4-Hydroxy Estrone 3-O-β-D-Glucuronide Triacetate Methy Ester

Ref. TR-H941963

Product Information

• Name: 4-Hydroxy Estrone 3-O-β-D-Glucuronide Triacetate Methy Ester
• Synonyms: (2S,3R,4S,5S,6S)-2-(((8R,9S,13S,14S)-4-hydroxy-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate

Description

Applications 4-Hydroxy Estrone 3-O-β-D-Glucuronide Triacetate Methy Ester is an intermediate in the synthesis of 4-Hydroxyestradiol 4-O-β-D-Glucuronide Sodium Salt, which is a glucuronide derivative of 4-Hydroxy-17β-estradiol (H941895); a metabolite of Estradiol (E888000) which is the major estrogen secreted by the premenopausal ovary.
References Bucala, R., et al.: J. Clin. Endocrinol. Metab., 60, 841 (1985); Telang, N., et al.: Anticancer Res., et al.: 11, 1021 (1991); Seeger, H., et al.: Med. Sci. Res., 26, 481 (1998); Bolton, J., et al.: Chem. Res. Toxicol., 13, 135 (2000); Salole, E.G., et al.: Anal. Profiles Drug Subs., 15, 283 (1986); Lievertz, R.W., et al.: Am. J. Obstet. Gynecol., 156, 1289 (1987)

• Brand: TRC

Chemical properties

• Molecular weight: 602.63
• Formula: C₃₁H₃₈O₁₂
• Color/Form: Neat
• InChI: InChI=1S/C31H38O12/c1-14(32)39-25-26(40-15(2)33)28(41-16(3)34)30(43-27(25)29(37)38-5)42-22-10-8-17-18-12-13-31(4)21(9-11-23(31)35)19(18)6-7-20(17)24(22)36/h8,10,18-19,21,25-28,30,36H,6-7,9,11-13H2,1-5H3/t18-,19-,21+,25+,26+,27+,28-,30-,31+/m1/s1
• InChI key: InChIKey=IPGGELGANIXRSX-RBUKOAKNSA-N
• SMILES: C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)cc1OC