(1S,2R,3S,4S,6R,7R,8R,14R)-3-Hydroxy-2,4,7,14-Tetramethyl-9-Oxo-4-Vinyltricyclo[5.4.3.0~1,8~]Tetradec-6-Yl {[2-Methyl-1-(D-Valylamino)-2-Propanyl]Sulfanyl}Acetate
Properties
| Property | Value |
|---|---|
| Formula | C31H52N2O5S |
| IUPAC Name | [(1r,2s,3r,4r,6s,7s,8s,14r)-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-4-vinyl-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[2-[[(2s)-2-amino-3-methyl-butanoyl]amino]-1,1-dimethyl-ethyl]sulfanylacetate |
| Molecular Mass | 564.820 g·mol−1 |
| Heat of Formation | -1154.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.12 ± 1.08 D |
| Volume | 726.52 Å 3 |
| Surface Area | 513.87 Å 2 |
| HOMO Energy | -8.92 ± 0.55 eV |
| LUMO Energy | -0.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LLYYNOVSVPBRGV-NJDJHSKTSA-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 N |