Ethinyl Estradiol
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Revision as of 00:00, 15 January 2001 by Special:Contributions/ (Talk)
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Description
A semisynthetic alkylated ESTRADIOL with a 17-alpha-ethinyl substitution. It has high estrogenic potency when administered orally, and is often used as the estrogenic component in ORAL CONTRACEPTIVES.
General Properties
*Molecular Weight
296.4
*Molecular Formula
C20H24O2
*IUPAC NAME
(8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
*Canonical Smiles
CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
*Isomeric Smiles
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O
PhysioChemical Properties
*Melting Point
183(EXP)
*LogP
3.67(EXP)
*Water Solubility
11.3(EXP) at 27C