KEGG   DRUG: PirbuterolHelp
Entry
D08387                      Drug                                   

Name
Pirbuterol (INN)
Formula
C12H20N2O3
Exact mass
240.1474
Mol weight
240.2988
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01455  beta-Adrenergic receptor agonist
   DG01452  beta2-Adrenergic receptor agonist
Remark
Same as: C07807
ATC code: R03AC08 R03CC07
Chemical structure group: DG01048
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
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
     R03AC08 Pirbuterol
      D08387  Pirbuterol (INN)
   R03C ADRENERGICS FOR SYSTEMIC USE
    R03CC Selective beta-2-adrenoreceptor agonists
     R03CC07 Pirbuterol
      D08387  Pirbuterol (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB2
     D08387  Pirbuterol (INN)
BRITE hierarchy
Other DBs
CAS: 38677-81-5
PubChem: 96025073
ChEBI: 8245
ChEMBL: CHEMBL1094966
DrugBank: DB01291
LigandBox: D08387
NIKKAJI: J16.427E
KCF data Show

ATOM        17
            1   C8y C    18.1300  -16.1700
            2   N5x N    16.8700  -16.8700
            3   C1c C    19.3200  -16.8700
            4   C8x C    18.1300  -14.7700
            5   C8y C    15.6800  -16.1700
            6   C1b C    20.5100  -16.1700
            7   O1a O    19.3200  -18.2700
            8   C8x C    16.8700  -14.0700
            9   C8y C    15.6800  -14.7700
            10  C1b C    14.4900  -16.8700
            11  N1b N    21.7000  -16.8700
            12  O1a O    14.4900  -14.0700
            13  O1a O    13.1600  -16.1700
            14  C1d C    22.9600  -16.1700
            15  C1a C    24.1500  -15.4700
            16  C1a C    23.6600  -17.3600
            17  C1a C    22.2600  -14.9800
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     3   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1
            10    6  11 1
            11    9  12 1
            12   10  13 1
            13   11  14 1
            14    8   9 2
            15   14  15 1
            16   14  16 1
            17   14  17 1

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