(1S,2S,5R,7S,10R,11R,14S,16R,17R)-17-(Hydroxymethyl)-7-(4-Hydroxyphenyl)-2,10-Dimethyl-6,8-Dioxapentacyclo[14.3.1.0~1,14~.0~2,11~.0~5,10~]Icosan-17-Ol
Properties
| Property | Value |
|---|---|
| Formula | C27H38O5 |
| IUPAC Name | (1s,2s,5r,7s,10r,11r,14s,16r,17r)-17-(hydroxymethyl)-7-(4-hydroxyphenyl)-2,10-dimethyl-6,8-dioxapentacyclo[14.3.1.0 1,14 .0 2,11 .0 5,10 ]icosan-17-ol |
| Molecular Mass | 442.588 g·mol−1 |
| Heat of Formation | -958.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.95 ± 1.08 D |
| Volume | 539.11 Å 3 |
| Surface Area | 390.35 Å 2 |
| HOMO Energy | -9.12 ± 0.55 eV |
| LUMO Energy | 0.10 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QXXWIRGFTIMWGL-WXAIGJAWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |