Methyl 2-[2-Oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-Yl]Acetate
[CAS# 127615-75-2]

Identification

• Name: Methyl 2-[2-Oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-Yl]Acetate
• Synonyms: Methyl 2-[2-Oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Chromen-4-Yl]Acetate; 2-[2-Oxo-7-[[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-4-Chromenyl]Acetic Acid Methyl Ester; 2-[2-Keto-7-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Chromen-4-Yl]Acetic Acid Methyl Ester
• Molecular Formula: C₁₈H₂₀O₁₀
• Molecular Weight: 396.35
• CAS Registry Number: 127615-75-2
• SMILES: [C@@H]3(OC1=CC=C2C(=C1)OC(=O)C=C2CC(OC)=O)O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO
• InChI: 1S/C18H20O10/c1-25-13(20)4-8-5-14(21)27-11-6-9(2-3-10(8)11)26-18-17(24)16(23)15(22)12(7-19)28-18/h2-3,5-6,12,15-19,22-24H,4,7H2,1H3/t12-,15+,16+,17-,18-/m1/s1
• InChIKey: KECAQLCDHILXFI-COWMOVNHSA-N

Properties

• Density: 1.526g/cm³ (Cal.)
• Boiling point: 670.555°C at 760 mmHg (Cal.)
• Flash point: 242.308°C (Cal.)