| Name |
Albuterol (USP);Salbutamol;Proventil (TN) |
| Formula |
C13H21NO3 |
| Exact mass |
239.1521 |
| Mol weight |
239.31 |
| Structure |
 |
| Simcomp |
|
| Class |
Cardiovascular agent DG01456 Adrenergic receptor agonist DG01455 beta-Adrenergic receptor agonist DG01452 beta2-Adrenergic receptor agonist |
| Remark |
ATC code: R03AC02 R03CC02Chemical structure group: DG01045Product (DG01045): D00683<JP/US> |
| Efficacy |
Bronchodilator, beta2-Adrenergic receptor agonist |
| Comment |
Phenethylamine derivative |
| Target |
ADRB2 [HSA:154] [KO:K04142] |
| Pathway |
hsa04020 Calcium signaling pathwayhsa04024 cAMP signaling pathwayhsa04080 Neuroactive ligand-receptor interaction |
| 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 R03AC02 Salbutamol D02147 Albuterol (USP) R03C ADRENERGICS FOR SYSTEMIC USE R03CC Selective beta-2-adrenoreceptor agonists R03CC02 Salbutamol D02147 Albuterol (USP)Drug groups [BR:br08330] Cardiovascular agent DG01456 Adrenergic receptor agonist DG01455 beta-Adrenergic receptor agonist DG01452 beta2-Adrenergic receptor agonist DG01045 Albuterol D02147 AlbuterolTarget-based classification of drugs [BR:br08310] G Protein-coupled receptors Rhodopsin family Adrenaline ADRB2 D02147 Albuterol (USP)Drug groups [BR:br08330] Cardiovascular agent DG01456 Adrenergic receptor agonist DG01455 beta-Adrenergic receptor agonist DG01452 beta2-Adrenergic receptor agonist DG01045 Albuterol |
| Other DBs |
CAS: 18559-94-9PubChem: 7849208ChEBI: 2549LigandBox: D02147NIKKAJI: J10.899E |
| LinkDB |
|
| KCF data |
ATOM 17 1 C8y C 21.4900 -16.1700 2 C8x C 20.3000 -16.8700 3 C1c C 22.6800 -16.8700 4 C8x C 21.4900 -14.7700 5 C8y C 19.0400 -16.1700 6 C1b C 23.9400 -16.1700 7 O1a O 22.6800 -18.2700 8 C8x C 20.3000 -14.0700 9 C8y C 19.0400 -14.7700 10 C1b C 17.8500 -16.8700 11 N1b N 25.1300 -16.8700 12 O1a O 17.8500 -14.0700 13 O1a O 16.6600 -16.1700 14 C1d C 26.3200 -16.1700 15 C1a C 27.5800 -16.8700 16 C1a C 26.3200 -14.7700 17 C1a C 27.5324 -15.4700BOND 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 14 15 1 15 14 16 1 16 8 9 2 17 14 17 1 |
