4-Hydroxyphenyl 6-O-[(2E)-3-(1,4-Dihydroxy-6-Oxo-2-Cyclohexen-1-Yl)-2-Propenoyl]-β-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C21H24O11 |
| IUPAC Name | [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)tetrahydropyran-2-yl]methyl (e)-3-[(1r,4s)-1,4-dihydroxy-6-oxo-cyclohex-2-en-1-yl]prop-2-enoate |
| Molecular Mass | 452.409 g·mol−1 |
| Heat of Formation | -1746.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.98 ± 1.08 D |
| Volume | 499.74 Å 3 |
| Surface Area | 381.53 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | -0.46 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MJKRDLMPYUENAA-OKTZYABESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |