[(2R,3S,5R)-3-Hydroxy-5-[6-[[(2R,3S)-2,3,4-Trihydroxybutyl]Amino]Purine-1,3,7-Triium-9-Yl]Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C14H22N5O9P |
| IUPAC Name | [(2r,3s,5r)-3-hydroxy-5-[6-[[(2r,3s)-2,3,4-trihydroxybutyl]amino]purine-1,3,7-triium-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 435.326 g·mol−1 |
| Heat of Formation | -1760.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.21 ± 1.08 D |
| Volume | 457.09 Å 3 |
| Surface Area | 396.07 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | -0.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WIRAEJGDDCPPGM-OGBGREFGSA-O |
| QR Code | Generate QR Code |
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| Elements | P C H O N |