[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3R,4R,5R,6S)-6-[(1R)-1,2-Dihydroxyethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C17H29N5O16P2 |
| 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,3r,4r,5r,6s)-6-[(1r)-1,2-dihydroxyethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl] hydrogen phosphate |
| Molecular Mass | 621.384 g·mol−1 |
| Heat of Formation | -3272.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.98 ± 1.08 D |
| Volume | 618.69 Å 3 |
| Surface Area | 509.53 Å 2 |
| HOMO Energy | -9.33 ± 0.55 eV |
| LUMO Energy | -1.82 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QANVIAQOILNJER-GZNZTODLSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |