(2R,3R,4S,5S,6R)-3-Acetamido-5-Amino-4-Hydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl [(2R,3S,4R,5R)-5-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl Dihydrogen Diphosphate

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Formula C17H28N4O15P2
IUPAC Name [(2r,3r,4s,5s,6r)-3-acetamido-5-amino-4-hydroxy-6-methyl-tetrahydropyran-2-yl] [[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate
Molecular Mass 590.370 g·mol−1
Heat of Formation -3336.8 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 603.13 Å 3
Surface Area 468.16 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
InChIKey FUUMLYWEEZBCQR-UINYWEPJSA-N
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