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

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Formula C18H31N3O14P2
IUPAC Name [(2r,3r,4s,5s,6r)-4-(dimethylamino)-3,5-dihydroxy-6-methyl-tetrahydropyran-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate
Molecular Mass 575.398 g·mol−1
Heat of Formation -3177.5 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 611.55 Å 3
Surface Area 485.75 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
InChIKey IJJNPDQFXCRKOA-WHRNYZGVSA-N
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