(2R,3R,4S,5S,6R)-3,5-Dihydroxy-4-[(E)-({3-Hydroxy-2-Methyl-5-[(Phosphonooxy)Methyl]-4-Pyridinyl}Methylene)Amino]-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
Properties
| Property | Value |
|---|---|
| Formula | C24H35N4O19P3 |
| IUPAC Name | [(2r,3r,4s,5s,6r)-3,5-dihydroxy-4-[(e)-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methyleneamino]-6-methyl-tetrahydropyran-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-ium-5-id-1-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate |
| Molecular Mass | 776.471 g·mol−1 |
| Heat of Formation | -4235.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.53 ± 1.08 D |
| Volume | 802.13 Å 3 |
| Surface Area | 649.67 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | -1.66 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UJDWKFAFGYHSFM-HMSDFHDVSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |