(6S,8S,9S,10R,11S,13S,14S,17R)-17-Acetyl-11,17-Dihydroxy-6,10,13-Trimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3- One
[CAS# 7055-53-0]

Identification

• Name: (6S,8S,9S,10R,11S,13S,14S,17R)-17-Acetyl-11,17-Dihydroxy-6,10,13-Trimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-3- One
• Synonyms: (6S,8S,9S,10R,11S,13S,14S,17R)-17-Ethanoyl-11,17-Dihydroxy-6,10,13-Trimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-3-One; 11Beta-17-Dihydroxy-6Alpha-Methylpregn-4-Ene-3,20-Dione; 6Alpha-Methyl-11Beta,17Alpha-Dihydroxyprogesterone
• Molecular Formula: C₂₂H₃₂O₄
• Molecular Weight: 360.49
• CAS Registry Number: 7055-53-0
• SMILES: [C@@]4([C@]3(C[C@H](O)[C@@H]2[C@@]1(C)CCC(=O)C=C1[C@H](C[C@H]2[C@@H]3CC4)C)C)(C(C)=O)O
• InChI: 1S/C22H32O4/c1-12-9-15-16-6-8-22(26,13(2)23)21(16,4)11-18(25)19(15)20(3)7-5-14(24)10-17(12)20/h10,12,15-16,18-19,25-26H,5-9,11H2,1-4H3/t12-,15-,16-,18-,19+,20-,21-,22-/m0/s1
• InChIKey: VSGTWMOZGFNRPM-RSWUNGFYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 527.365°C at 760 mmHg (Cal.)
• Flash point: 286.817°C (Cal.)