Methyl 6-Deoxy-6-[(2R,3R,4R,5S)-3,4,5-Trihydroxy-2-(Hydroxymethyl)-1-Piperidinyl]-α-D-Glucopyranoside

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Formula C13H25NO9
IUPAC Name (1s,2r,3r,4r,5s)-2-(hydroxymethyl)-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl]methyl]piperidine-3,4,5-triol
Molecular Mass 339.339 g·mol−1
Heat of Formation -1691.4 ± 16.7 kJ·mol−1
Dipole Moment 5.48 ± 1.08 D
Volume 386.71 Å 3
Surface Area 319.66 Å 2
HOMO Energy -10.00 ± 0.55 eV
LUMO Energy 0.75 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r,5s)-2-(hydroxymethyl)-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxy-2-tetrahydropyranyl]methyl]piperidine-3,4,5-triol
  • (2r,3r,4r,5s)-2-(hydroxymethyl)-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxy-oxan-2-yl]methyl]piperidine-3,4,5-triol
  • (2r,3r,4r,5s)-2-(hydroxymethyl)-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl]methyl]piperidine-3,4,5-triol
  • (2r,3r,4r,5s)-2-(hydroxymethyl)-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl]piperidine-3,4,5-triol
  • (2r,3r,4r,5s)-2-methylol-1-[[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl]methyl]piperidine-3,4,5-triol
InChIKey UEZIBPZHJNOZNX-CDTKKYFSSA-N
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