7-Hydroxy-2-(4-Hydroxyphenyl)-4-Oxo-4H-Chromen-5-Yl 4-O-(6-Deoxy-β-D-Gulopyranosyl)-β-D-Allopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C27H30O14
IUPAC Name 5-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-7-hydroxy-2-(4-hydroxyphenyl)chromen-4-one
Molecular Mass 578.519 g·mol−1
Heat of Formation -2297.2 ± 16.7 kJ·mol−1
Dipole Moment 4.06 ± 1.08 D
Volume 626.8 Å 3
Surface Area 511.06 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • 4h-1-benzopyran-4-one, 5-((4-o-(6-deoxy-alpha-l-mannopyranosyl)-beta-d-glucopyranosyl)oxy)-7-hydroxy-2-(4-hydroxyphenyl)-
  • 5-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]oxy-7-hydroxy-2-(4-hydroxyphenyl)chromen-4-one
  • 5-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-7-hydroxy-2-(4-hydroxyphenyl)chromen-4-one
  • 5-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-methylol-5-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-7-hydroxy-2-(4-hydroxyphenyl)chromone
  • 5-[[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-7-hydroxy-2-(4-hydroxyphenyl)-4-chromenone
  • camellianin b
  • camellin
CAS Number(s)
  • 109232-76-0
InChIKey LRFDUPNLCDXZOE-ZLDQKHMLSA-N
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