Methyl [(1S,3R,4R,5S,7S,8S,9S,10S,11S,12S,16R)-4,5,10-Triacetoxy-12-(3-Furyl)-6,6,8,11,16-Pentamethyl-14,17-Dioxo-2,13-Dioxatetracyclo[7.6.2.0~1,11~.0~3,8~]Heptadec-7-Yl]Acetate
Properties
| Property | Value |
|---|---|
| Formula | C33H42O13 |
| IUPAC Name | methyl [(1s,3r,4r,5s,7s,8s,9s,10s,11s,12s,16r)-4,5,10-triacetoxy-12-(3-furyl)-6,6,8,11,16-pentamethyl-14,17-dioxo-2,13-dioxatetracyclo[7.6.2.0 1,11 .0 3,8 ]heptadec-7-yl]acetate |
| Molecular Mass | 646.679 g·mol−1 |
| Heat of Formation | -2375.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.92 ± 1.08 D |
| Volume | 725.8 Å 3 |
| Surface Area | 473.1 Å 2 |
| HOMO Energy | -9.39 ± 0.55 eV |
| LUMO Energy | 3.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KBFRUTVJXWMSRC-LRJYQUDRSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |