(8Xi,9Xi,14Xi,20Xi,22R,24Xi)-17-Hydroxy-25-Methyl-22,26-Epoxy-21,24-Cycloergosta-2,4,6-Triene-1,26-Dione
Properties
| Property | Value |
|---|---|
| Formula | C29H38O4 |
| IUPAC Name | (1r,5r,7s)-7-[(8s,9s,10r,13s,14s,17s)-17-hydroxy-10,13-dimethyl-1-oxo-9,11,12,14,15,16-hexahydro-8h-cyclopenta[a]phenanthren-17-yl]-4,4,5-trimethyl-2-oxabicyclo[3.2.1]octan-3-one |
| Molecular Mass | 450.610 g·mol−1 |
| Heat of Formation | -723.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.26 ± 1.08 D |
| Volume | 552.64 Å 3 |
| Surface Area | 412.71 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | 2.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PUUBDLMPBUSJAL-JCDJOAGLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |