(1α,3Beta,20S)-20-(3-Hydroxy-3-Methylbutoxy)Pregna-5,7-Diene-1,3-Diol
Properties
| Property | Value |
|---|---|
| Formula | C26H42O4 |
| IUPAC Name | (1r,3r,9s,10r,13s,14r,17s)-17-[(1r)-1-(3-hydroxy-3-methyl-butoxy)ethyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1h-cyclopenta[a]phenanthrene-1,3-diol |
| Molecular Mass | 418.609 g·mol−1 |
| Heat of Formation | -932.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.31 ± 1.08 D |
| Volume | 544.77 Å 3 |
| Surface Area | 424.48 Å 2 |
| HOMO Energy | -8.47 ± 0.55 eV |
| LUMO Energy | 0.45 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DUZLDPYKMSNPLT-MMPNFCDWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |