3-[(6-Deoxy-α-L-Mannopyranosyl)Oxy]-5-Hydroxy-2-(4-Hydroxyphenyl)-8-(3-Methyl-2-Buten-1-Yl)-4-Oxo-4H-Chromen-7-Yl Beta-D-Glucopyranoside

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Properties Simple | Detailed

Formula C32H38O15
IUPAC Name 5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3-[(2s,3s,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 662.635 g·mol−1
Heat of Formation -2504.7 ± 16.7 kJ·mol−1
Dipole Moment 9.06 ± 1.08 D
Volume 727.95 Å 3
Surface Area 551.53 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
InChIKey OGYXOOJUJQIDOX-WJLMMPLCSA-N
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