6-O-Galloyl Arbutin
[CAS# 5991-00-4]

Identification

• Name: 6-O-Galloyl Arbutin
• Synonyms: [(2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-Hydroxyphenoxy)Tetrahydropyran-2-Yl]Methyl 3,4,5-Trihydroxybenzoate; 3,4,5-Trihydroxybenzoic Acid [(2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-Hydroxyphenoxy)-2-Tetrahydropyranyl]Methyl Ester; 3,4,5-Trihydroxybenzoic Acid [(2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-Hydroxyphenoxy)Tetrahydropyran-2-Yl]Methyl Ester
• Molecular Formula: C₁₉H₂₀O₁₁
• Molecular Weight: 424.36
• CAS Registry Number: 5991-00-4
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)COC(C2=CC(=C(C(=C2)O)O)O)=O)O)O)OC3=CC=C(C=C3)O
• InChI: 1S/C19H20O11/c20-9-1-3-10(4-2-9)29-19-17(26)16(25)15(24)13(30-19)7-28-18(27)8-5-11(21)14(23)12(22)6-8/h1-6,13,15-17,19-26H,7H2/t13-,15-,16+,17-,19-/m1/s1
• InChIKey: KPFBMNKCSZQESS-WIMVFMHDSA-N

Properties

• Density: 1.664g/cm³ (Cal.)
• Boiling point: 808.169°C at 760 mmHg (Cal.)
• Flash point: 289.097°C (Cal.)