Cichoriin
[CAS# 531-58-8]

Identification

• Name: Cichoriin
• Synonyms: 6-Hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Chromen-2-One; 6-Hydroxy-7-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Chromenone; 6-Hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Coumarin
• Molecular Formula: C₁₅H₁₆O₉
• Molecular Weight: 340.29
• CAS Registry Number: 531-58-8
• SMILES: [C@@H]3(OC1=CC2=C(C=C1O)C=CC(O2)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO
• InChI: 1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-4-8-6(3-7(9)17)1-2-11(18)22-8/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1
• InChIKey: WNBCMONIPIJTSB-TVKJYDDYSA-N

Properties

• Density: 1.7±0.1g/cm³ (Cal.)
• Boiling point: 697.7±55.0°C at 760 mmHg (Cal.)
• Flash point: 262.8±25.0°C (Cal.)