3-(Decyloxy)-2,7,8-Trihydroxy-(1)Benzopyrano(5,4,3-Cde)(1)Benzopyran-5,10-Dione
[CAS# 110007-19-7]

Identification

• Name: 3-(Decyloxy)-2,7,8-Trihydroxy-(1)Benzopyrano(5,4,3-Cde)(1)Benzopyran-5,10-Dione
• Synonyms: 3-O-Decylellagic Acid
• Molecular Formula: C₂₄H₂₆O₈
• Molecular Weight: 442.46
• CAS Registry Number: 110007-19-7
• SMILES: C3=C(O)C(=C2OC(=O)C1=CC(=C(O)C4=C1C2=C3C(O4)=O)O)OCCCCCCCCCC
• InChI: 1S/C24H26O8/c1-2-3-4-5-6-7-8-9-10-30-20-16(26)12-14-18-17-13(24(29)32-22(18)20)11-15(25)19(27)21(17)31-23(14)28/h11-12,25-27H,2-10H2,1H3
• InChIKey: IOLJKBSBRLZDIU-UHFFFAOYSA-N

Properties

• Density: 1.381g/cm³ (Cal.)
• Boiling point: 710.592°C at 760 mmHg (Cal.)
• Flash point: 245.838°C (Cal.)