Dehydroxychlorofusarielin B
Properties
| Property | Value |
|---|---|
| Formula | C25H39ClO4 |
| IUPAC Name | (2s,3s,4e,6e)-7-[(1ar,2r,3s,3as,5r,6r,7ar,7bs)-5-chloro-6-hydroxy-1a,6-dimethyl-2-[(e)-1-methylprop-1-enyl]-2,3,3a,4,5,7,7a,7b-octahydronaphtho[1,2-b]oxiren-3-yl]-2,4-dimethyl-hepta-4,6-diene-1,3-diol |
| Molecular Mass | 439.028 g·mol−1 |
| Heat of Formation | -836.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.99 ± 1.08 D |
| Volume | 572.1 Å 3 |
| Surface Area | 441.55 Å 2 |
| HOMO Energy | -9.05 ± 0.55 eV |
| LUMO Energy | 0.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NUVPMECBNLBBBB-RGIDNKBKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Cl |