(5β,17Alpha,20S)-3-Oxocholan-24-Oic Acid
Properties
Property | Value |
---|---|
Formula | C24H38O3 |
IUPAC Name | (4s)-4-[(5r,8r,9s,10s,13r,14s,17r)-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 | 374.557 g·mol−1 |
Heat of Formation | -852.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.97 ± 1.08 D |
Volume | 491.64 Å 3 |
Surface Area | 381.27 Å 2 |
HOMO Energy | -9.80 ± 0.55 eV |
LUMO Energy | 0.91 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | KIQFUORWRVZTHT-HSYHYESFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |