(3S,3aS,5aR,6R,9aS,9bS)-6-Hydroxy-3,5alpha-Dimethyl-9-Methylidene-3a,4,5,6,7,8,9a,9b-Octahydro-3H-Naphtho[3,4-d]Furan-2-One
[CAS# 32223-12-4]

Identification

• Name: (3S,3aS,5aR,6R,9aS,9bS)-6-Hydroxy-3,5alpha-Dimethyl-9-Methylidene-3a,4,5,6,7,8,9a,9b-Octahydro-3H-Naphtho[3,4-d]Furan-2-One
• Synonyms: (3S,3As,5Ar,6R,9As,9Bs)-6-Hydroxy-3,5A-Dimethyl-9-Methylene-3A,4,5,6,7,8,9A,9B-Octahydro-3H-Benzo[G]Benzofuran-2-One; Aids104095; 11-Epi-Dihydroreynosin
• Molecular Formula: C₁₅H₂₂O₃
• Molecular Weight: 250.34
• CAS Registry Number: 32223-12-4
• SMILES: [C@H]12OC(=O)[C@H]([C@@H]1CC[C@@]3([C@@H]2C(CC[C@H]3O)=C)C)C
• InChI: 1S/C15H22O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h9-13,16H,1,4-7H2,2-3H3/t9-,10-,11+,12+,13-,15-/m0/s1
• InChIKey: JWBPWNWPEVPCMJ-DMLGPZFASA-N

Properties

• Density: 1.143g/cm³ (Cal.)
• Boiling point: 402.675°C at 760 mmHg (Cal.)
• Flash point: 168.763°C (Cal.)