5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-3-Yl 2-O-(6-Deoxy-β-D-Allopyranosyl)-Alpha-L-Lyxofuranoside

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Properties Simple | Detailed

Formula C26H8O14
IUPAC Name 5,7-dihydroxy-3-[(2s,3r,4r,5s)-4-hydroxy-5-(hydroxymethyl)-3-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxolan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
Molecular Mass 544.333 g·mol−1
Heat of Formation 551.8 ± 16.7 kJ·mol−1
Dipole Moment 5.50 ± 1.08 D
Volume 522.1 Å 3
Surface Area 433.3 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -2.58 ± eV
Point Group Symmetry C1
Synonyms
  • 5,7-dihydroxy-3-[(2s,3r,4r,5s)-4-hydroxy-5-(hydroxymethyl)-3-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxolan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
  • 5,7-dihydroxy-3-[(2s,3r,4r,5s)-4-hydroxy-5-(hydroxymethyl)-3-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydrofuran-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
  • 5,7-dihydroxy-3-[(2s,3r,4r,5s)-4-hydroxy-5-methylol-3-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydrofuran-2-yl]oxy-2-(4-hydroxyphenyl)chromone
  • 5,7-dihydroxy-3-[[(2s,3r,4r,5s)-4-hydroxy-5-(hydroxymethyl)-3-[[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydrofuranyl]oxy]-2-(4-hydroxyphenyl)-4-chromenone
InChIKey NRVLSEXRPWZCQQ-FAYVFZJUSA-N
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