KEGG   DRUG: D02702Help
Entry
D02702                      Drug                                   

Name
Talibegron hydrochloride (USAN)
Formula
C18H21NO4. HCl
Exact mass
351.1237
Mol weight
351.8246
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of obesity in dogs and cats [beta-adrenoreceptor agonist]
Target
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
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Talibegron
      D02702  Talibegron hydrochloride (USAN)
    beta2-adrenergic receptor
     Talibegron
      D02702  Talibegron hydrochloride (USAN)
    beta3-adrenergic receptor
     Talibegron
      D02702  Talibegron hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
178600-17-4
PubChem: 
LigandBox: 
KCF data Show

ATOM        24
            1   C8x C    15.1200  -22.4700
            2   C8x C    15.1200  -21.0700
            3   C8x C    16.3100  -20.3700
            4   C8x C    17.5700  -21.0700
            5   C8y C    17.5700  -22.4700
            6   C8x C    16.3100  -23.1700
            7   C1c C    18.7600  -23.1700
            8   C1b C    20.0200  -22.4700
            9   N1b N    21.2100  -23.1700
            10  C1b C    22.4000  -22.4700
            11  C1b C    23.6600  -23.1700
            12  O2a O    24.8500  -22.4700
            13  C8y C    26.0400  -23.1700
            14  O1a O    18.7600  -24.5700
            15  C8x C    27.3000  -22.4700
            16  C8x C    28.4900  -23.1700
            17  C8y C    28.4900  -24.5700
            18  C8x C    27.3000  -25.2700
            19  C8x C    26.0400  -24.5700
            20  C1b C    29.6800  -25.2700
            21  C6a C    30.9400  -24.5700
            22  O6a O    32.1300  -25.2700
            23  O6a O    30.9400  -23.1700
            24  X   Cl   27.3700  -27.3000
BOND        24
            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     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    7  14 1 #Down
            15   13  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   13  19 1
            21   17  20 1
            22   20  21 1
            23   21  22 1
            24   21  23 2

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