2,6-Anhydro-1-Deoxy-5-O-(6-Deoxyhexopyranosyl)-6-[5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-6-Yl]Hex-3-Ulose

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Properties Simple | Detailed

Formula C27H28O13
IUPAC Name 5,7-dihydroxy-6-[(2r,4r)-4-hydroxy-6-methyl-5-oxo-3-[(2s,4s,5r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
Molecular Mass 560.503 g·mol−1
Heat of Formation 1589.1 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 560.29 Å 3
Surface Area 396.43 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -2.55 ± eV
Point Group Symmetry C1
InChIKey LCQVQAZLYBJMGJ-PNDBJZCDSA-N
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