(3R,4As,5R,6S)-3-[(4S)-4-Hydroxy-8-(4-Hydroxyphenyl)-2,6-Dioxooctyl]-1-Oxo-5-Vinyl-4,4A,5,6-Tetrahydro-1H,3H-Pyrano[3,4-C]Pyran-6-Yl β-D-Glucopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C30H38O13 |
| IUPAC Name | (4s)-1-[(3r,4as,5r,6s)-1-oxo-6-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-5-vinyl-4,4a,5,6-tetrahydro-3h-pyrano[3,4-c]pyran-3-yl]-4-hydroxy-8-(4-hydroxyphenyl)octane-2,6-dione |
| Molecular Mass | 606.615 g·mol−1 |
| Heat of Formation | -2197.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.41 ± 1.08 D |
| Volume | 714.1 Å 3 |
| Surface Area | 526.54 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | -0.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NRVMYJKCFMJRML-PSSYNQDQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |