(1S)-2,3,6-Tri-O-Acetyl-1,5-Anhydro-1-Sulfamoyl-4-O-(2,3,4,6-Tetra-O-Acetyl-β-D-Galactopyranosyl)-D-Glucitol

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Formula C26H37NO19S
IUPAC Name [(2r,3s,4s,5r,6s)-3,4,5-triacetoxy-6-[(2r,3r,4s,5r,6s)-4,5-diacetoxy-2-(acetoxymethyl)-6-sulfamoyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-2-yl]methyl acetate
Molecular Mass 699.632 g·mol−1
Heat of Formation -3503.7 ± 16.7 kJ·mol−1
Dipole Moment 4.93 ± 1.08 D
Volume 779.4 Å 3
Surface Area 568.37 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy 0.46 ± eV
Point Group Symmetry C1
InChIKey PRBMNHXZLHBQIF-NDMRNNIMSA-N
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