[(2,3-Dihydroxybenzoyl)Amino] [(2R,3S,4R,5R)-3,4-Dihydroxy-5-Purine-1,3,7-Triium-9-Yl-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C17H18N5O10P |
| IUPAC Name | [(2,3-dihydroxybenzoyl)amino] [(2r,3s,4r,5r)-3,4-dihydroxy-5-purine-1,3,7-triium-9-yl-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 483.326 g·mol−1 |
| Heat of Formation | -1570.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.50 ± 1.08 D |
| Volume | 489.94 Å 3 |
| Surface Area | 364.1 Å 2 |
| HOMO Energy | -8.98 ± 0.55 eV |
| LUMO Energy | -1.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LOYUBYPXNVHBGH-LSCFUAHRSA-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 |