(8R,9S,10R,13S,14S,17R)-17-Ethyl-17-Hydroxy-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One
[CAS# 3090-78-6]

Identification

• Name: (8R,9S,10R,13S,14S,17R)-17-Ethyl-17-Hydroxy-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One
• Synonyms: 17-Hpeo; 17-Hydroxypregn-4-Ene-3-One; 17Alpha-Hydroxy-4-Pregnen-3-One
• Molecular Formula: C₂₁H₃₂O₂
• Molecular Weight: 316.48
• CAS Registry Number: 3090-78-6
• SMILES: [C@H]34[C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)CC[C@@]3([C@](CC)(O)CC4)C
• InChI: 1S/C21H32O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h13,16-18,23H,4-12H2,1-3H3/t16-,17+,18+,19+,20+,21-/m1/s1
• InChIKey: FGPGANCDNDLUST-SJFWLOONSA-N

Properties

• Density: 1.094g/cm³ (Cal.)
• Boiling point: 447.289°C at 760 mmHg (Cal.)
• Flash point: 190.592°C (Cal.)