4-Methyl-2-Oxo-2H-Chromen-7-Yl 4-O-β-D-Galactopyranosyl-β-D-Glucopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C22H28O13
IUPAC Name hepta-1,3,6-triyne-1,7-diol; 6-(oxomethylene)-5-[3,4,5-trioxo-6-(oxomethylene)tetrahydropyran-2-yl]oxy-tetrahydropyran-2,3,4-trione
Molecular Mass 500.450 g·mol−1
Heat of Formation -2196.3 ± 16.7 kJ·mol−1
Dipole Moment 5.97 ± 1.08 D
Volume 543.59 Å 3
Surface Area 447.75 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methylumbelliferyl beta-d-lactopyranoside
  • 4-methylumbelliferyl beta-d-lactoside
  • 7-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-4-methyl-chromen-2-one
  • 7-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-methylchromen-2-one
  • 7-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4-methyl-chromen-2-one
  • 7-[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-methylol-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4-methyl-coumarin
  • 7-[[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranyl]oxy]-4-methyl-2-chromenone
InChIKey PRTGXBPFDYMIJH-KSFLKEQHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O