
            7   C7a C     7.2960   -4.5390
            8   X   F     4.8524   -3.1502
            9   O7a O     8.5012   -5.2347
            10  O6a O     7.2957   -3.1501
            11  C1b C     9.6835   -4.5519
            12  C1c C    10.8775   -5.2412
            13  C1b C    12.0654   -4.5552
            14  O1a O    10.8777   -6.6497
            15  N1b N    13.2565   -5.2429
            16  C1d C    14.4459   -4.5561
            17  C1b C    15.6362   -5.2434
            18  C1a C    15.4359   -3.5661
            19  C1a C    13.4560   -3.5661
            20  N1b N    16.8261   -4.5563
            21  C5a C    18.0162   -5.2435
            22  N1a N    19.2061   -4.5564
            23  O5a O    18.0163   -6.6498
            24  S4a S    24.6079   -5.0160
            25  O1d O    26.0076   -5.0160
            26  O1d O    23.2080   -5.0558
            27  O1d O    24.6707   -6.4157
            28  O1d O    24.6114   -3.6161
BOND        27
            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     5   7 1
            8     6   8 1
            9     7   9 1
            10    7  10 2
            11    9  11 1
            12   11  12 1
            13   12  13 1
            14   12  14 1
            15   13  15 1
            16   15  16 1
            17   16  17 1
            18   16  18 1
            19   16  19 1
            20   17  20 1
            21   20  21 1
            22   21  22 1
            23   21  23 2
            24   24  25 1
            25   24  26 1
            26   24  27 2
            27   24  28 2

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