KEGG   DRUG: BambuterolHelp
Entry
D07377                      Drug                                   

Name
Bambuterol (INN)
Formula
C18H29N3O5
Exact mass
367.2107
Mol weight
367.44
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
ATC code: R03CC12
Chemical structure group: DG01060
Efficacy
Bronchodilator, beta2-Adrenergic receptor agonist
Comment
Phenethylamine derivative
Active form of prodrug: Terbutaline [DR:D08570]
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
   R03C ADRENERGICS FOR SYSTEMIC USE
    R03CC Selective beta-2-adrenoreceptor agonists
     R03CC12 Bambuterol
      D07377  Bambuterol (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB2
     D07377  Bambuterol (INN)
Prodrugs [br08324.html]
 D07377
Prodrugs [br08324.html]
 DG01060
BRITE hierarchy
Other DBs
CAS: 81732-65-2
PubChem: 51091713
ChEBI: 553827
ChEMBL: CHEMBL521589
DrugBank: DB01408
LigandBox: D07377
NIKKAJI: J126.243B
LinkDB All DBs
KCF data Show

ATOM        26
            1   C8x C    16.8331  -16.5489
            2   C8y C    16.8331  -17.9514
            3   C8x C    18.0477  -18.6527
            4   C8y C    19.2625  -17.9514
            5   C8x C    19.2625  -16.5489
            6   C8y C    18.0477  -15.8476
            7   C1c C    20.5023  -18.6527
            8   C1b C    21.7170  -17.9514
            9   N1b N    22.9316  -18.6527
            10  O7a O    15.6185  -18.6527
            11  C7a C    14.4037  -17.9514
            12  N1c N    13.1891  -18.6527
            13  C1a C    11.9745  -17.9514
            14  O6a O    14.4037  -16.5491
            15  C1a C    13.1891  -20.0553
            16  O1a O    20.5085  -20.0550
            17  O7a O    18.0477  -14.4452
            18  C7a C    16.8163  -13.7341
            19  N1c N    15.6102  -14.4304
            20  C1a C    14.4249  -13.7460
            21  C1a C    15.6096  -15.7771
            22  O6a O    16.8165  -12.3412
            23  C1d C    24.1797  -17.9327
            24  C1a C    25.3641  -18.6171
            25  C1a C    24.1804  -16.5203
            26  C1a C    25.3921  -17.2327
BOND        26
            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     4   7 1
            8     7   8 1
            9     8   9 1
            10    2  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   11  14 2
            15   12  15 1
            16    7  16 1
            17    6  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   19  21 1
            22   18  22 2
            23    9  23 1
            24   23  24 1
            25   23  25 1
            26   23  26 1

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