(1S)-1,5-Anhydro-1-[5-Hydroxy-2-(4-Hydroxyphenyl)-7-Oxido-4-Oxo-4H-Chromen-6-Yl]-D-Glucitol

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Formula C21H19O10-
IUPAC Name 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]chromen-7-olate
Molecular Mass 431.370 g·mol−1
Heat of Formation 912.7 ± 16.7 kJ·mol−1
Dipole Moment 1.99 ± 1.08 D
Volume 406.36 Å 3
Surface Area 362.52 Å 2
HOMO Energy -10.12 ± 0.55 eV
LUMO Energy -3.48 ± eV
Point Group Symmetry C1
InChIKey MYXNWGACZJSMBT-VJXVFPJBSA-M
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Elements C O