5'-O-[(S)-{[(2R)-2-Amino-6-{[(2-Propyn-1-Yloxy)Carbonyl]Amino}Hexanoyl]Oxy}(Hydroxy)Phosphoryl]Adenosine
Properties
| Property | Value |
|---|---|
| Formula | C20H28N7O10P |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] (2r)-2-amino-6-(prop-2-ynoxycarbonylamino)hexanoate |
| Molecular Mass | 557.451 g·mol−1 |
| Heat of Formation | -1635.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.54 ± 1.08 D |
| Volume | 555.92 Å 3 |
| Surface Area | 514.06 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -0.75 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BXXVGWFYYCXKTG-AJKMGBEJSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |