5-Hydroxy-6-Methoxy-2-(4-Methoxyphenyl)-4-Oxo-4H-Chromen-7-Yl 6-O-Acetyl-β-D-Threo-Hexopyranoside

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Properties Simple | Detailed

Formula C25H26O12
IUPAC Name [(3s,4s,6s)-3,4,5-trihydroxy-6-[5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-chromen-7-yl]oxy-tetrahydropyran-2-yl]methyl acetate
Molecular Mass 518.467 g·mol−1
Heat of Formation 3182.7 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 619.95 Å 3
Surface Area 499.69 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -3.77 ± eV
Point Group Symmetry C1
InChIKey FHBWUJAADRENKL-FZBWBFFVSA-N
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Elements C O