(3S,5Z,7E,14Xi)-9,10-Secocholesta-5,7,10-Triene-3,25,26-Triol
Properties
| Property | Value |
|---|---|
| Formula | C27H44O3 |
| IUPAC Name | (2r,6r)-6-[(1r,3as,4e,7as)-4-[(2e)-2-[(5s)-5-hydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-1-yl]-2-methyl-heptane-1,2-diol |
| Molecular Mass | 416.636 g·mol−1 |
| Heat of Formation | -753.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.02 ± 1.08 D |
| Volume | 562.15 Å 3 |
| Surface Area | 469.01 Å 2 |
| HOMO Energy | -8.57 ± 0.55 eV |
| LUMO Energy | 0.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QOWCBCXATJITSI-ROEDXCEWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |