5.α.-Ergosta-7,22-Diene-3.Beta.,5,6.Beta.-Triol
Properties
Property | Value |
---|---|
Formula | C28H46O3 |
IUPAC Name | (3s,5r,6r,9s,10r,13r,14r,17r)-10,13-dimethyl-17-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol |
Molecular Mass | 430.663 g·mol−1 |
Heat of Formation | -808.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.47 ± 1.08 D |
Volume | 576.99 Å 3 |
Surface Area | 443.23 Å 2 |
HOMO Energy | -9.44 ± 0.55 eV |
LUMO Energy | 0.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | ARXHRTZAVQOQEU-BRVLHLJYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |