Carvedilol b-D-Glucuronide (mixture of diasteromers)

CAS: 114869-83-9

Ref. TR-C184640

Product Information

• Name: Carvedilol b-D-Glucuronide (mixture of diasteromers)
• Synonyms: 2-(9H-Carbazol-4-yloxy)-1-[[[2-(2-methoxyphenoxy)ethyl]amino]methyl]ethyl β-D-Glucopyranosiduronic Acid, Carvedilol Glucuronide, 2-(9H-Carbazol-4-yloxy)-1-[[[2-(2-methoxyphenoxy)ethyl]amino]methyl]ethyl b-D-Glucopyranosiduronic Acid, (Glucopyranosiduronic Acid, Carvedilol-D-Glucuronide, 2-(9H-Carbazol-4-yloxy)-1-[[[2-(2-methoxyphenoxy)ethyl]amino]methyl]ethyl-D-Glucopyranosiduronic Acid
• CAS: 114869-83-9

Description

Applications A metabolite of Carvedilol (C184625).
References McGurk, K., et al.: Biochem. Pharmacol., 55, 1005 (1998), Tukey, R., et al.: Annu. Rev. Pharmacol. Toxicol., 40, 581 (2000), Bowalgaha, K., et al.: Br. J. Clin. Pharmacol., 52, 605 (2001), Richardson, T., et al.: Drug Metab. Dispos., 34, 351 (2006),

• Brand: TRC

Chemical properties

• Molecular weight: 582.60
• Formula: C₃₀H₃₄N₂O₁₀
• Color/Form: White to Beige Solid
• InChI: InChI=1S/C30H34N2O10/c1-38-21-10-4-5-11-22(21)39-14-13-31-15-17(16-40-30-27(35)25(33)26(34)28(42-30)29(36)37)41-23-12-6-9-20-24(23)18-7-2-3-8-19(18)32-20/h2-12,17,25-28,30-35H,13-16H2,1H3,(H,36,37)/t17?,25-,26-,27+,28-,30+/m0/s1
• InChI key: InChIKey=PUVQFGCELBOSRN-VKTJNCFWSA-N
• SMILES: COc1ccccc1OCCNCC(COc1cccc2[nH]c3ccccc3c12)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O