KEGG   DRUG: Zinterol hydrochlorideHelp
Entry
D06374                      Drug                                   

Name
Zinterol hydrochloride (USAN)
Formula
C19H26N2O4S. HCl
Exact mass
414.138
Mol weight
414.9467
Structure
Mol fileKCF fileDB search
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01455  beta-Adrenergic receptor agonist
   DG01452  beta2-Adrenergic receptor agonist
Efficacy
Bronchodilator, beta2-Adrenergic receptor agonist
Comment
Phenethylamine derivative
Target
ADRB2 [HSA:154] [KO:K04142]
  Pathway
hsa04020  Calcium signaling pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB2
     D06374  Zinterol hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 38241-28-0
PubChem: 47208031
ChEMBL: CHEMBL2105510
LigandBox: D06374
NIKKAJI: J244.557C
KCF data Show

ATOM        27
            1   C8y C    12.6000  -15.4700
            2   C8y C    12.6000  -14.0700
            3   C8x C    13.8600  -13.3700
            4   C8x C    15.0500  -14.0700
            5   C8y C    15.0500  -15.4700
            6   C8x C    13.8600  -16.1700
            7   O1a O    11.4100  -13.3700
            8   C1c C    16.3100  -16.2400
            9   N1b N    11.4100  -16.1700
            10  S4a S    11.4100  -17.6400
            11  C1a C    11.4100  -19.0400
            12  O3c O    10.0100  -17.6400
            13  O3c O    12.8100  -17.6400
            14  C1b C    17.5000  -15.5400
            15  O1a O    16.3100  -17.6400
            16  N1b N    18.6900  -16.1700
            17  C1d C    19.8800  -15.5400
            18  C1b C    21.0700  -16.1700
            19  C8y C    22.2600  -15.5400
            20  C8x C    22.2600  -14.0700
            21  C8x C    23.5200  -13.3700
            22  C8x C    24.7100  -14.0700
            23  C8x C    24.7100  -15.5400
            24  C8x C    23.5200  -16.2400
            25  C1a C    18.9000  -14.4900
            26  C1a C    20.8600  -14.4900
            27  X   Cl   24.0800  -19.1100
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     2   7 1
            8     5   8 1
            9     1   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 2
            13   10  13 2
            14    8  14 1
            15    8  15 1
            16   14  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   22  23 1
            24   23  24 2
            25   19  24 1
            26   17  25 1
            27   17  26 1

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