(2R,3R,4R,5R)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-Oxo-3-Piperidinyl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C12H21NO10
IUPAC Name (3r,4r,5r,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-piperidin-2-one
Molecular Mass 339.296 g·mol−1
Heat of Formation -1835.7 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 370.57 Å 3
Surface Area 314.22 Å 2
HOMO Energy -10.18 ± 0.55 eV
LUMO Energy 3.61 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r,5r,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-piperidin-2-one
  • (3r,4r,5r,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypiperidin-2-one
  • (3r,4r,5r,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-piperidin-2-one
  • (3r,4r,5r,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-piperidinone
  • (3r,4r,5r,6r)-3,4-dihydroxy-6-methylol-5-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-2-piperidone
InChIKey WXSNJJDPPISYEF-ZNLUKOTNSA-N
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