2-[(2-O-Benzoylhexopyranosyl)Oxy]Benzyl 1-Hydroxy-6-Oxo-2-Cyclohexene-1-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C27H28O11 |
| IUPAC Name | [(2s,3s,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-[[(1r)-1-hydroxy-6-oxo-cyclohex-2-ene-1-carbonyl]oxymethyl]phenoxy]tetrahydropyran-3-yl] benzoate |
| Molecular Mass | 528.505 g·mol−1 |
| Heat of Formation | -1606.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.38 ± 1.08 D |
| Volume | 601.36 Å 3 |
| Surface Area | 478.96 Å 2 |
| HOMO Energy | -9.50 ± 0.55 eV |
| LUMO Energy | -0.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RCKCYCDBDYUIGM-OJSSCUGGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |