463962-56-3

Basic information

• Product Name: Simvastatin Acyl-b-D-glucuronide
• Synonyms: 1-[(βR,δR,1S,2S,6R,8S,8aR)-8-(2,2-DiMethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-diMethyl-1-naphthaleneheptanoate] β-D-Glucopyranuronic Acid;1-[(bR,dR,1S,2S,6R,8S,8aR)-8-(2,2-Dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-b,d-dihydroxy-2,6-dimethyl-1-naphthaleneheptanoate] b-D-Glucopyranuronic Acid;Simvastatin Acyl-b-D-glucuronide;1-[(R,dR,1S,2S,6R,8S,8aR)-8-(2,2-Dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-,d-dihydroxy-2,6-dimethyl-1-naphthaleneheptanoate] -D-Glucopyranuronic Acid;Simvastatin Acyl--D-glucuronide
• CAS NO: 463962-56-3
• Molecular Formula: C31H48O12
• Molecular Weight: 612.70562
• Product Categories: Pharmaceuticals;Chiral Reagents;Glucuronides;Intermediates & Fine Chemicals;Metabolites & Impurities
• Mol File: 463962-56-3.mol
• Article Data: 0

Chemical Properties

• Melting Point: 90-95?C
• Boiling Point: 800.055°C at 760 mmHg
• Flash Point: 251.125°C
• Appearance: /
• Density: 1.318g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.575
• Storage Temp.: Hygroscopic, -20°C Freezer, Under Inert Atmosphere
• Solubility: Methanol (Slightly)
• Stability: Hygroscopic
• CAS DataBase Reference: Simvastatin Acyl-b-D-glucuronide(CAS DataBase Reference)
• NIST Chemistry Reference: Simvastatin Acyl-b-D-glucuronide(463962-56-3)
• EPA Substance Registry System: Simvastatin Acyl-b-D-glucuronide(463962-56-3)

Safety Data

• Hazardous Substances Data: 463962-56-3(Hazardous Substances Data)

Usage

Chemical Properties

Off-White Solid

InChI:InChI=1/C31H48O12/c1-6-31(4,5)30(40)41-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-18(32)13-19(33)14-22(34)42-29-26(37)24(35)25(36)27(43-29)28(38)39/h7-8,11,15-16,18-21,23-27,29,32-33,35-37H,6,9-10,12-14H2,1-5H3,(H,38,39)/t15-,16-,18+,19+,20-,21-,23-,24?,25+,26?,27?,29-/m0/s1