(3aS,6abeta,9bbeta)-3a,4,5,6,6a,7,8,9,9a,9B-Decahydro-8beta,9beta-Dihydroxy-6alpha,9aalpha-Dimethyl-3-Methyleneazuleno[4,5-b]Furan-2(3H)-One
[CAS# 5090-67-5]

Identification

• Name: (3aS,6abeta,9bbeta)-3a,4,5,6,6a,7,8,9,9a,9B-Decahydro-8beta,9beta-Dihydroxy-6alpha,9aalpha-Dimethyl-3-Methyleneazuleno[4,5-b]Furan-2(3H)-One
• Synonyms: 8,9-Dihydroxy-6,9A-Dimethyl-3-Methylene-4,5,6,6A,7,8,9,9B-Octahydro-3Ah-Azuleno[7,8-D]Furan-2-One; 10.Alpha.H-Ambros-11(13)-En-12-Oic Acid, 3.Alpha.,4.Alpha.,6.Beta.-Trihydroxy-, .Gamma.-Lactone; Ambrosiol
• Molecular Formula: C₁₅H₂₂O₄
• Molecular Weight: 266.34
• CAS Registry Number: 5090-67-5
• SMILES: CC23C1OC(=O)C(C1CCC(C2CC(C3O)O)C)=C
• InChI: 1S/C15H22O4/c1-7-4-5-9-8(2)14(18)19-13(9)15(3)10(7)6-11(16)12(15)17/h7,9-13,16-17H,2,4-6H2,1,3H3
• InChIKey: UOGCXTUFYJBFHD-UHFFFAOYSA-N

Properties

• Density: 1.227g/cm³ (Cal.)
• Boiling point: 432.501°C at 760 mmHg (Cal.)
• Flash point: 160.206°C (Cal.)