N-(2-{[5-(5-Chloro-2-Thienyl)-1,2-Oxazol-3-Yl]Methoxy}-6-{3-[(2,3,4,6-Tetra-O-Acetyl-β-D-Glucopyranosyl)Oxy]Propoxy}Phenyl)-1-Isopropyl-4-Piperidinecarboxamide

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Properties Simple | Detailed

Formula C40H50ClN3O14S
IUPAC Name [(2r,3r,4s,5r,6r)-3,4,5-triacetoxy-6-[3-[3-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methoxy]-2-[(1-isopropylpiperidine-4-carbonyl)amino]phenoxy]propoxy]tetrahydropyran-2-yl]methyl acetate
Molecular Mass 864.355 g·mol−1
Heat of Formation -2170.1 ± 16.7 kJ·mol−1
Dipole Moment 2.96 ± 1.08 D
Volume 992.16 Å 3
Surface Area 773.26 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry C1
InChIKey GNVQZTIXGHEXLF-NIURAOKHSA-N
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