(3R,4R,5S,6R)-3,4-Dihydroxy-6-(Hydroxymethyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}Tetrahydro-2H-Pyran-2-One

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Properties Simple | Detailed

Formula C12H20O11
IUPAC Name (3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-one
Molecular Mass 340.281 g·mol−1
Heat of Formation -1999.3 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 363.45 Å 3
Surface Area 307.81 Å 2
HOMO Energy -10.69 ± 0.55 eV
LUMO Energy 0.36 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-one
  • (3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-one
  • (3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-one
  • (3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-tetrahydropyranone
  • (3r,4r,5s,6r)-3,4-dihydroxy-6-methylol-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-one
  • 4-o-beta-d-glucopyranosyl-d-gluconic acid delta-lactone
  • cellobiono-1,5-lactone
  • cellobionolactone
  • cellobiose-1,5-lactone
  • d-gluconic acid, 4-o-beta-d-glucopyranosyl-, delta-lactone
InChIKey FSICMNGKCHFHGP-ZNLUKOTNSA-N
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