3-(5-{[6-O-(β-D-Glucopyranosyl)-β-D-Glucopyranosyl]Oxy}-2,2-Dimethyl-2H-Chromen-6-Yl)Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C26H36O14 |
| IUPAC Name | 3-[2,2-dimethyl-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chromen-6-yl]propanoic acid |
| Molecular Mass | 572.556 g·mol−1 |
| Heat of Formation | -2507.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.51 ± 1.08 D |
| Volume | 653.04 Å 3 |
| Surface Area | 450.52 Å 2 |
| HOMO Energy | -8.56 ± 0.55 eV |
| LUMO Energy | -0.28 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NQAQCZORTDQVFT-LMYULTQQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |