[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3S,4S)-5-[(3R)-6,7-Dimethyl-2,2',5'-Trioxo-Spiro[4H-Quinoxaline-3,4'-Imidazolidine]-1-Yl]-2,3,4-Trihydroxy-Pentyl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C27H37N9O16P2 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4s)-5-[(3r)-6,7-dimethyl-2,2',5'-trioxo-spiro[4h-quinoxaline-3,4'-imidazolidine]-1-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate |
| Molecular Mass | 805.581 g·mol−1 |
| Heat of Formation | -3112.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.22 ± 1.08 D |
| Volume | 834.28 Å 3 |
| Surface Area | 668.24 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | -1.29 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QZHMDQWJJUDIBE-QUWWARRSSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |