17-Ethynyl-5-Estrane-3,17-Diol
[CAS# 25796-09-2]

Identification

• Name: 17-Ethynyl-5-Estrane-3,17-Diol
• Synonyms: 17-Ethynyl-5-Estrane-3,17-Diol; 19-Nor-5Beta,17Alpha-Pregn-20-Yne-3Alpha,17-Diol; 19-Norpregn-20-Yne-3,17-Diol
• Molecular Formula: C₂₀H₃₀O₂
• Molecular Weight: 302.46
• CAS Registry Number: 25796-09-2
• SMILES: [C@H]1(CC[C@H]3[C@@H](C1)CC[C@H]4[C@@H]2CCC(C#C)([C@@]2(C)CC[C@H]34)O)O
• InChI: 1S/C20H30O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,13-18,21-22H,4-12H2,2H3/t13-,14-,15+,16-,17-,18+,19+,20?/m1/s1
• InChIKey: DPDZKJQFRFZZCW-XLXOIOBMSA-N