4',7-Dihydroxy-6-Methoxyisoflavone-7-D-Glucoside

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Properties Simple | Detailed

Formula C22H22O10
IUPAC Name 3-(4-hydroxyphenyl)-6-methoxy-7-[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 446.404 g·mol−1
Heat of Formation -1446.2 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 490.01 Å 3
Surface Area 416.49 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
InChIKey OZBAVEKZGSOMOJ-ICGSVKGVSA-N
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Elements H C O