3-[3,5-Dihydroxy-6-Methyl-4-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxyoxan-2-Yl]Oxy-5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-One
[CAS# 137218-02-1]

Identification

• Name: 3-[3,5-Dihydroxy-6-Methyl-4-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxyoxan-2-Yl]Oxy-5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxychromen-4-One
• Synonyms: 3-[3,5-Dihydroxy-6-Methyl-4-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Chromen-4-One; 3-[[3,5-Dihydroxy-6-Methyl-4-[(3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxy]-5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-4-Chromenone; 3-[3,5-Dihydroxy-6-Methyl-4-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-2-(4-Methoxyphenyl)-8-(3-Methylbut-2-Enyl)-7-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-Chromone
• Molecular Formula: C₃₉H₅₀O₁₉
• Molecular Weight: 822.81
• CAS Registry Number: 137218-02-1
• SMILES: C5=C(C1=C(OC(=C(C1=O)OC3C(C(OC2C(C(O)C(C(O2)C)O)O)C(C(O3)C)O)O)C4=CC=C(C=C4)OC)C(=C5OC6C(C(O)C(C(O6)CO)O)O)CC=C(C)C)O
• InChI: 1S/C39H50O19/c1-14(2)6-11-19-21(54-38-31(49)29(47)26(44)22(13-40)55-38)12-20(41)23-27(45)36(33(56-34(19)23)17-7-9-18(51-5)10-8-17)58-39-32(50)35(25(43)16(4)53-39)57-37-30(48)28(46)24(42)15(3)52-37/h6-10,12,15-16,22,24-26,28-32,35,37-44,46-50H,11,13H2,1-5H3
• InChIKey: LMZZWQKHDOVICB-UHFFFAOYSA-N

Properties

• Density: 1.578g/cm³ (Cal.)
• Boiling point: 1074.274°C at 760 mmHg (Cal.)
• Flash point: 326.038°C (Cal.)