(3R,5Z,7E,23S)-9,10-Secocholesta-5,7,10-Triene-3,23,25-Triol
Properties
| Property | Value |
|---|---|
| Formula | C27H44O3 |
| IUPAC Name | (4s,6r)-6-[(1r,3as,4e,7ar)-4-[(2z)-2-[(5r)-5-hydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-1-yl]-2-methyl-heptane-2,4-diol |
| Molecular Mass | 416.636 g·mol−1 |
| Heat of Formation | -758.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.73 ± 1.08 D |
| Volume | 565.21 Å 3 |
| Surface Area | 447.88 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | 0.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JVBPQHSRTHJMLM-VCAQAZSGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |