4-Methyl-2-Oxo-2H-Chromen-7-Yl 2-Acetamido-2-Deoxy-α-L-Glucopyranosyl-(1->4)-2-Acetamido-2-Deoxy-α-L-Idopyranosyl-(1->4)-2-Acetamido-2-Deoxy-α-L-Idopyranoside

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Formula C34H48N3O18+
IUPAC Name n-[(2s,3r,4r,5s,6r)-2-[(2r,3s,4r,5r,6s)-5-acetamido-6-[(2r,3s,4r,5r,6r)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-methyl-2-oxo-chromen-7-yl)oxy-tetrahydropyran-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 786.754 g·mol−1
Heat of Formation -3227.8 ± 16.7 kJ·mol−1
Dipole Moment 7.62 ± 1.08 D
Volume 881.25 Å 3
Surface Area 686.3 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -1.22 ± eV
Point Group Symmetry C1
InChIKey BNYGKUQXGBVTRE-ITRNKESMSA-O
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