(1S,3R,7S,8S,9R,10S,12R,16S)-6,9,12,17-Tetrahydroxy-16-Methyl-8-(2-Methyl-2-Propanyl)-2,4,14,19-Tetraoxahexacyclo[8.7.2.0~1,11~.0~3,7~.0~7,11~.0~13,17~]Nonadecane-5,15,18-Trione
Properties
| Property | Value |
|---|---|
| Formula | C20H24O11 |
| IUPAC Name | (1r,3r,7s,8s,9r,10s,11r,13s,16s,17r)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0 1,11 .0 3,7 .0 7,11 .0 13,17 ]nonadecane-5,15,18-trione |
| Molecular Mass | 440.398 g·mol−1 |
| Heat of Formation | -1905.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.21 ± 1.08 D |
| Volume | 458.24 Å 3 |
| Surface Area | 338.84 Å 2 |
| HOMO Energy | -10.70 ± 0.55 eV |
| LUMO Energy | -0.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AMOGMTLMADGEOQ-YPVGKNFZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |