(2R,3R,3Ar,5R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-5-[(1S)-2-(2,2-Dimethylpropanoyloxymethoxy)-1-Hydroxy-2-Oxo-Ethyl]-3-Hydroxy-3,3A-Dihydro-2H-Furo[3,2-B]Furan-5-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H23N5O10 |
| IUPAC Name | (2r,3r,3ar,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-5-[(1s)-2-(2,2-dimethylpropanoyloxymethoxy)-1-hydroxy-2-oxo-ethyl]-3-hydroxy-3,3a-dihydro-2h-furo[3,2-b]furan-5-carboxylic acid |
| Molecular Mass | 493.424 g·mol−1 |
| Heat of Formation | -1408.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.03 ± 1.08 D |
| Volume | 529.72 Å 3 |
| Surface Area | 375.72 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | -0.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VDZDXTDKEHZSTQ-LUZCYJSKSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |