4-[4-[2-Oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethyl]Phenyl]-5H-Furan-2-One
[CAS# 37636-71-8]

Identification

• Name: 4-[4-[2-Oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxyphenyl]Ethyl]Phenyl]-5H-Furan-2-One
• Synonyms: 4-[4-[2-Oxo-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxyphenyl]Ethyl]Phenyl]-5H-Furan-2-One; 4-[4-[2-Oxo-2-[4-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]Phenyl]Ethyl]Phenyl]-5H-Furan-2-One; 4-[4-[2-Keto-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxyphenyl]Ethyl]Phenyl]-5H-Furan-2-One
• Molecular Formula: C₂₄H₂₄O₉
• Molecular Weight: 456.45
• CAS Registry Number: 37636-71-8
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)OC4=CC=C(C(=O)CC3=CC=C(C2=CC(OC2)=O)C=C3)C=C4
• InChI: 1S/C24H24O9/c25-11-19-21(28)22(29)23(30)24(33-19)32-17-7-5-15(6-8-17)18(26)9-13-1-3-14(4-2-13)16-10-20(27)31-12-16/h1-8,10,19,21-25,28-30H,9,11-12H2/t19-,21-,22+,23-,24-/m1/s1
• InChIKey: UIMPACXRSOBGQI-PFKOEMKTSA-N

Properties

• Density: 1.467g/cm³ (Cal.)
• Boiling point: 780.478°C at 760 mmHg (Cal.)
• Flash point: 270.954°C (Cal.)