(3S,8S,9S,10R,11S,13S,14S,17S)-10,13,17-Trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthrene-3,11,17-Triol
[CAS# 5446-39-9]

Identification

• Name: (3S,8S,9S,10R,11S,13S,14S,17S)-10,13,17-Trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthrene-3,11,17-Triol
• Synonyms: Nsc17252; 17-Methylandrost-5-Ene-3Beta,11Beta,17Beta-Triol; C15041
• Molecular Formula: C₂₀H₃₂O₃
• Molecular Weight: 320.47
• CAS Registry Number: 5446-39-9
• SMILES: [C@]1([C@]2(C)[C@@H](CC1)[C@H]3[C@H]([C@@H](O)C2)[C@@]4(C(=CC3)C[C@H](CC4)O)C)(C)O
• InChI: 1S/C20H32O3/c1-18-8-6-13(21)10-12(18)4-5-14-15-7-9-20(3,23)19(15,2)11-16(22)17(14)18/h4,13-17,21-23H,5-11H2,1-3H3/t13-,14-,15-,16-,17+,18-,19-,20-/m0/s1
• InChIKey: GKKUXCSIYRLCSI-AGVUXJGHSA-N

Properties

• Density: 1.178g/cm³ (Cal.)
• Boiling point: 470.725°C at 760 mmHg (Cal.)
• Flash point: 213.01°C (Cal.)