3-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R)-3,4-Dihydroxy-4-(Hydroxymethyl)Oxolan-2-Yl]Oxy-4,5-Dihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-5,7-Dihydroxy-2-(4-Hydroxyphenyl)Chromen-4-One
[CAS# 132294-84-9]

Identification

• Name: 3-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R)-3,4-Dihydroxy-4-(Hydroxymethyl)Oxolan-2-Yl]Oxy-4,5-Dihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-5,7-Dihydroxy-2-(4-Hydroxyphenyl)Chromen-4-One
• Synonyms: 3-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R)-3,4-Dihydroxy-4-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Oxy-4,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-5,7-Dihydroxy-2-(4-Hydroxyphenyl)Chromen-4-One; 3-[[(2S,3R,4S,5R,6R)-3-[[(2S,3R,4R)-3,4-Dihydroxy-4-(Hydroxymethyl)-2-Tetrahydrofuranyl]Oxy]-4,5-Dihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Chromenone; 3-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4R)-3,4-Dihydroxy-4-Methylol-Tetrahydrofuran-2-Yl]Oxy-4,5-Dihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-5,7-Dihydroxy-2-(4-Hydroxyphenyl)Chromone
• Molecular Formula: C₂₆H₂₈O₁₅
• Molecular Weight: 580.50
• CAS Registry Number: 132294-84-9
• SMILES: [C@@H]4([C@H](OC2=C(OC1=CC(=CC(=C1C2=O)O)O)C3=CC=C(O)C=C3)O[C@@H]([C@H](O)[C@@H]4O)CO)O[C@H]5[C@@H]([C@@](O)(CO)CO5)O
• InChI: 1S/C26H28O15/c27-7-15-17(32)19(34)22(41-25-23(35)26(36,8-28)9-37-25)24(39-15)40-21-18(33)16-13(31)5-12(30)6-14(16)38-20(21)10-1-3-11(29)4-2-10/h1-6,15,17,19,22-25,27-32,34-36H,7-9H2/t15-,17+,19+,22-,23+,24+,25+,26-/m1/s1
• InChIKey: MNBRHJWOHPGQIW-QLAXZGQUSA-N

Properties

• Density: 1.814g/cm³ (Cal.)
• Boiling point: 972.384°C at 760 mmHg (Cal.)
• Flash point: 325.591°C (Cal.)