(1S)-1-[(7R)-4-Amino-7H-Pyrrolo[3,2-D]Pyrimidin-7-Yl]-1,4-Anhydro-5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-D-Ribitol
Properties
| Property | Value |
|---|---|
| Formula | C11H17N4O13P3 |
| IUPAC Name | [[(2r,3s,4r,5s)-5-[(7s)-4-amino-7h-pyrrolo[3,2-d]pyrimidin-7-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 506.193 g·mol−1 |
| Heat of Formation | -3028.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.84 ± 1.08 D |
| Volume | 478.41 Å 3 |
| Surface Area | 355.3 Å 2 |
| HOMO Energy | -8.65 ± 0.55 eV |
| LUMO Energy | -1.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MXSLUFGKBYJNGX-WQJMHRRTSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |