16-Oxo Ethynyl Estradiol

For research use only. Not for therapeutic Use.

  • CAT Number: R048285
  • CAS Number: 1350468-76-6
  • Molecular Formula: C20H22O3
  • Molecular Weight: 310.393
  • Purity: ≥95%
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Catalog Number R048285
CAS Number 1350468-76-6
Synonyms

(17α)-3,17-Dihydroxy-19-norpregna-1,3,5(10)-trien-20-yn-16-one; Ethinyl Estradiol Impurity H (EP)

Molecular Formula C20H22O3
Purity ≥95%
Storage -20°C
IUPAC Name (8R,9S,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-16-one
InChI InChI=1S/C20H22O3/c1-3-20(23)18(22)11-17-16-6-4-12-10-13(21)5-7-14(12)15(16)8-9-19(17,20)2/h1,5,7,10,15-17,21,23H,4,6,8-9,11H2,2H3/t15-,16-,17+,19+,20+/m1/s1
InChIKey ZJACPGCDLFVQMY-JOMPHRNESA-N
SMILES CC12CCC3C(C1CC(=O)C2(C#C)O)CCC4=C3C=CC(=C4)O

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