(2R,3S,4S,5S,6R)-5-Acetamido-3,4-Dihydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl [(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-1,6-Dihydro-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl Dihydrogen Diphosphate (Non-Preferred Name)
Properties
| Property | Value |
|---|---|
| Formula | C18H28N6O15P2 |
| IUPAC Name | [(2r,3s,4s,5s,6r)-5-acetamido-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl] [[(2r,3s,4r,5s)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate |
| Molecular Mass | 630.394 g·mol−1 |
| Heat of Formation | -1324.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.71 ± 1.08 D |
| Volume | 577.71 Å 3 |
| Surface Area | 456.86 Å 2 |
| HOMO Energy | -9.06 ± 0.55 eV |
| LUMO Energy | -2.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QYYLCPNKZRMSFL-XEDXKBCUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C O N |