1-[2-Deoxy-5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-α-D-Erythro-Pentofuranosyl]-5,6-Dihydroxy-5-Methyldihydro-2,4(1H,3H)-Pyrimidinedione
Properties
| Property | Value |
|---|---|
| Formula | C10H19N2O16P3 |
| IUPAC Name | [[(2r,3s,5s)-5-[(5s,6s)-5,6-dihydroxy-5-methyl-2,4-dioxo-hexahydropyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 516.183 g·mol−1 |
| Heat of Formation | -3943.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.44 ± 1.08 D |
| Volume | 487.32 Å 3 |
| Surface Area | 369.6 Å 2 |
| HOMO Energy | -9.72 ± 0.55 eV |
| LUMO Energy | -1.94 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IJWFNGSBJBRLIA-QPGMQRLESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |