3,5-Dihydroxy-4,4-Dimethyl-2-(2-Methylpropanoyl)-6-[[2,4,6-Trihydroxy-3-(3-Methylbut-2-Enyl)-5-(2-Methylpropanoyl)Phenyl]Methyl]Cyclohexa-2,5-Dien-1-One
[CAS# 19809-78-0]

Identification

• Name: 3,5-Dihydroxy-4,4-Dimethyl-2-(2-Methylpropanoyl)-6-[[2,4,6-Trihydroxy-3-(3-Methylbut-2-Enyl)-5-(2-Methylpropanoyl)Phenyl]Methyl]Cyclohexa-2,5-Dien-1-One
• Molecular Formula: C₂₈H₃₆O₈
• Molecular Weight: 500.58
• CAS Registry Number: 19809-78-0
• SMILES: CC(C)C(=O)C1=C(C(=C(C(=C1O)CC2=C(C(C(=C(C2=O)C(=O)C(C)C)O)(C)C)O)O)CC=C(C)C)O
• InChI: 1S/C28H36O8/c1-12(2)9-10-15-22(31)16(24(33)18(23(15)32)20(29)13(3)4)11-17-25(34)19(21(30)14(5)6)27(36)28(7,8)26(17)35/h9,13-14,31-33,35-36H,10-11H2,1-8H3
• InChIKey: SBVAYWWFCDLDFH-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 720.0±60.0°C at 760 mmHg (Cal.)
• Flash point: 403.2±29.4°C (Cal.)
• Refractive index: 1.605 (Cal.)