4,6-Dideoxy-4-{[(1S,2S,3S,4R,5R)-2,3,4-Trihydroxy-5-(Hydroxymethyl)Cyclohexyl]Amino}-α-D-Glucopyranosyl-(1->4)-α-D-Glucopyranosyl-(1->4)-α-D-Glucopyranose

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Formula C25H45NO18
IUPAC Name (2s,3r,4r,5s,6r)-5-[(2r,3r,4r,5s,6r)-5-[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-[[(1s,2s,3s,4r,5r)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino]tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-2,3,4-triol
Molecular Mass 647.621 g·mol−1
Heat of Formation -3492.5 ± 16.7 kJ·mol−1
Dipole Moment 7.31 ± 1.08 D
Volume 720.62 Å 3
Surface Area 539.43 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 0.71 ± eV
Point Group Symmetry C1
Synonyms
  • -
  • b
  • d
  • h
  • o
  • s
  • y
InChIKey CUAQESWNTOXZJZ-RTNAABQMSA-N
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