Salmeterol structure, CAS 89365-50-4

Salmeterol

CAS Number89365-50-4

Synonyms(+-)-4-hydroxy-alpha1-(((6-(4-phenylbutoxy)hexyl)amino)methyl)-1,3-benzenedi; SAMETEROL; SalmeterolXenofoate; 4-Hydroxy-3-[hydroxymethyl]phenyl-N-[6-phenylbutoxyhexyl]ethanolamine; Salmeterol; 2-(Hydroxymethyl)-4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol; 2-(hydroxymethyl)-4-[1-hydroxy-2-({6-[(4-phenylbutyl)oxy]hexyl}amino)ethyl]phenol; 2-hydroxymethyl-4-{1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl}phenol; (±)-4-Hydroxy-a1-[[[6-(4-phenylbutoxy)hexyl]amino]methyl]-1,3-benzenedimethanol; MFCD00867037; serevent (R); (±)-4-Hydroxy-a1-[[[6-(4-phenylbutoxy)hexyl]amino]methyl]-m-xylene-a,a1-diol; 4-HYDROXY-A1-[[[6-(4-PHENYLBUTOXY)HEXYL]AMINO]METHYL]-1,3-BENZENEDIMETHANOL

Molecular FormulaC25H37NO4

Molecular Weight415.566

Purity98%

Density1.1±0.1 g/cm3

Boiling Point603.0±55.0 °C at 760 mmHg

Melting Point

Flash Point

Appearancepowder

EINECS

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Symbol

Signal Word

Cat. No.: 2A-1169855 Purity: 98%
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Quality Control of [ 89365-50-4 ] Purity: 98% SDS Specification MoL

Chemical & Physical Properties
CAS Number89365-50-4
Catalog No.2A-1169855
Chinese Name沙美特罗
Synonyms(+-)-4-hydroxy-alpha1-(((6-(4-phenylbutoxy)hexyl)amino)methyl)-1,3-benzenedi; SAMETEROL; SalmeterolXenofoate; 4-Hydroxy-3-[hydroxymethyl]phenyl-N-[6-phenylbutoxyhexyl]ethanolamine; Salmeterol; 2-(Hydroxymethyl)-4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol; 2-(hydroxymethyl)-4-[1-hydroxy-2-({6-[(4-phenylbutyl)oxy]hexyl}amino)ethyl]phenol; 2-hydroxymethyl-4-{1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl}phenol; (±)-4-Hydroxy-a1-[[[6-(4-phenylbutoxy)hexyl]amino]methyl]-1,3-benzenedimethanol; MFCD00867037; serevent (R); (±)-4-Hydroxy-a1-[[[6-(4-phenylbutoxy)hexyl]amino]methyl]-m-xylene-a,a1-diol; 4-HYDROXY-A1-[[[6-(4-PHENYLBUTOXY)HEXYL]AMINO]METHYL]-1,3-BENZENEDIMETHANOL
Molecular FormulaC25H37NO4
Molecular Weight415.566
Purity98
Density1.1±0.1 g/cm3
Boiling Point603.0±55.0 °C at 760 mmHg
Appearancepowder
Storage ConditionRefrigerate at 2-8°C
ApplicationSalmeterol is a long-acting β2-adrenoceptor agonist that can be used to treat asthma.
HTC2922509090
PubChem ID9450
SMILESOCc1cc(C(O)CNCCCCCCOCCCCc2ccccc2)ccc1O
InChIInChI=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 KeyGIIZNNXWQWCKIB-UHFFFAOYSA-N
Use ofSalmeterol is a long-acting beta2-adrenergic receptor (beta 2AR) agonist used clinically to treat asthma.Target: beta2-Adrenergic ReceptorSalmeterol is a long-acting beta2-adrenergic receptor agonist drug that is prescribed for the treatment of asthma and chronic obstructive pulmonary disease (COPD). salmeterol also binds with very high affinity at a second site, termed the "exosite", and that this exosite contributes to the long duration of action of salmeterol [1]. Properties Name 2-(hydroxymethyl)-4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol Synonym More Synonyms Salmeterol Biological Activity Description Salmeterol is a long-acting beta2-adrenergic receptor (beta 2AR) agonist used clinically to treat asthma.Target: beta2-Adrenergic ReceptorSalmeterol is a long-acting beta2-adrenergic receptor agonist drug that is prescribed for the treatment of asthma and chronic obstructive pulmonary disease (COPD). salmeterol also binds with very high affinity at a second site, termed the "exosite", and that this exosite contributes to the long duration of action of salmeterol [1]. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adrenergic Receptor Research Areas >> Others References [1]. Rong, Y., et al., Probing the salmeterol binding site on the beta 2-adrenergic receptor using a novel photoaffinity ligand, [(125)I]iodoazidosalmeterol. Biochemistry, 1999. 38(35): p. 11278-86. Chemical & Physical Properties Molecular Formula C25H37NO4 Exact Mass 415.272247 PSA 81.95000 Index of Refraction 1.566 InChIKey GIIZNNXWQWCKIB-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 1,3-Benzenedimethanol, 4-hydroxy-alpha1-(((6-(4-phenylbutoxy)hexyl)amino)met hyl)-, (+-)- CAS REGISTRY NUMBER : 89365-50-4 LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C25-H37-N-O4 MOLECULAR WEIGHT : HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 5600 ug/kg/28D-I TOXIC EFFECTS : Liver - changes in liver weight Blood - changes in spleen Immunological Including Allergic - decreased immune response REFERENCE : IJIMDS International Journal of Immunopharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1979- Volume(issue)/page/year: 18,523,1996 Safety Information RTECS CZ6457000 HS Code 2922509090 Synthetic Route 2-(Benzyl(6-(4-... 943969-38-8 Salmeterol 89365-50-4 4-Phenylbutan-1... Salmeterol 89365-50-4 Literature: Synthetic Communications, , vol. 29, # 12 p. 2155 - 2162 [4-(6-BROMO-HEX... 94749-73-2 Salmeterol 89365-50-4 Literature: Synthetic Communications, , vol. 29, # 12 p. 2155 - 2162 Precursor & DownStream Precursor 9 CAS#:3360-41-6 4-Phenylbutan-1-ol CAS#:94749-73-2 [4-(6-BROMO-HEX... CAS#:934842-69-0 4-[2-[benzyl-[6... CAS#:629-03-8 1,6-Dibromohexane DownStream 0
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