2,2-Dimethylpropyl (2S)-2-[[[(2R,3R,4R,5R)-5-(2-Amino-6-Methoxy-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-4-Methyl-Tetrahydrofuran-2-Yl]Methoxy-(1-Naphthyloxy)Phosphoryl]Amino]Propanoate
Properties
| Property | Value |
|---|---|
| Formula | C30H39N6O9P |
| IUPAC Name | 2,2-dimethylpropyl (2s)-2-[[[(2r,3r,4r,5r)-5-(2-amino-6-methoxy-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-4-methyl-tetrahydrofuran-2-yl]methoxy-(1-naphthyloxy)phosphoryl]amino]propanoate |
| Molecular Mass | 658.639 g·mol−1 |
| Heat of Formation | -1604.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.60 ± 1.08 D |
| Volume | 753.27 Å 3 |
| Surface Area | 492.35 Å 2 |
| HOMO Energy | -8.19 ± 0.55 eV |
| LUMO Energy | 3.63 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JMECKKAUFFKEKL-MWPHEXKPSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |