Anhydroicaritin 3-(6-O-acetylgalactosyl(1-3)rhamnoside)-7-glucoside
[CAS# 128988-54-5]

Identification

• Name: Anhydroicaritin 3-(6-O-acetylgalactosyl(1-3)rhamnoside)-7-glucoside
• Synonyms: [(2R,3R,4S,5R,6S)-6-[(2S,3R,4R,5S,6S)-3,5-Dihydroxy-2-[5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-4-Oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Chromen-3-Yl]Oxy-6-Methyl-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl]Methyl Acetate; Acetic Acid [(2R,3R,4S,5R,6S)-6-[[(2S,3R,4R,5S,6S)-3,5-Dihydroxy-2-[[5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-4-Oxo-7-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-3-Chromenyl]Oxy]-6-Methyl-4-Tetrahydropyranyl]Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Methyl Ester; Acetic Acid [(2R,3R,4S,5R,6S)-6-[(2S,3R,4R,5S,6S)-3,5-Dihydroxy-2-[5-Hydroxy-4-Keto-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Chromen-3-Yl]Oxy-6-Methyl-Tetrahydropyran-4-Yl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl]Methyl Ester
• Molecular Formula: C₄₁H₅₂O₂₁
• Molecular Weight: 880.85
• CAS Registry Number: 128988-54-5
• SMILES: [C@@H]6(OC2=C(OC1=C(C(=CC(=C1C2=O)O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)CC=C(C)C)C4=CC=C(OC)C=C4)O[C@H]([C@H](O)[C@@H](O[C@@H]5O[C@@H]([C@H](O)[C@H](O)[C@H]5O)COC(=O)C)[C@H]6O)C
• InChI: 1S/C41H52O21/c1-15(2)6-11-20-22(57-39-32(51)30(49)27(46)23(13-42)58-39)12-21(44)25-29(48)38(35(60-36(20)25)18-7-9-19(54-5)10-8-18)62-41-34(53)37(26(45)16(3)56-41)61-40-33(52)31(50)28(47)24(59-40)14-55-17(4)43/h6-10,12,16,23-24,26-28,30-34,37,39-42,44-47,49-53H,11,13-14H2,1-5H3/t16-,23+,24+,26-,27+,28-,30-,31-,32+,33+,34+,37+,39+,40-,41-/m0/s1
• InChIKey: SCGIMZSPRPPEMA-AYTNJEMSSA-N

Properties

• Density: 1.585g/cm³ (Cal.)
• Boiling point: 1104.843°C at 760 mmHg (Cal.)
• Flash point: 330.269°C (Cal.)