Acetyldiethylstilbestrol 2,3,4-Tri-O-acetyl-Beta-D-glucuronide Methyl Ester

CAS: 40269-22-5

Ref. TR-A173650

Produktinformation

• Name: Acetyldiethylstilbestrol 2,3,4-Tri-O-acetyl-Beta-D-glucuronide Methyl Ester
• Synonyme: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[4-[(E)-4-(4-acetyloxyphenyl)hex-3-en-3-yl]phenoxy]oxane-2-carboxylate
• Marke: TRC

Beschreibung

Applications Intermediate for the preparation of Diethylstilbestrol β-D-Glucuronide.

Chemische Eigenschaften

• Molekulargewicht: 626.65
• Formel: C₃₃H₃₈O₁₂
• Farbe/Form: Neat
• InChl: InChI=1S/C33H38O12/c1-8-26(22-10-14-24(15-11-22)40-18(3)34)27(9-2)23-12-16-25(17-13-23)44-33-31(43-21(6)37)29(42-20(5)36)28(41-19(4)35)30(45-33)32(38)39-7/h10-17,28-31,33H,8-9H2,1-7H3/b27-26+/t28-,29-,30-,31+,33+/m0/s1
• InChI Key: InChIKey=LMEOVEVTJJLCOK-FCQDFCJFSA-N
• SMILES: CC/C(=C(/CC)c1ccc(O[C@@H]2O[C@H](C(=O)OC)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1)c1ccc(OC(C)=O)cc1