1-[5-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethanone
[CAS# 149475-52-5]

Identification

• Name: 1-[5-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethanone
• Synonyms: 1-[5-Hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Phenyl]Ethanone; 1-[5-Hydroxy-2-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Ethanone; 1-[5-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: 149475-52-5
• SMILES: [C@@H]1([C@@H]([C@@H](O)[C@@H]([C@H](O1)CO)O)O)OC2=CC=C(O)C=C2C(=O)C
• InChI: 1S/C14H18O8/c1-6(16)8-4-7(17)2-3-9(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: GXBCTYRBTGLIQW-RKQHYHRCSA-N

Properties

• Density: 1.522g/cm³ (Cal.)
• Boiling point: 625.627°C at 760 mmHg (Cal.)
• Flash point: 236.61°C (Cal.)