(5Xi,16α)-16-Hydroxy-24-Methylene-3-Oxolanosta-7,9(11)-Dien-21-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C31H46O4 |
| IUPAC Name | (2s)-2-[(5s,10s,13r,14r,16r,17r)-16-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylene-heptanoic acid |
| Molecular Mass | 482.695 g·mol−1 |
| Heat of Formation | 4270.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.24 ± 1.08 D |
| Volume | 550.27 Å 3 |
| Surface Area | 442.9 Å 2 |
| HOMO Energy | -9.36 ± 0.55 eV |
| LUMO Energy | -0.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KPKYWYZPIVAHKU-YZVSHBSASA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |