Methyl-1-(6-tert-butyldimethylsylyl-4’-hydroxyraloxifene)-2,3,4-tri-O-acetyl-Beta-D-glycopyranuronate

CAS: 174264-48-3

Ref. TR-M294409

Produktinformation

• Name: Methyl-1-(6-tert-butyldimethylsylyl-4’-hydroxyraloxifene)-2,3,4-tri-O-acetyl-Beta-D-glycopyranuronate
• Synonyme: 4-[6-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-3-[4-[2-(1-piperidinyl)ethoxy]benzoyl]benzo[b]thien-2-yl]phenyl β-D-Glucopyranosiduronic Acid Methyl Ester 2,3,4-Triacetate

Beschreibung

Applications An intermediate in the synthesis for the metabolite of Raloxifene, a nonsteroidal estrogen receptor mixed agonist/antagonist.
References Dodge, J. A., et al.: Bioorg. Med. Chem. Lett., 7, 993 (1997)

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 904.105
• Formel: C₄₇H₅₇NO₁₃SSi
• Farbe/Form: Orange Foam
• InChl: InChI=1S/C47H57NO13SSi/c1-28(49)56-40-41(57-29(2)50)43(58-30(3)51)46(60-42(40)45(53)54-7)59-34-19-15-32(16-20-34)44-38(36-22-21-35(27-37(36)62-44)61-63(8,9)47(4,5)6)39(52)31-13-17-33(18-14-31)55-26-25-48-23-11-10-12-24-48/h13-22,27,40-43,46H,10-12,23-26H2,1-9H3/t40-,41-,42-,43+,46+/m0/s1
• InChI Key: InChIKey=YPNOPKDREFSCOE-BJWFOKEOSA-N
• SMILES: COC(=O)[C@H]1O[C@@H](Oc2ccc(-c3sc4cc(O[Si](C)(C)C(C)(C)C)ccc4c3C(=O)c3ccc(OCCN4CCCCC4)cc3)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O