[(1R,2S,3R,5S,6R,8S)-3-(β-D-Galactopyranosyloxy)-6-Hydroxy-8-Methyl-9,10-Dioxatetracyclo[4.3.1.0~2,5~.0~3,8~]Dec-2-Yl]Methyl Benzoate
Properties
| Property | Value |
|---|---|
| Formula | C23H28O11 |
| IUPAC Name | paeoniflorin |
| Molecular Mass | 480.462 g·mol−1 |
| Heat of Formation | 888.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.19 ± 1.08 D |
| Volume | 471.41 Å 3 |
| Surface Area | 380.66 Å 2 |
| HOMO Energy | -9.62 ± 0.55 eV |
| LUMO Energy | -2.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YKRGDOXKVOZESV-XUGMNLOOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |