(2R,3R,4S)-3-Acetamido-2-[(1R,2R)-3-[(4-Azido-2-Hydroxy-Benzoyl)Amino]-1,2-Dihydroxy-Propyl]-4-Hydroxy-3,4-Dihydro-2H-Pyran-6-Carboxylic Acid

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Formula C18H21N5O9
IUPAC Name (2r,3r,4s)-3-acetamido-2-[(1r,2r)-3-[(4-azido-2-hydroxy-benzoyl)amino]-1,2-dihydroxy-propyl]-4-hydroxy-3,4-dihydro-2h-pyran-6-carboxylic acid
Molecular Mass 451.387 g·mol−1
Heat of Formation -1235.4 ± 16.7 kJ·mol−1
Dipole Moment 8.37 ± 1.08 D
Volume 497.42 Å 3
Surface Area 428.06 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy -1.26 ± eV
Point Group Symmetry C1
InChIKey DLZGIWFWVJOGIZ-OVJXPFRRSA-N
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