(8S,10S,13S,14S,17R)-17-Acetyl-17-Hydroxy-10,13-Dimethyl-2,6,7,8,12,14,15,16-Octahydro-1H-Cyclopenta[a]Phenanthren-3-One
[CAS# 34184-82-2]

Identification

• Name: (8S,10S,13S,14S,17R)-17-Acetyl-17-Hydroxy-10,13-Dimethyl-2,6,7,8,12,14,15,16-Octahydro-1H-Cyclopenta[a]Phenanthren-3-One
• Synonyms: (8S,10S,13S,14S,17R)-17-Ethanoyl-17-Hydroxy-10,13-Dimethyl-2,6,7,8,12,14,15,16-Octahydro-1H-Cyclopenta[A]Phenanthren-3-One; 17-Hydroxypregna-4,9(11)-Diene-3,20-Dione
• Molecular Formula: C₂₁H₂₈O₃
• Molecular Weight: 328.45
• CAS Registry Number: 34184-82-2
• EINECS: 251-868-4
• SMILES: [C@H]12[C@@]([C@](O)(CC1)C(=O)C)(CC=C3[C@H]2CCC4=CC(=O)CC[C@]34C)C
• InChI: 1S/C21H28O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h7,12,16,18,24H,4-6,8-11H2,1-3H3/t16-,18+,19+,20+,21+/m1/s1
• InChIKey: ARJWMUSCDIJFLB-GVVDHYSOSA-N

Properties

• Density: 1.179g/cm³ (Cal.)
• Boiling point: 497.533°C at 760 mmHg (Cal.)
• Flash point: 268.795°C (Cal.)