(2R,8S,9S,10R,11R,13S,14S,17S)-11,17-Dihydroxy-2,10,13,17-Tetramethyl- 2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One
[CAS# 5888-10-8]

Identification

• Name: (2R,8S,9S,10R,11R,13S,14S,17S)-11,17-Dihydroxy-2,10,13,17-Tetramethyl- 2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3-One
• Synonyms: Nsc49625; C15022; 11Alpha,17Beta-Dihydroxy-2Alpha,17-Dimethylandrost-4-En-3-One
• Molecular Formula: C₂₁H₃₂O₃
• Molecular Weight: 332.48
• CAS Registry Number: 5888-10-8
• SMILES: [C@@]1(O)(CC[C@H]2[C@H]4[C@H]([C@H](O)C[C@]12C)[C@]3(C[C@@H](C)C(=O)C=C3CC4)C)C
• InChI: 1S/C21H32O3/c1-12-10-19(2)13(9-16(12)22)5-6-14-15-7-8-21(4,24)20(15,3)11-17(23)18(14)19/h9,12,14-15,17-18,23-24H,5-8,10-11H2,1-4H3/t12-,14+,15+,17-,18-,19+,20+,21+/m1/s1
• InChIKey: QYTBFAIVLHMSQG-RWWLUNCRSA-N

Properties

• Density: 1.155g/cm³ (Cal.)
• Boiling point: 480.438°C at 760 mmHg (Cal.)
• Flash point: 258.468°C (Cal.)