5-Hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranoside
[CAS# 31025-53-3]

Identification

• Name: 5-Hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranoside
• Synonyms: 5,7-Dihydroxyflavone-7β-monoglucoside; Chrysin-7β-monoglucoside
• Molecular Formula: C₂₁H₂₀O₉
• Molecular Weight: 416.38
• CAS Registry Number: 31025-53-3
• SMILES: O=C\3c4c(O)cc(O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)cc4O/C(c2ccccc2)=C/3
• InChI: 1S/C21H20O9/c22-9-16-18(25)19(26)20(27)21(30-16)28-11-6-12(23)17-13(24)8-14(29-15(17)7-11)10-4-2-1-3-5-10/h1-8,16,18-23,25-27H,9H2/t16-,18-,19+,20-,21-/m1/s1
• InChIKey: PIJHQWMTZXDYER-QNDFHXLGSA-N

Properties

• Density: 1.573g/cm³ (Cal.)
• Boiling point: 736.673°C at 760 mmHg (Cal.)
• Flash point: 263.132°C (Cal.)