(3aR)-3aalpha,4,4aalpha,5,6,8,9,9a,10,10aalpha-Decahydro-9abeta-Acetoxymethyl-8beta-Hydroxy-3,5-Bis(Methylene)-6beta,9beta-Epoxyfuro[2,3-h][3]Benzoxepin-2(3H)-One
[CAS# 61701-92-6]

Identification

• Name: (3aR)-3aalpha,4,4aalpha,5,6,8,9,9a,10,10aalpha-Decahydro-9abeta-Acetoxymethyl-8beta-Hydroxy-3,5-Bis(Methylene)-6beta,9beta-Epoxyfuro[2,3-h][3]Benzoxepin-2(3H)-One
• Synonyms: Micordilin
• Molecular Formula: C₁₇H₂₀O₇
• Molecular Weight: 336.34
• CAS Registry Number: 61701-92-6
• SMILES: [C@]14([C@H](C([C@H]2O[C@@H]1[C@@H](O2)O)=C)C[C@H]3[C@H](OC(=O)C3=C)C4)COC(=O)C
• InChI: 1S/C17H20O7/c1-7-10-4-11-8(2)16-23-13(15(20)24-16)17(11,6-21-9(3)18)5-12(10)22-14(7)19/h10-13,15-16,20H,1-2,4-6H2,3H3/t10-,11+,12-,13-,15-,16+,17+/m1/s1
• InChIKey: KIMFLFYOUFXUAC-XLOUWHCTSA-N

Properties

• Density: 1.38g/cm³ (Cal.)
• Boiling point: 524.961°C at 760 mmHg (Cal.)
• Flash point: 192.855°C (Cal.)