4-(3-Oxobutyl)Phenyl 6-O-(3,4,5-Trihydroxybenzoyl)-β-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C23H26O11 |
| IUPAC Name | [(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[4-(3-oxobutyl)phenoxy]tetrahydropyran-2-yl]methyl 3,4,5-trihydroxybenzoate |
| Molecular Mass | 478.446 g·mol−1 |
| Heat of Formation | -1817.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.86 ± 1.08 D |
| Volume | 543.19 Å 3 |
| Surface Area | 421.81 Å 2 |
| HOMO Energy | -9.00 ± 0.55 eV |
| LUMO Energy | 2.38 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BJYRNIFAMMOVGW-ZNCFPDGUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |