3-O-Acetyl Ezetimibe 2,3,4-Tri-O-acetyl-β-D-glucuronide Methyl Ester

CAS: 190448-56-7

Ref. TR-A173800

Informação sobre produto

• Nome: 3-O-Acetyl Ezetimibe 2,3,4-Tri-O-acetyl-β-D-glucuronide Methyl Ester
• Sinónimos: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[4-[(2S,3R)-3-[(3S)-3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]oxane-2-carboxylate
• Marca: TRC
• Descrição: Applications Intermediate in the preparation of Phase-II metabolites of Ezetimibe. Glucuronide azetidinone cholesterol absorption inhibitor.References Mutlib, A., et al.: Drug Metab. Dispos., 20, 451 (1992), Clader, J., et al.: J. Med. Chem., 39, 3684 (1996), van Heek, M., et al.: J. Pharmacol. Exp. Ther., 283, 157 (1997),

Propriedades químicas

• Peso molecular: 767.72
• Fórmula: C₃₉H₃₉F₂NO₁₃
• Cor/forma: Neat
• InChI: InChI=1S/C39H39F2NO13/c1-20(43)50-31(24-6-10-26(40)11-7-24)19-18-30-32(42(37(30)47)28-14-12-27(41)13-15-28)25-8-16-29(17-9-25)54-39-36(53-23(4)46)34(52-22(3)45)33(51-21(2)44)35(55-39)38(48)49-5/h6-17,30-36,39H,18-19H2,1-5H3/t30-,31+,32-,33+,34+,35+,36-,39-/m1/s1
• Chave InChI: InChIKey=NZXOBPVQKQLFNG-HOEWMZCESA-N
• SMILES: COC(=O)[C@H]1O[C@@H](Oc2ccc([C@@H]3[C@@H](CC[C@H](OC(C)=O)c4ccc(F)cc4)C(=O)N3c3ccc(F)cc3)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O