(1R)-1,5-Anhydro-2,6-Dideoxy-1-{2-[4-(β-D-Glucopyranosyloxy)-3-Hydroxyphenyl]-5,7-Dihydroxy-4-Oxo-4H-Chromen-6-Yl}-D-Xylo-Hexitol
Properties
| Property | Value |
|---|---|
| Formula | C27H30O14 |
| IUPAC Name | 6-[(2r,4s,5r,6r)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-5,7-dihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]chromen-4-one |
| Molecular Mass | 578.519 g·mol−1 |
| Heat of Formation | -2311.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.04 ± 1.08 D |
| Volume | 620.77 Å 3 |
| Surface Area | 515.25 Å 2 |
| HOMO Energy | -9.19 ± 0.55 eV |
| LUMO Energy | -1.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NJNUVWMGNSDFQJ-GIZWKEFHSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |