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Salmeterol-[d3]

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General Information
Catalog: BLP-013905
CAS: 497063-94-2
Molecular Formula: C25H34D3NO4
Molecular Weight: 418.58

Chemical Structure

Description	A deuterated salmeterol. Salmeterol is a β2-Adrenergic agonist used for relief and control of asthma symptoms
Synonyms	4-Hydroxy-alpha1[[[6-(4-phenylbutoxy)hexyl]amino]methyl]-1,3-benzenedimethanol-d3; GR-33343X-d3
IUPAC Name	4-[1-deuterio-1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]-2-[dideuterio(hydroxy)methyl]phenol
Related CAS	89365-50-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C1=C(C=CC(=C1)C([2H])(CNCCCCCCOCCCCC2=CC=CC=C2)O)O)O
Canonical SMILES	C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O
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/i20D2,25D
InChI Key	GIIZNNXWQWCKIB-LPUTUNIKSA-N
Boiling Point	603.0°C at 760 mmHg
Melting Point	75-77°C
Purity	98%; 99% atom D
Density	1.1 g/cm3
Solubility	Soluble in Water (<0.1%), Methanol, and Chloroform.
Appearance	White to Off-White Solid