(5Xi)-4-Deoxy-4-{[(1S,4R,5S,6S)-4,5,6-Trihydroxy-3-(Hydroxymethyl)-2-Cyclohexen-1-Yl]Amino}-β-D-Xylo-Hexopyranosyl-(1->4)-Alpha-D-Glucopyranosyl-(1->4)-D-Glucose

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Formula C25H43NO19
IUPAC Name (2r,3r,4r,5r)-3-[(2s,3r,4r,5s,6r)-5-[(2s,3r,4s,5s,6r)-3,4-dioxido-6-(oxidomethyl)-5-[[(1s,4r,5s,6s)-4,5,6-trioxido-3-(oxidomethyl)cyclohex-2-en-1-yl]amino]tetrahydropyran-2-yl]oxy-3,4-dioxido-6-(oxidomethyl)tetrahydropyran-2-id-2-yl]oxy-6-oxo-hexane-1,2,4,5-tetrolate
Molecular Mass 661.604 g·mol−1
Heat of Formation -3505.8 ± 16.7 kJ·mol−1
Dipole Moment 5.38 ± 1.08 D
Volume 720.27 Å 3
Surface Area 542.46 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
InChIKey SWCIZDWVIVXZIC-DFURHSRTSA-N
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