2-(3,4-Dihydroxyphenyl)-5-Hydroxy-6-Methoxy-4-Oxo-4H-Chromen-7-Yl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C22H23O12+
IUPAC Name 2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-7-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 479.411 g·mol−1
Heat of Formation -1845.2 ± 16.7 kJ·mol−1
Dipole Moment 7.78 ± 1.08 D
Volume 508.25 Å 3
Surface Area 427.41 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey DMXHXBGUNHLMQO-DDXGHMLGSA-O
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