An internal standard for the quantification of hexestrol
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Unlabeled Version(s)
29003Hexestrol
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Hexestrol-d6

Item No. 43149

Technical Information
Formal Name
4,4'-(hexane-3,4-diyl-2,2,3,4,5,5-d6)diphenol
CAS Number
1219798-48-7
Synonyms
  • Hexoestrol-d6
  • meso-Hexestrol-d6
Molecular Formula
C18H16D6O2
Formula Weight
Purity
≥99% deuterated forms (d1-d6
A solid
DMSO: Slightly solubleMethanol: Slightly soluble
SMILES
CC([2H])([2H])C(C1=CC=C(C=C1)O)([2H])C(C2=CC=C(C=C2)O)([2H])C([2H])([2H])C
InChi Code
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/i3D2,4D2,17D,18D
InChi Key
PBBGSZCBWVPOOL-WQNCLESNSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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    Product Description

    Hexestrol-d6 is intended for use as an internal standard for the quantification of hexestrol (Item No. 29003) by GC- or LC-MS. Hexestrol is a synthetic non-steroidal estrogen receptor ligand that binds to estrogen receptor α (ERα) and ERβ (Kis = 0.06 and 0.06 nM for the human and rat receptors, respectively).1 It inhibits rat liver microsomal and ox brain phospholipid liposomal lipid peroxidation (IC50s = 1.5 and 2.75 μM, respectively).2 It also inhibits porcine microtubule assembly and induces disassembly of preformed microtubules when used at concentrations of 50 and 100 μM, respectively, in a cell-free assay.3 Hexestrol (25 mg/animal) induces kidney tumors in male Syrian hamsters.4

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Kuiper, G.G.J.M., Carlsson, B., Grandien, K., et alComparison of the ligand binding specificity and transcript tissue distribution of estrogen receptors α and β. Endocrinology 138(3), 863-870 (1997).

    2. Wiseman, H., and Halliwell, B. Carcinogenic antioxidants. Diethylstilboestrol, hexoestrol and 17 α-ethynyloestradiol. FEBS Lett. 332(1-2), 159-163 (1993).

    3. Sato, Y., Murai, T., Oda, T., et alInhibition of microtubule polymerization by synthetic estrogens: Formation of a ribbon structure. J. Biochem. 101(5), 1247-1252 (1987).

    4. Liehr, J.G., Ballatore, A.M., Dague, B.B., et alCarcinogenicity and metabolic activation of hexestrol. Chem. Biol. Interact. 55(1-2), 157-176 (1985).