(5R,6R,7R,8S)-7,8-Dihydroxy-5-(Hydroxymethyl)-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyridin-6-Yl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C14H22N2O9
IUPAC Name (2r,3r,4s,5s,6r)-2-[[(5r,6r,7r,8s)-7,8-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 362.332 g·mol−1
Heat of Formation -1500.5 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 400.06 Å 3
Surface Area 335.3 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6r)-2-[[(5r,6r,7r,8s)-7,8-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[2,1-f]pyridin-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(5r,6r,7r,8s)-7,8-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[2,1-f]pyridin-6-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-[[(5r,6r,7r,8s)-7,8-dihydroxy-5-methylol-5,6,7,8-tetrahydroimidazo[2,1-f]pyridin-6-yl]oxy]-6-methylol-tetrahydropyran-3,4,5-triol
  • 5-hydroxymethyl-5,6,7,8-tetrahydro-imidazo[1,2-a]pyridin-6yl-7,8-diol-glucopyranoside
  • imidazole-derived cellobiose
InChIKey CSXOUJBOYXGFCL-OFKZETBZSA-N
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