{(2R,3S,4R,5R)-5-[5-(5-Formyl-2-Thienyl)-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl]-3,4-Dihydroxytetrahydro-2-Furanyl}Methyl (2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl Dihydrogen Diphosphate
Properties
| Property | Value |
|---|---|
| Formula | C20H26N2O18P2S |
| IUPAC Name | [[(2r,3s,4r,5r)-5-[5-(5-formyl-2-thienyl)-2,4-dioxo-pyrimidin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] hydrogen phosphate |
| Molecular Mass | 676.436 g·mol−1 |
| Heat of Formation | -3706.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.15 ± 1.08 D |
| Volume | 670.29 Å 3 |
| Surface Area | 519.68 Å 2 |
| HOMO Energy | -9.44 ± 0.55 eV |
| LUMO Energy | -1.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KKHANSZRQMPJKN-PCGMDOMSSA-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 |