1-[4-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethanone
[CAS# 149561-88-6]

Identification

• Name: 1-[4-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethanone
• Synonyms: 1-[4-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Phenyl]Ethanone; 1-[4-Hydroxy-2-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Ethanone; 1-[4-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Phenyl]Ethanone
• Molecular Formula: C₁₄H₁₈O₈
• Molecular Weight: 314.29
• CAS Registry Number: 149561-88-6
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO)O)O)OC2=C(C=CC(=C2)O)C(=O)C
• InChI: 1S/C14H18O8/c1-6(16)8-3-2-7(17)4-9(8)21-14-13(20)12(19)11(18)10(5-15)22-14/h2-4,10-15,17-20H,5H2,1H3/t10-,11-,12+,13-,14-/m1/s1
• InChIKey: UEIZKRYEGCOJBJ-RKQHYHRCSA-N

Properties

• Density: 1.522g/cm³ (Cal.)
• Boiling point: 634.124°C at 760 mmHg (Cal.)
• Flash point: 239.895°C (Cal.)