(1S,2Xi)-1,5-Anhydro-1-(1,3,6,7-Tetrahydroxy-9-Oxo-9H-Xanthen-2-Yl)-D-Arabino-Hexitol
Properties
| Property | Value |
|---|---|
| Formula | C19H18O11 |
| IUPAC Name | 1,3,6,7-tetrahydroxy-2-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]xanthen-9-one |
| Molecular Mass | 422.340 g·mol−1 |
| Heat of Formation | -1808.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.90 ± 1.08 D |
| Volume | 430.18 Å 3 |
| Surface Area | 369.34 Å 2 |
| HOMO Energy | -9.31 ± 0.55 eV |
| LUMO Energy | -1.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AEDDIBAIWPIIBD-MNHFLTBFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |