(3β,4Alpha,5Alpha,6Xi,11Xi)-4,15-Diacetoxy-3-Hydroxy-12,13-Epoxytrichothec-9-En-8-Yl 3-Methylbutanoate
Properties
| Property | Value |
|---|---|
| Formula | C24H34O9 |
| IUPAC Name | [(1s,2r,9s,12s)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate |
| Molecular Mass | 466.521 g·mol−1 |
| Heat of Formation | 1785.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.58 ± 1.08 D |
| Volume | 469.23 Å 3 |
| Surface Area | 397.93 Å 2 |
| HOMO Energy | -8.27 ± 0.55 eV |
| LUMO Energy | -2.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BXFOFFBJRFZBQZ-XKFJMNPUSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |