Systematic / IUPAC Name: 2-(Hydroxymethyl)-4-{1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl}phenol
ID: Reference2265
Other Names:
Astmerole;
Aeromax;
Salmeterolum;
Salmaterol;
2-(Hydroxymethyl)-4-[1-hydroxy-2-({6-[(4-phenylbutyl)oxy]hexyl}amino)ethyl]phenol
Formula: C25H37NO4
Class: Therapeutics/Prescription Drugs Sports Doping Drugs
Salmeterol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Plus Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 45 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 2/13/2015 10:39:04 AM |
InChI | InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2 |
InChI Key | GIIZNNXWQWCKIB-UHFFFAOYSA-N |
Canonical SMILES | C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O |
CAS | 89365504 |
Splash | |
Other Names |
Astmerole; Aeromax; Salmeterolum; Salmaterol; 2-(Hydroxymethyl)-4-[1-hydroxy-2-({6-[(4-phenylbutyl)oxy]hexyl}amino)ethyl]phenol; 4-(1-Hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)-2-(hydroxymethyl)phenol |
ChemSpider | 4968 |
ChEBI | CHEBI:64064 |
ChemIDPlus | 094749083; 089365504; 136112011 |
ChEMBL | CHEMBL1263 |
Wikipedia | Salmeterol |
DrugBank | DB00938 |
KEGG | C07241; D00687; D05792 |
PubChem | 5152 |