(5Xi)-1-O-{2-[(2,3-Dimethylphenyl)Amino]Benzoyl}-β-L-Lyxo-Hexopyranuronic Acid

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Formula C21H23NO8
IUPAC Name (2s,3s,4s,5r,6r)-6-[2-(2,3-dimethylanilino)benzoyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 417.409 g·mol−1
Heat of Formation -1315.5 ± 16.7 kJ·mol−1
Dipole Moment 5.45 ± 1.08 D
Volume 467.11 Å 3
Surface Area 379.48 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
InChIKey DAHIGOGKMFBIOR-DKLJTFSYSA-N
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