N-(Benzoylcarbamoyl)-β-D-Glucopyranosylamine

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Formula C14H18N2O7
IUPAC Name n-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]carbamoyl]benzamide
Molecular Mass 326.302 g·mol−1
Heat of Formation -1161.8 ± 16.7 kJ·mol−1
Dipole Moment 7.96 ± 1.08 D
Volume 365.15 Å 3
Surface Area 332.82 Å 2
HOMO Energy -10.36 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • bzd
  • n-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]carbamoyl]benzamide
  • n-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]carbamoyl]benzamide
  • n-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]carbamoyl]benzamide
  • n-[oxo-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]amino]methyl]benzamide
  • n-benzoyl-n'-beta-d-glucopyranosyl urea
InChIKey JSBCZGSPFATCOV-BZNQNGANSA-N
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