5'-O-[(R)-{[(R)-{[(1S,3R,4R,5S)-3,4-Dihydroxy-5-Methylcyclohexyl]Oxy}(Hydroxy)Phosphoryl]Oxy}(Hydroxy)Phosphoryl]Thymidine
Properties
| Property | Value |
|---|---|
| Formula | C17H28N2O13P2 |
| IUPAC Name | [[(1s,3r,4r,5s)-3,4-dihydroxy-5-methyl-cyclohexoxy]-hydroxy-phosphoryl] [(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 530.357 g·mol−1 |
| Heat of Formation | -3100.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.02 ± 1.08 D |
| Volume | 549.52 Å 3 |
| Surface Area | 420.21 Å 2 |
| HOMO Energy | -9.75 ± 0.55 eV |
| LUMO Energy | -1.37 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CWVOKCJHBPKJQP-PVMIAKCWSA-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 |