(5β,7Alpha,12β)-7,12-Dihydroxy-3-Oxocholan-24-Oic Acid
Properties
Property | Value |
---|---|
Formula | C24H38O5 |
IUPAC Name | (4r)-4-[(5r,7r,8r,9s,10s,12r,13r,14s,17r)-7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid |
Molecular Mass | 406.556 g·mol−1 |
Heat of Formation | -1192.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.15 ± 1.08 D |
Volume | 513.55 Å 3 |
Surface Area | 392.74 Å 2 |
HOMO Energy | -9.88 ± 0.55 eV |
LUMO Energy | 0.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | OEKUSRBIIZNLHZ-SNNQMBQZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |