3-(β-D-Glucopyranosyl)-6-Pentylfuro[2,3-D]Pyrimidin-2(3H)-One
Properties
| Property | Value |
|---|---|
| Formula | C17H24N2O7 |
| IUPAC Name | 6-pentyl-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-5h-furo[2,3-d]pyrimidin-3-ium-1,5,6-triid-2-one |
| Molecular Mass | 368.382 g·mol−1 |
| Heat of Formation | -1113.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.29 ± 1.08 D |
| Volume | 426.96 Å 3 |
| Surface Area | 378.29 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | -0.94 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OPBPIQMYHFDOAO-XYFZXANASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |