Epoxyazadiradione
[CAS# 18385-59-6]

Identification

• Name: Epoxyazadiradione
• Synonyms: 24-Norchola-1,20,22-Triene-3,16-Dione, 7-(Acetyloxy)-14,15:21,23-Diepoxy-4,4,8-Trimethyl-, (5Alpha,7Alpha,13Alpha,14Beta,15Beta,17Alpha)-; Nsc 640467; Aids-030683
• Molecular Formula: C₂₈H₃₄O₆
• Molecular Weight: 466.57
• CAS Registry Number: 18385-59-6
• SMILES: [C@@]123O[C@@H]1C(=O)C(C2(CC[C@H]4[C@]3(C(OC(=O)C)C[C@@H]5[C@@]4(C=CC(=O)C5(C)C)C)C)C)C6=COC=C6
• InChI: 1S/C28H34O6/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)22(31)23-28(26,34-23)27(17,20)6/h8-10,12,14,17-18,20-21,23H,7,11,13H2,1-6H3/t17-,18+,20?,21?,23-,25-,26?,27+,28-/m1/s1
• InChIKey: NEYCGDYQBQONFC-AMVLTCCSSA-N

Properties

• Density: 1.259g/cm³ (Cal.)
• Boiling point: 569.115°C at 760 mmHg (Cal.)
• Flash point: 297.99°C (Cal.)