4-Methyl-2-Oxo-2H-Chromen-7-Yl (6R)-5-Acetamido-3,5-Dideoxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-β-L-Threo-Hex-2-Ulopyranosidonic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H25NO11 |
| IUPAC Name | (2s,4s,5r,6r)-5-acetamido-4-hydroxy-2-(4-methyl-2-oxo-chromen-7-yl)oxy-6-[(1s,2r)-1,2,3-trihydroxypropyl]tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 467.423 g·mol−1 |
| Heat of Formation | -1880.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.25 ± 1.08 D |
| Volume | 524.69 Å 3 |
| Surface Area | 408.56 Å 2 |
| HOMO Energy | -9.50 ± 0.55 eV |
| LUMO Energy | -1.14 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KKDWIUJBUSOPGC-MORHTPAJSA-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 |