Tirandamycin B
Properties
| Property | Value |
|---|---|
| Formula | C22H27NO8 |
| IUPAC Name | (3e)-3-[(2e,4e,6r)-1-hydroxy-6-[(1s,2s,4r,6s,7r,8r)-2-(hydroxymethyl)-1,7-dimethyl-5-oxo-3,9,10-trioxatricyclo[4.3.1.02,4]decan-8-yl]-4-methyl-hepta-2,4-dienylidene]pyrrolidine-2,4-dione |
| Molecular Mass | 433.452 g·mol−1 |
| Heat of Formation | -1181.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.87 ± 1.08 D |
| Volume | 495.76 Å 3 |
| Surface Area | 412.2 Å 2 |
| HOMO Energy | -9.38 ± 0.55 eV |
| LUMO Energy | -1.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LYJKREGDQDJIDC-SMXDXXKISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |