(3R,4S,5R)-5-({[{[(2R,3S,4R,5R)-5-(6-Amino-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methoxy}(Phosphonooxy)Phosphoryl]Oxy}Methyl)-3,4-Dihydroxytetrahydro-2-Furanyl (2R)-2-Amino-3-Sulfanylpropanoate
Properties
| Property | Value |
|---|---|
| Formula | C18H28N6O15P2S |
| IUPAC Name | [(2s,3r,4s,5r)-5-[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-dihydroxyphosphoryloxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl] (2r)-2-amino-3-sulfanyl-propanoate |
| Molecular Mass | 662.459 g·mol−1 |
| Heat of Formation | -3005.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.32 ± 1.08 D |
| Volume | 678.62 Å 3 |
| Surface Area | 550.03 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -1.48 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CUNAFAQOOPCELJ-JNCBEGNDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |