(1S,4R,5S,8R,9R,12S,13R,14R,16R,18S)-5,11-Dihydroxy-13-(Hydroxymethyl)-9,16-Dimethyl-8-(2-Oxo-2H-Pyran-5-Yl)-15,17,20-Trioxahexacyclo[14.3.1.1~14,18~.0~1,13~.0~4,12~.0~5,9~]Henicosan-10-One
Properties
| Property | Value |
|---|---|
| Formula | C26H32O9 |
| IUPAC Name | (1s,4r,5s,8r,9r,12s,13r,14r,16r,18s)-5,11-dihydroxy-13-(hydroxymethyl)-9,16-dimethyl-8-(2-oxo-2h-pyran-5-yl)-15,17,20-trioxahexacyclo[14.3.1.1 14,18 .0 1,13 .0 4,12 .0 5,9 ]henicosan-10-one |
| Molecular Mass | 488.527 g·mol−1 |
| Heat of Formation | 1750.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.09 ± 1.08 D |
| Volume | 445.16 Å 3 |
| Surface Area | 352.4 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -0.30 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GWAJSVNDQHKYPG-RYTBTWGKSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |