(2α,3α,5α,22R,23R,24S)-2,3,22,23-Tetrahydroxyergostan-6-One
Properties
| Property | Value |
|---|---|
| Formula | C28H48O5 |
| IUPAC Name | (2r,3s,5r,8r,9s,10r,13s,14s,17r)-17-[(1s,2s,3s,4r)-2,3-dihydroxy-1,4,5-trimethyl-hexyl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one |
| Molecular Mass | 464.678 g·mol−1 |
| Heat of Formation | -1239.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.26 ± 1.08 D |
| Volume | 595.26 Å 3 |
| Surface Area | 439.84 Å 2 |
| HOMO Energy | -9.59 ± 0.55 eV |
| LUMO Energy | 4.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VYUIKSFYFRVQLF-PUZINLRVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |