(5S)-5-[(beta-D-Glucopyranosyloxy)Methyl]-2(5H)-Furanone
[CAS# 644-69-9]

Identification

• Name: (5S)-5-[(beta-D-Glucopyranosyloxy)Methyl]-2(5H)-Furanone
• Synonyms: (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxymethyl]-5H-Furan-2-One; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxymethyl]-5H-Furan-2-One; (5S)-5-[[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxymethyl]-5H-Furan-2-One
• Molecular Formula: C₁₁H₁₆O₈
• Molecular Weight: 276.24
• CAS Registry Number: 644-69-9
• EINECS: 211-421-6
• SMILES: [C@H]1([C@H]([C@@H]([C@@H](CO)O[C@H]1OC[C@H]2OC(=O)C=C2)O)O)O
• InChI: 1S/C11H16O8/c12-3-6-8(14)9(15)10(16)11(19-6)17-4-5-1-2-7(13)18-5/h1-2,5-6,8-12,14-16H,3-4H2/t5-,6+,8+,9-,10+,11+/m0/s1
• InChIKey: TYWXNGXVSZRXNA-NVZSGMJQSA-N

Properties

• Density: 1.573g/cm³ (Cal.)
• Boiling point: 585.03°C at 760 mmHg (Cal.)
• Flash point: 229.438°C (Cal.)

References

• (1): Michael Benn, Lois Jean Yelland and Masood Parvez . Ranunculin , Acta Cryst (2010). E66, o2503Â Â