(1S)-1,5-Anhydro-1-([(2S,3S,4R,5R)-5-(5-Fluoro-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Methyl)-D-Glucitol
Properties
Property | Value |
---|---|
Formula | C15H23FN2O17P2 |
IUPAC Name | [(s)-[(2s,3s,4r,5r)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]methyl] phosphono hydrogen phosphate |
Molecular Mass | 584.292 g·mol−1 |
Heat of Formation | -3848.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.26 ± 1.08 D |
Volume | 556.02 Å 3 |
Surface Area | 418.16 Å 2 |
HOMO Energy | -9.61 ± 0.55 eV |
LUMO Energy | -1.75 ± eV |
Point Group Symmetry | C1 |
InChIKey | UPRBTCOBJAWDAG-KHUSBBKHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N P |