(8R,9S,10R,14S)-13-Ethyl-17-Ethynyl-2,3,6,7,8,9,10,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Ol
[CAS# 124478-41-7]

Identification

• Name: (8R,9S,10R,14S)-13-Ethyl-17-Ethynyl-2,3,6,7,8,9,10,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Ol
• Synonyms: 17-Ethynyl-13-Ethyl-4-Gonene-17-Ol; 3-Deoxonorgestrel
• Molecular Formula: C₂₁H₃₀O
• Molecular Weight: 298.47
• CAS Registry Number: 124478-41-7
• SMILES: [C@H]34[C@H]2[C@@H]([C@@H]1C(=CCCC1)CC2)CCC3(C(O)(CC4)C#C)CC
• InChI: 1S/C21H30O/c1-3-20-13-11-17-16-8-6-5-7-15(16)9-10-18(17)19(20)12-14-21(20,22)4-2/h2,7,16-19,22H,3,5-6,8-14H2,1H3/t16-,17+,18+,19-,20?,21?/m0/s1
• InChIKey: MXXKGWYLIJQEBP-HSEZNXMJSA-N