6-Amino-9-[(2R,3R,4R,5R)-4-Hydroxy-5-({[(S)-Hydroxy{[(R)-Hydroxy{[(2R,3S,4R,5R)-3,4,5-Trihydroxytetrahydro-2-Furanyl]Methoxy}Phosphoryl]Oxy}Phosphoryl]Oxy}Methyl)-3-(Phosphonooxy)Tetrahydro-2-Furanyl]-7H-Purin-9-Ium
Properties
| Property | Value |
|---|---|
| Formula | C15H25N5O17P3+ |
| IUPAC Name | [[(2r,3r,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-4-dihydroxyphosphoryloxy-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 640.304 g·mol−1 |
| Heat of Formation | -1891.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.24 ± 1.08 D |
| Volume | 559.02 Å 3 |
| Surface Area | 494.28 Å 2 |
| HOMO Energy | -9.66 ± 0.55 eV |
| LUMO Energy | 0.17 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FWTHMAZNNLXFAH-ZQSHOCFMSA-O |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C O N |