4-Methyl-2-Oxo-2H-Chromen-7-Yl 2-Acetamido-2-Deoxy-6-O-Sulfohexopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C18H21NO11S |
| IUPAC Name | [(2r,3s,4r,5r,6r)-5-acetamido-3,4-dihydroxy-6-(4-methyl-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl hydrogen sulfate |
| Molecular Mass | 459.424 g·mol−1 |
| Heat of Formation | -1835.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.13 ± 1.08 D |
| Volume | 489.23 Å 3 |
| Surface Area | 414.38 Å 2 |
| HOMO Energy | -9.57 ± 0.55 eV |
| LUMO Energy | -1.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FEMWMNCEGXUBRL-FGTAOJJYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |