(17R)-13-Ethyl-17-Ethynyl-17-Hydroxy-11-Methylidene-2,6,7,8,9,10,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One; (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
[CAS# 135988-10-2]

Identification

• Name: (17R)-13-Ethyl-17-Ethynyl-17-Hydroxy-11-Methylidene-2,6,7,8,9,10,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One; (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
• Synonyms: (17R)-13-Ethyl-17-Ethynyl-17-Hydroxy-11-Methylene-2,6,7,8,9,10,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-3-One; (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; 18,19-Dinorpregn-4-En-20-Yn-3-One, 13-Ethyl-17-Hydroxy-11-Methylene-, (17Alpha)-, Mixt. With (17Alpha)-19-Norpregna-1,3,5(10)-Trien-20-Yne-3,17-Diol; Ethinylestradiol-3-Oxodesogestrel Mixt.
• Molecular Formula: C₄₂H₅₂O₄
• Molecular Weight: 620.87
• CAS Registry Number: 135988-10-2
• SMILES: [C@H]34[C@H]1[C@@H](C2=C(CC1)C=C(O)C=C2)CC[C@@]3([C@@](O)(CC4)C#C)C.[C@]8(O)(C5(C(C7C(C(C5)=C)C6C(=CC(=O)CC6)CC7)CC8)CC)C#C
• InChI: 1S/C22H28O2.C20H24O2/c1-4-21-13-14(3)20-17-9-7-16(23)12-15(17)6-8-18(20)19(21)10-11-22(21,24)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/h2,12,17-20,24H,3-4,6-11,13H2,1H3;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: MXDOOIVQXATHKU-RINAXLLBSA-N