Methyl (2R,3S,6S,8S,9S,10R,11S,12R,13S)-3-{[(2E)-4-Acetoxy-3,4-Dimethyl-2-Pentenoyl]Oxy}-8-Acetyl-11,12-Dihydroxy-9-(2-Methoxy-2-Oxoethyl)-4-Oxo-5,14-Dioxatetracyclo[8.5.0.0~1,6~.0~2,13~]Pentadecane-13-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C29H38O14 |
| IUPAC Name | methyl (2r,3s,6s,8s,9s,10r,11s,12r,13s)-3-{[(2e)-4-acetoxy-3,4-dimethyl-2-pentenoyl]oxy}-8-acetyl-11,12-dihydroxy-9-(2-methoxy-2-oxoethyl)-4-oxo-5,14-dioxatetracyclo[8.5.0.0 1,6 .0 2,13 ]pentadecane-13-carboxylate |
| Molecular Mass | 610.604 g·mol−1 |
| Heat of Formation | -2489.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.71 ± 1.08 D |
| Volume | 688.52 Å 3 |
| Surface Area | 510.8 Å 2 |
| HOMO Energy | -10.27 ± 0.55 eV |
| LUMO Energy | 0.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OHZFUWABZIZYPL-NYJXJCDRSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |