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Hydroxy Ebastine-[d5]

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General Information
Catalog: BLP-005929
CAS: 1189954-07-1
Molecular Formula: C32H34D5NO3
Molecular Weight: 490.69

Chemical Structure

Description	Hydroxy Ebastine-[d5] is the labelled analogue of Hydroxy Ebastine, which is a metabolite of Ebastine. Ebastine is a H1 histamine blocker.
Synonyms	4-[4-(Diphenylmethoxy-d5)-1-piperidinyl]-1-[4-(2-hydroxy-1,1-dimethylethyl)phenyl]-1-butanone; Hydroxy Ebastine D5
IUPAC Name	1-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]-4-[4-[(2,3,4,5,6-pentadeuteriophenyl)-phenylmethoxy]piperidin-1-yl]butan-1-one
Related CAS	210686-41-2 (unlabelled)
Canonical SMILES	CC(C)(CO)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4
InChI	InChI=1S/C32H39NO3/c1-32(2,24-34)28-17-15-25(16-18-28)30(35)14-9-21-33-22-19-29(20-23-33)36-31(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,29,31,34H,9,14,19-24H2,1-2H3/i3D,5D,6D,10D,11D
InChI Key	UDZUMQUGNZBRMN-KILXEUBNSA-N
Melting Point	114-117°C
Purity	≥99% by HPLC; ≥99% atom D
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	Off-white to Pale Beige Solid
Storage	Store at -20°C