3,5-Dihydroxy-2-(4-Methoxyphenyl)-8-(3-Methyl-2-Buten-1-Yl)-4-Oxo-4H-Chromen-7-Yl β-D-Threo-Hexopyranoside

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Properties Simple | Detailed

Formula C27H30O11
IUPAC Name 3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 530.520 g·mol−1
Heat of Formation -1752.9 ± 16.7 kJ·mol−1
Dipole Moment 6.45 ± 1.08 D
Volume 597.12 Å 3
Surface Area 473.51 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey IYCPMVXIUPYNHI-RBOMYRCTSA-N
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