Oviol
[CAS# 71138-35-7]

Identification

• Name: Oviol
• Synonyms: (8S,9S,10R,13S,14S,17R)-13-Ethyl-17-Ethynyl-11-Methylene-1,2,3,6,7,8,9,10,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-17-Ol; (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; Desogen; 19-Norpregna-1,3,5(10)-Trien-20-Yne-3,17-Diol, (17Alpha)-, Mixt. With (17Alpha)-13-Ethyl-11-Methylene-18,19-Dinorpregn-4-En-20-Yn-17-Ol
• Molecular Formula: C₄₂H₅₄O₃
• Molecular Weight: 606.89
• CAS Registry Number: 71138-35-7
• SMILES: [C@H]34[C@H]2[C@@H]([C@@H]1C(=CCCC1)CC2)C(C[C@@]3([C@@](O)(CC4)C#C)CC)=C.[C@H]78[C@H]5[C@@H](C6=C(CC5)C=C(O)C=C6)CC[C@@]7([C@@](O)(CC8)C#C)C
• InChI: 1S/C22H30O.C20H24O2/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2;1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3;1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t17-,18-,19-,20+,21-,22-;16-,17-,18+,19+,20+/m01/s1
• InChIKey: MXBCYQUALCBQIJ-RYVPXURESA-N