(2S,3S,4S,5R,6R)-6-[[[(2R,3S,4R,5R)-5-(5-Azido-2,4-Dioxo-Pyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid

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Formula C15H22N5O18P2
IUPAC Name (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 622.305 g·mol−1
Heat of Formation -3558.7 ± 16.7 kJ·mol−1
Dipole Moment 5.67 ± 1.08 D
Volume 590.34 Å 3
Surface Area 419.02 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -1.72 ± eV
Point Group Symmetry C1
InChIKey QNGMPZDRBDQJKR-DDOVFHLRSA-P
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