(3α,5Beta,7Beta,8Xi,9Xi,14Xi)-3,7-Dihydroxy-20,23-Cyclocholan-24-Oic Acid
Properties
Property | Value |
---|---|
Formula | C24H38O4 |
IUPAC Name | (1r,2s)-2-[(3r,5s,7s,8r,9s,10s,13s,14s,17s)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methyl-cyclopropanecarboxylic acid |
Molecular Mass | 390.556 g·mol−1 |
Heat of Formation | -942.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.19 ± 1.08 D |
Volume | 497.21 Å 3 |
Surface Area | 379.51 Å 2 |
HOMO Energy | -10.03 ± 0.55 eV |
LUMO Energy | 0.77 ± eV |
Point Group Symmetry | C1 |
InChIKey | WLGCTZBTSBEUDJ-BWNZWDLPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |