Isoquercetin

Molecule SVG Image

Properties Simple | Detailed

Formula C21H20O12
IUPAC Name 2-(3,4-dioxidobenzene-5-id-1-yl)-4-oxo-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromene-5,7-diolate
Molecular Mass 464.376 g·mol−1
Heat of Formation -1872.5 ± 16.7 kJ·mol−1
Dipole Moment 7.29 ± 1.08 D
Volume 489.5 Å 3
Surface Area 397.44 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,4-dihidroxyphenyl)-3-(beta-d-glucofuranosyloxy)-5,7-dihydroxy-4h-1-benzopyran-4-one
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-4-one
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-chromone
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-4-chromenone
  • 3,3',4',5,7-pentahydroxyflavone 3-beta-glucoside
  • 3-glucosylquercetin
  • 4h-1-benzopyran-4-one, 2-(3,4-dihydroxy-phenyl)-3-(.beta.-d-glucofuranosyloxy)-5,7-dihydroxy-
  • 4h-1-benzopyran-4-one, 5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-3-(beta-d-glucopyranosyloxy)-
  • acon1_002134
  • glucosyl 3-quercetin
  • hirsutrin
  • isoquercitrin
  • isotrifoliin
  • pdsp1_001363
  • pdsp2_001347
  • q 5
  • quercetin 3-beta-d-glucoside
  • quercetin 3-beta-glucoside
  • quercetin 3-beta-o-glucoside
  • quercetin 3-d-glucoside
  • quercetin 3-glucoside
  • quercetin 3-monoglucoside
  • quercetin 3-o-.beta.-d-glucopyranoside
  • quercetin 3-o-glucopyranoside
  • quercetin 3-o-glucoside
  • quercetin-3-o-glucopyranoside
  • quercetol 3-glucoside
  • quercetol 3-monoglucoside
CAS Number(s)
  • 21637-25-2
  • 482-35-9
InChIKey OVSQVDMCBVZWGM-QSOFNFLRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O