(1b,17a)-1-(Acetyloxy)-13-ethyl-17-hydroxy-18,19-Dinorpregn-4-en-20-yn-3-one
[CAS# 53020-96-5]

Identification

• Name: (1b,17a)-1-(Acetyloxy)-13-ethyl-17-hydroxy-18,19-Dinorpregn-4-en-20-yn-3-one
• Synonyms: Acetic Acid [(1R,8R,9S,10R,14S)-13-Ethyl-17-Ethynyl-17-Hydroxy-3-Oxo-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-1-Yl] Ester; Acetic Acid [(1R,8R,9S,10R,14S)-13-Ethyl-17-Ethynyl-17-Hydroxy-3-Keto-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-1-Yl] Ester; [(1R,8R,9S,10R,14S)-13-Ethyl-17-Ethynyl-17-Hydroxy-3-Oxo-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-1-Yl] Ethanoate
• Molecular Formula: C₂₃H₃₀O₄
• Molecular Weight: 370.49
• CAS Registry Number: 53020-96-5
• SMILES: [C@H]24[C@H]1C(C(O)(CC1)C#C)(CC[C@@H]2[C@@H]3C(=CC(=O)C[C@H]3OC(=O)C)CC4)CC
• InChI: 1S/C23H30O4/c1-4-22-10-8-18-17(19(22)9-11-23(22,26)5-2)7-6-15-12-16(25)13-20(21(15)18)27-14(3)24/h2,12,17-21,26H,4,6-11,13H2,1,3H3/t17-,18+,19+,20-,21+,22?,23?/m1/s1
• InChIKey: ZBPVWXFCEBSBMY-OAGZJYNBSA-N