[2-[(6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-10,13-Dimethyl-3,11 -Dioxo-1,2,6,7,8,9,12,14,15,16-Decahydrocyclopenta[a]Phenanthren-17-Yl ]-2-Oxo-Ethyl] Acetate
[CAS# 16319-99-6]

Identification

• Name: [2-[(6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-10,13-Dimethyl-3,11 -Dioxo-1,2,6,7,8,9,12,14,15,16-Decahydrocyclopenta[a]Phenanthren-17-Yl ]-2-Oxo-Ethyl] Acetate
• Synonyms: [2-[(6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-10,13-Dimethyl-3,11-Dioxo-1,2,6,7,8,9,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-10,13-Dimethyl-3,11-Dioxo-1,2,6,7,8,9,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-3,11-Diketo-10,13-Dimethyl-1,2,6,7,8,9,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₃H₂₉ClO₆
• Molecular Weight: 436.93
• CAS Registry Number: 16319-99-6
• SMILES: [C@]4([C@]3(CC(=O)[C@@H]2[C@]1(C)C(=CC(=O)CC1)[C@H](C[C@H]2[C@@H]3CC4)Cl)C)(O)C(COC(=O)C)=O
• InChI: 1S/C23H29ClO6/c1-12(25)30-11-19(28)23(29)7-5-15-14-9-17(24)16-8-13(26)4-6-21(16,2)20(14)18(27)10-22(15,23)3/h8,14-15,17,20,29H,4-7,9-11H2,1-3H3/t14-,15-,17-,20+,21-,22-,23-/m0/s1
• InChIKey: MLTOGNYFVGWIRE-PLTZVPCUSA-N

Properties

• Density: 1.324g/cm³ (Cal.)
• Boiling point: 605.901°C at 760 mmHg (Cal.)
• Flash point: 320.238°C (Cal.)