Prednisolone-21-(2,3,4-Tri-O-acetyl-b-D-glucuronic Acid Methyl Ester)

CAS: 105560-80-3

Ref. TR-P703737

Informação sobre produto

• Nome: Prednisolone-21-(2,3,4-Tri-O-acetyl-b-D-glucuronic Acid Methyl Ester)

Descrição

Applications Prednisolone-21-(2,3,4-Tri-O-acetyl-β-D-glucuronic Acid Methyl Ester) is an intermediate in the synthesis of Prednisolone 21-β-D-Glucuronide- Sodium Salt (P703745) which is a metabolite of Prednisolone (P703740).
References Hutzler, J., ET AL.: Drug Metab. Dispos., 30, 355 (2002), Sugiyama, D., et al.: J. Biol. Chem., 278, 43489 (2003), Hagenbuch, B., et al.: Xenobiotica, 38, 778 (2008),

• Marca: TRC

Propriedades químicas

• Peso molecular: 676.79
• Fórmula: C₃₄H₄₄O₁₄
• Cor/forma: Pale yellow solid
• InChI: InChI=1S/C34H44O14/c1-16(35)45-26-27(46-17(2)36)29(47-18(3)37)31(48-28(26)30(41)43-6)44-15-24(40)34(42)12-10-22-21-8-7-19-13-20(38)9-11-32(19,4)25(21)23(39)14-33(22,34)5/h9,11,13,21-23,25-29,31,39,42H,7-8,10,12,14-15H2,1-6H3/t21?,22?,23?,25?,26-,27-,28-,29+,31+,32+,33+,34+/m1/s1
• Chave InChI: InChIKey=QSXLITYOJPKJGJ-WJSFBJJMSA-N
• SMILES: COC(=O)[C@@H]1O[C@H](OCC(=O)[C@@]2(O)CCC3C4CCC5=CC(=O)C=C[C@]5(C)C4C(O)C[C@@]32C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O