KEGG   DRUG: Carbuterol hydrochlorideHelp
Entry
D03402                      Drug                                   

Name
Carbuterol hydrochloride (USAN)
Formula
C13H21N3O3. HCl
Exact mass
303.135
Mol weight
303.7851
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01455  beta-Adrenergic receptor agonist
   DG01452  beta2-Adrenergic receptor agonist
Remark
ATC code: 
Activity
Bronchodilator
Target
beta2-adrenergic receptor [HSA:154] [KO:K04142]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Endocytosis
Adrenergic signaling in cardiomyocytes
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
     R03AC10 Carbuterol
      D03402  Carbuterol hydrochloride (USAN)
   R03C ADRENERGICS FOR SYSTEMIC USE
    R03CC Selective beta-2-adrenoreceptor agonists
     R03CC10 Carbuterol
      D03402  Carbuterol hydrochloride (USAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta2-adrenergic receptor
     Carbuterol
      D03402  Carbuterol hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
34866-46-1
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        20
            1   C8x C    18.6059  -12.5966
            2   C8y C    18.6059  -14.0026
            3   C8y C    19.8235  -14.7056
            4   C8x C    21.0411  -14.0026
            5   C8x C    21.0411  -12.5966
            6   C8y C    19.8235  -11.8937
            7   C1c C    19.8235  -10.4879
            8   O1a O    19.8235  -16.1113
            9   O1a O    18.5891   -9.7750
            10  C1b C    21.0242   -9.7946
            11  N1b N    22.2164  -10.4829
            12  C1d C    23.4129   -9.7920
            13  N1b N    17.3884  -14.7056
            14  C5a C    16.1878  -14.0122
            15  N1a N    14.9954  -14.7006
            16  O5a O    16.1877  -12.5969
            17  C1a C    24.6134   -9.0986
            18  C1a C    24.1058  -10.9926
            19  C1a C    22.7003   -8.5574
            20  X   Cl   28.7991  -12.9481
BOND        19
            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     6   7 1
            8     3   8 1
            9     7   9 1
            10    7  10 1
            11   10  11 1
            12   11  12 1
            13    2  13 1
            14   13  14 1
            15   14  15 1
            16   14  16 2
            17   12  17 1
            18   12  18 1
            19   12  19 1

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