Retigabine N-β-D-Glucuronide Sodium Salt

CAS: 191873-41-3

Ref. TR-R189060

Produktinformation

• Name: Retigabine N-β-D-Glucuronide Sodium Salt
• Synonyme: 1-Deoxy-1-[[2-[(ethoxycarbonyl)amino]-5-[[(4-fluorophenyl)methyl]amino]phenyl]amino] β-D-Glucopyranuronic Acid
• Marke: TRC

Beschreibung

Applications Sodium salt of Retigabine N-β-D-Glucuronide is the major metabolite of the antiepileptic drug Retigabine (R189050) that is produced via N-glucuronidation in humans.
References Hiller, A. et al.: Drug Metab. Dispos., 27, 605 (1999); Borlak, J. et al.: Metab. Clin. Exp., 55, 711 (2006); McNeilly, P.P. et al.: Zenobiotica, 27, 431 (1997);

Chemische Eigenschaften

• Molekulargewicht: 501.44
• Formel: C₂₂H₂₅FN₃NaO₈
• Farbe/Form: Neat
• InChl: InChI=1S/C22H26FN3O8.Na/c1-2-33-22(32)26-14-8-7-13(24-10-11-3-5-12(23)6-4-11)9-15(14)25-20-18(29)16(27)17(28)19(34-20)21(30)31;/h3-9,16-20,24-25,27-29H,2,10H2,1H3,(H,26,32)(H,30,31);/q;+1/p-1/t16-,17-,18+,19-,20+;/m0./s1
• InChI Key: InChIKey=RZKTVVLXZBXQRF-FINOVQJASA-M
• SMILES: CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N[C@@H]1O[C@H](C(=O)O[Na])[C@@H](O)[C@H](O)[C@H]1O