5-Acetoxy-6-[2-(3,4-Dihydroxyphenyl)Ethoxy]-2-(Hydroxymethyl)-4-[(3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Methoxy]Tetrahydro-2H-Pyran-3-Yl (2E)-3-(3,4-Dihydroxyphenyl)Acrylate (Non-Preferred Name)
Properties
| Property | Value |
|---|---|
| Formula | C32H40O16 |
| IUPAC Name | [(2r,3r,4s,5r,6r)-5-acetoxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl] (e)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| Molecular Mass | 680.650 g·mol−1 |
| Heat of Formation | -2745.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.45 ± 1.08 D |
| Volume | 765.01 Å 3 |
| Surface Area | 554.86 Å 2 |
| HOMO Energy | -8.61 ± 0.55 eV |
| LUMO Energy | -0.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KJJKGAYHJMZKLA-DBDAIDROSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |