Hexestrol-d4

• CAT Number: R010666
• CAS Number: 1189950-25-1
• Molecular Formula: C18H22O2
• Molecular Weight: 274.396
• Purity: ≥95%
• Synonyms: 4,4’-[1,2-(Diethyl-d4)-1,2-ethanediyl]bisphenol; meso-3,4-Di(p-hydroxyphenyl)-n-hexane-d4; Cycloestrol-d4; Erythrohexestrol-d4; Estrifar-d4; Estronal-d4; meso-Hexestrol-d4
• Target: Estrogen Receptor/ERR
• Storage: -80°C
• IUPAC Name: 4-[2,2,5,5-tetradeuterio-4-(4-hydroxyphenyl)hexan-3-yl]phenol
• InChI: InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3/i3D2,4D2
• InChIKey: PBBGSZCBWVPOOL-KHORGVISSA-N
• SMILES: [2H]C([2H])(C)C(C1=CC=C(C=C1)O)C(C2=CC=C(C=C2)O)C([2H])([2H])C

Hexestrol-d4 is a deuterated form of the synthetic estrogen hexestrol, where four hydrogen atoms are replaced with deuterium. This isotopically labeled compound is primarily used in pharmaceutical and biochemical research to study the metabolism, pharmacokinetics, and biological activity of estrogens. The presence of deuterium atoms provides a unique mass signature, facilitating precise tracking and analysis in mass spectrometry and NMR spectroscopy. Researchers utilize Hexestrol-d4 to investigate the metabolic pathways of estrogens, their interactions with estrogen receptors, and their role in hormone-related conditions. This compound is essential for advancing the understanding of estrogenic activity, contributing to the development of more effective hormone therapies and improving safety profiles in clinical settings.