5alpha,6alpha-Epoxy-3beta,17-Dihydroxy-16alpha-Methylpregnan-20-One 3-Acetate
[CAS# 2857-83-2]

Identification

• Name: 5alpha,6alpha-Epoxy-3beta,17-Dihydroxy-16alpha-Methylpregnan-20-One 3-Acetate
• Molecular Formula: C₂₄H₃₆O₅
• Molecular Weight: 404.55
• CAS Registry Number: 2857-83-2
• EINECS: 220-671-5
• SMILES: [C@]45([C@H]([C@H]2[C@@H]([C@@]3(C1(OC1C2)C[C@@H](OC(=O)C)CC3)C)CC4)C[C@H]([C@@]5(C(=O)C)O)C)C
• InChI: 1S/C24H36O5/c1-13-10-19-17-11-20-23(29-20)12-16(28-15(3)26)6-8-21(23,4)18(17)7-9-22(19,5)24(13,27)14(2)25/h13,16-20,27H,6-12H2,1-5H3/t13-,16+,17-,18+,19+,20?,21-,22+,23?,24+/m1/s1
• InChIKey: ZZEABJWXAVDRKW-NTXICKLYSA-N

Properties

• Density: 1.201g/cm³ (Cal.)
• Boiling point: 508.021°C at 760 mmHg (Cal.)
• Flash point: 167.05°C (Cal.)