(17α)-7-Ethyl-3,7-Dihydroxycholan-24-Oic Acid
Properties
Property | Value |
---|---|
Formula | C26H44O4 |
IUPAC Name | (4r)-4-[(3s,5r,7s,8r,9s,10s,13r,14s,17s)-7-ethyl-3,7-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid |
Molecular Mass | 420.625 g·mol−1 |
Heat of Formation | -1119.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.80 ± 1.08 D |
Volume | 547.48 Å 3 |
Surface Area | 412.93 Å 2 |
HOMO Energy | -9.85 ± 0.55 eV |
LUMO Energy | 0.94 ± eV |
Point Group Symmetry | C1 |
InChIKey | MQLOTQXSYYOCHY-JPDLONLHSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |