4-[Butyl(Nitroso)Amino]Butyl β-D-Glucopyranosiduronic Acid

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Formula C14H26N2O8
IUPAC Name (2s,3s,4r,5s,6s)-6-[4-[butyl(nitroso)amino]butoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 350.365 g·mol−1
Heat of Formation -1413.1 ± 16.7 kJ·mol−1
Dipole Moment 8.40 ± 1.08 D
Volume 411.51 Å 3
Surface Area 334.1 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy 3.08 ± eV
Point Group Symmetry C1
InChIKey VVDUKXBGFTUMPJ-FGPLHTHASA-N
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