Prontoglucal

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Formula C12H18N2O7S
IUPAC Name 4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]amino]benzenesulfonamide
Molecular Mass 334.346 g·mol−1
Heat of Formation -1178.6 ± 16.7 kJ·mol−1
Dipole Moment 6.75 ± 1.08 D
Volume 361.55 Å 3
Surface Area 319.66 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]amino]benzenesulfonamide
  • 4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]benzenesulfonamide
  • 4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]amino]benzenesulfonamide
  • 4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]amino]benzenesulfonamide
  • bo1
InChIKey RMCYKIOWPVOBJX-RMPHRYRLSA-N
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