N-(3-Carboxy-4-Hydroxyphenyl)-D-Glucopyranosylamine

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Formula C13H17NO8
IUPAC Name 2-hydroxy-5-[[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]amino]benzoic acid
Molecular Mass 315.276 g·mol−1
Heat of Formation -1400.0 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 338.42 Å 3
Surface Area 293.48 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
InChIKey SJRWBGQWNUAGPK-LDMBFOFVSA-N
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