Methyl (2S,3S,4R)-3,4,6-Trihydroxy-2-Methyl-5-Oxo-3,4-Dihydro-2H,5H-Thiopyrano[2,3-B]Chromene-4-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C15H14O7S |
| IUPAC Name | methyl (2s,3s,4r)-3,4,6-trihydroxy-2-methyl-5-oxo-2,3-dihydrothiopyrano[2,3-b]chromene-4-carboxylate |
| Molecular Mass | 338.332 g·mol−1 |
| Heat of Formation | -1085.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.63 ± 1.08 D |
| Volume | 347.42 Å 3 |
| Surface Area | 300.68 Å 2 |
| HOMO Energy | -9.14 ± 0.55 eV |
| LUMO Energy | -1.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BPLWVCBQPIGTLA-FXICSDJMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O |