Name: Silodosin-[d4] β-D-Glucuronide Sodium Salt
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-015162

Molecular Formula: C31H35D4F3N3NaO10

Molecular Weight: 697.67

Chemical Structure

Silodosin-[d4] β-D-Glucuronide Sodium Salt

Description	An isotope labelled metabolite of Silodosin. Silodosin is an α1-adrenoceptor antagonist. It can be used for symptomatic treatment of benign prostatic hyperplasia.
Synonyms	Sodium (2S,3S,4S,5R,6R)-6-(3-(7-carbamoyl-5-((R)-2-((2-(2-(2,2,2-trifluoroethoxy)phenoxy)ethyl-1,1,2,2-d4)amino)propyl)indolin-1-yl)propoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate; Silodosin-D4 β-D-Glucuronide Sodium Salt; Silodosin-d4 beta-D-Glucuronide Sodium Salt; 3-[7-(Aminocarbonyl)-2,3-dihydro-5-[(2R)-2-[[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethyl]amino]propyl]-1H-indol-1-yl]propyl-d4 β-D-Glucopyranosiduronic Acid Monosodium Salt
IUPAC Name	sodium;(2S,3S,4S,5R,6R)-6-[3-[7-carbamoyl-5-[(2R)-2-[[1,1,2,2-tetradeuterio-2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethyl]amino]propyl]-2,3-dihydroindol-1-yl]propoxy]-3,4,5-trihydroxyoxane-2-carboxylate
Related CAS	879292-24-7 (unlabelled) 879396-70-0 (unlabelled free acid)
Canonical SMILES	[2H]C([2H])(C([2H])([2H])OC1=CC=CC=C1OCC(F)(F)F)N[C@H](C)CC2=CC3=C(C(=C2)C(=O)N)N(CC3)CCCO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)[O-])O)O)O.[Na+]
InChI	InChI=1S/C31H40F3N3O10.Na/c1-17(36-8-12-44-21-5-2-3-6-22(21)46-16-31(32,33)34)13-18-14-19-7-10-37(23(19)20(15-18)28(35)41)9-4-11-45-30-26(40)24(38)25(39)27(47-30)29(42)43;/h2-3,5-6,14-15,17,24-27,30,36,38-40H,4,7-13,16H2,1H3,(H2,35,41)(H,42,43);/q;+1/p-1/t17-,24+,25+,26-,27+,30-;/m1./s1/i8D2,12D2;
InChI Key	SSXDGVSHJRFUEJ-WQEZOVLFSA-M
Purity	95% by HPLC; 98% atom D;
Storage	Store at 2-8 °C