2-Amino-9-{(4Xi)-5-O-[{[6-(Carboxymethyl)-3,5-Dimethyl-2-Oxo-1,2-Dihydro-4-Pyridinyl]Oxy}(Hydroxy)Phosphoryl]-D-Erythro-Pentofuranosyl}-1,9-Dihydro-6H-Purin-6-One
Properties
| Property | Value |
|---|---|
| Formula | C19H23N6O11P |
| IUPAC Name | 2-[4-[[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-3,5-dimethyl-6-oxo-1h-pyridin-2-yl]acetic acid |
| Molecular Mass | 542.393 g·mol−1 |
| Heat of Formation | -2020.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 15.61 ± 1.08 D |
| Volume | 559.61 Å 3 |
| Surface Area | 397.44 Å 2 |
| HOMO Energy | -8.81 ± 0.55 eV |
| LUMO Energy | -1.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GTHOTKPHMGEHFD-ACDAHVMNSA-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 |