(+)-beta-Cyclocostunolide
[CAS# 2221-82-1]

Identification

• Name: (+)-beta-Cyclocostunolide
• Synonyms: (3As,5Ar,9As,9Bs)-5A-Methyl-3,9-Dimethylene-3A,4,5,6,7,8,9A,9B-Octahydrobenzo[G]Benzofuran-2-One; Naphtho[1,2-B]Furan-2(3H)-One, Decahydro-5A-Methyl-3,9-Dimethylene-, (3As,5Ar,9As,9Bs)-; Aids-114261
• Molecular Formula: C₁₅H₂₀O₂
• Molecular Weight: 232.32
• CAS Registry Number: 2221-82-1
• SMILES: [C@H]12OC(=O)C([C@@H]1CC[C@@]3([C@@H]2C(=C)CCC3)C)=C
• InChI: 1S/C15H20O2/c1-9-5-4-7-15(3)8-6-11-10(2)14(16)17-13(11)12(9)15/h11-13H,1-2,4-8H2,3H3/t11-,12+,13-,15+/m0/s1
• InChIKey: XUYAKPXYKQEFPD-SFDCQRBFSA-N

Properties

• Density: 1.078g/cm³ (Cal.)
• Boiling point: 364.88°C at 760 mmHg (Cal.)
• Flash point: 152.67°C (Cal.)