(1S)-1,5-Anhydro-1-{2,4,6-Trihydroxy-3-[3-(4-Hydroxyphenyl)Propanoyl]Phenyl}-D-Threo-Hexitol
Properties
| Property | Value |
|---|---|
| Formula | C21H24O10 |
| IUPAC Name | 3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-[(2s,3s,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]phenyl]propan-1-one |
| Molecular Mass | 436.409 g·mol−1 |
| Heat of Formation | -1749.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.48 ± 1.08 D |
| Volume | 475.93 Å 3 |
| Surface Area | 408.07 Å 2 |
| HOMO Energy | -9.00 ± 0.55 eV |
| LUMO Energy | -0.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VZBPTZZTCBNBOZ-ODJUOBDQSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |