[4-[4,5-Dihydroxy-6-Methyl-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-5-Hydroxy-2-(Hydroxymethyl)Oxan-3-Yl] (E)-3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoate
[CAS# 137578-58-6]

Identification

• Name: [4-[4,5-Dihydroxy-6-Methyl-3-(3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-5-Hydroxy-2-(Hydroxymethyl)Oxan-3-Yl] (E)-3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoate
• Synonyms: [4-[4,5-Dihydroxy-6-Methyl-3-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-5-Hydroxy-2-(Hydroxymethyl)Tetrahydropyran-3-Yl] (E)-3-(4-Hydroxy-3-Methoxy-Phenyl)Prop-2-Enoate; (E)-3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoic Acid [4-[[4,5-Dihydroxy-6-Methyl-3-[(3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxy]-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-5-Hydroxy-2-(Hydroxymethyl)-3-Tetrahydropyranyl] Ester; (E)-3-(4-Hydroxy-3-Methoxy-Phenyl)Acrylic Acid [4-[4,5-Dihydroxy-6-Methyl-3-(3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-5-Hydroxy-2-Methylol-Tetrahydropyran-3-Yl] Ester
• Molecular Formula: C₃₆H₄₈O₁₉
• Molecular Weight: 784.76
• CAS Registry Number: 137578-58-6
• SMILES: C5=C(/C=C/C(OC3C(OC1OC(C(O)C(O)C1OC2OC(C(O)C(O)C2O)C)C)C(O)C(OC3CO)OCCC4=CC(=C(O)C=C4)O)=O)C=CC(=C5OC)O
• InChI: 1S/C36H48O19/c1-15-25(42)27(44)29(46)35(50-15)55-33-28(45)26(43)16(2)51-36(33)54-32-30(47)34(49-11-10-18-4-7-19(38)21(40)12-18)52-23(14-37)31(32)53-24(41)9-6-17-5-8-20(39)22(13-17)48-3/h4-9,12-13,15-16,23,25-40,42-47H,10-11,14H2,1-3H3/b9-6+
• InChIKey: VJZBGZNQVVWWSO-RMKNXTFCSA-N

Properties

• Density: 1.57g/cm³ (Cal.)
• Boiling point: 1004.288°C at 760 mmHg (Cal.)
• Flash point: 307.813°C (Cal.)