(3aR)-4beta-Acetoxy-3a,4,4a,5,6,7,7aalpha,8,9,9abeta-Decahydro-5alpha,7beta-Dihydroxy-4abeta,8alpha-Dimethyl-3-Methyleneazuleno[6,5-b]Furan-2(3H)-One
[CAS# 6851-56-5]

Identification

• Name: (3aR)-4beta-Acetoxy-3a,4,4a,5,6,7,7aalpha,8,9,9abeta-Decahydro-5alpha,7beta-Dihydroxy-4abeta,8alpha-Dimethyl-3-Methyleneazuleno[6,5-b]Furan-2(3H)-One
• Synonyms: (6,8-Dihydroxy-5,8A-Dimethyl-1-Methylene-2-Oxo-4,5,5A,6,7,8,9,9A-Octahydro-3Ah-Azuleno[6,5-B]Furan-9-Yl) Acetate; Acetic Acid (6,8-Dihydroxy-5,8A-Dimethyl-1-Methylene-2-Oxo-4,5,5A,6,7,8,9,9A-Octahydro-3Ah-Azuleno[6,5-B]Furan-9-Yl) Ester; Acetic Acid (6,8-Dihydroxy-2-Keto-5,8A-Dimethyl-1-Methylene-4,5,5A,6,7,8,9,9A-Octahydro-3Ah-Azuleno[5,6-D]Furan-9-Yl) Ester
• Molecular Formula: C₁₇H₂₄O₆
• Molecular Weight: 324.37
• CAS Registry Number: 6851-56-5
• SMILES: CC23C(C(CC1OC(=O)C(C1C2OC(=O)C)=C)C)C(O)CC3O
• InChI: 1S/C17H24O6/c1-7-5-11-13(8(2)16(21)23-11)15(22-9(3)18)17(4)12(20)6-10(19)14(7)17/h7,10-15,19-20H,2,5-6H2,1,3-4H3
• InChIKey: ROZRLLOAWQAIAR-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)
• Boiling point: 495.876°C at 760 mmHg (Cal.)
• Flash point: 178.569°C (Cal.)