4-Hydroxyestradiol 3-O-β-D-Glucuronide

CAS: 90746-94-4

Ref. TR-H941605

Product Information

• Name: 4-Hydroxyestradiol 3-O-β-D-Glucuronide
• Synonyms: (17beta)-4,17-Dihydroxyestra-1,3,5(10)-trien-3-yl beta-D-Glucopyranosiduronic Acid, 4-Hydroxyestradiol 3-Glucuronide, Estrane beta-D-Glucopyranosiduronic Acid derivative
• Brand: TRC
• Description: Applications 4-Hydroxyestradiol 3-O-β-D-Glucuronide 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)

Chemical properties

• Molecular weight: 464.51
• Formula: C₂₄H₃₂O₉
• Color/Form: Neat
• InChI: InChI=1S/C24H32O9/c1-24-9-8-11-10-4-6-15(32-23-20(29)18(27)19(28)21(33-23)22(30)31)17(26)13(10)3-2-12(11)14(24)5-7-16(24)25/h4,6,11-12,14,16,18-21,23,25-29H,2-3,5,7-9H2,1H3,(H,30,31)/t11-,12-,14+,16+,18+,19+,20-,21+,23-,24+/m1/s1
• InChI key: InChIKey=HGCOILRQOIIUJW-ICTMVFLBSA-N
• SMILES: C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)c(O)c4CC[C@H]3[C@@H]1CC[C@@H]2O