Aloesin
[CAS# 30861-27-9]

Identification

• Name: Aloesin
• Synonyms: 2-Acetonyl-7-Hydroxy-5-Methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Chromen-4-One; 2-Acetonyl-7-Hydroxy-5-Methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]-4-Chromenone; 2-Acetonyl-7-Hydroxy-5-Methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Chromone
• Molecular Formula: C₁₉H₂₂O₉
• Molecular Weight: 394.38
• CAS Registry Number: 30861-27-9
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)C3=C2OC(=CC(=O)C2=C(C=C3O)C)CC(=O)C
• InChI: 1S/C19H22O9/c1-7-3-10(22)14(19-17(26)16(25)15(24)12(6-20)28-19)18-13(7)11(23)5-9(27-18)4-8(2)21/h3,5,12,15-17,19-20,22,24-26H,4,6H2,1-2H3/t12-,15-,16+,17-,19+/m1/s1
• InChIKey: HKIKAXXIWJHWLY-ZIIYPAMZSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 628.0±55.0°C at 760 mmHg (Cal.)
• Flash point: 224.2±25.0°C (Cal.)