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17-Alpha-Ethynylestradiol-[2,4,16,16-d4]

General Information
Catalog: BLP-009159
CAS: 350820-06-3
Molecular Formula: C20H20D4O2
Molecular Weight: 300.44
Chemical Structure
17-Alpha-Ethynylestradiol-[2,4,16,16-d4]
Description Isotope labelled derivative of Estradiol. Estradiol​ is the major estrogen secreted by the premenopausal ovary. Estrogens direct the development of the female genotype in embryogenesis and at puberty.
Synonyms (17α)-19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol-d4; 17α-Ethynylestradiol-d4; Amenoron-d4; Eticylol-d4; Eticyclin-d4; Etivex-d4; Feminone-d4; Gynolett-d4; Kolpolyn-d4; Lynoral-d4; Oradiol-d4; Orestralyn-d4; Primogyn C-d4
IUPAC Name (8R,9S,13S,14S,17S)-2,4,16,16-tetradeuterio-17-ethynyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
Related CAS 57-63-6 (unlabelled)
Canonical SMILES CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
InChI InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20-/m1/s1/i5D,11D2,12D
InChI Key BFPYWIDHMRZLRN-KFGWRLGBSA-N
Melting Point 175-178°C
Purity >95%
Solubility Soluble in Chloroform (Slightly), Methanol (Slightly), Pyridine (Slightly)
Appearance White Solid
Storage Store at -20°C

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