6beta)-3-(Acetyloxy)-5,6-Epoxyandrostan-17-One (3beta 5beta
[CAS# 6585-68-8]

Identification

• Name: 6beta)-3-(Acetyloxy)-5,6-Epoxyandrostan-17-One (3beta 5beta
• Synonyms: 3-(Acetyloxy)-5,6-Epoxyandrostan-17-One (3Beta,5Beta,6Beta)-; Androstan-17-One, 3-(Acetyloxy)-5,6-Epoxy-, (3Beta,5Beta,6Beta)-
• Molecular Formula: C₂₁H₃₀O₄
• Molecular Weight: 346.47
• CAS Registry Number: 6585-68-8
• SMILES: [C@@H]1(CC[C@]3([C@@]5(C1)[C@H](C[C@H]4[C@@H]2CCC([C@@]2(C)CC[C@H]34)=O)O5)C)OC(=O)C
• InChI: 1S/C21H30O4/c1-12(22)24-13-6-9-20(3)16-7-8-19(2)15(4-5-17(19)23)14(16)10-18-21(20,11-13)25-18/h13-16,18H,4-11H2,1-3H3/t13-,14-,15-,16-,18-,19-,20+,21+/m0/s1
• InChIKey: RUQCGCWODJEVJZ-WLFCNCKTSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 452.634°C at 760 mmHg (Cal.)
• Flash point: 196.7°C (Cal.)