3-oxo chenodeoxycholic acid
| Catalog Number | BL-M000486 |
| CAS Number | 4185-00-6 |
| Description | 3-oxo chenodeoxycholic acid, a compound classified as a bile acid derivative, exhibits therapeutic efficacy in addressing gallstones, cholestasis, and various liver pathologies. Furthermore, ongoing research explores its promising role in mitigating metabolic irregularities and optimizing lipid homeostasis. |
| Structure |  |
| IUPAC Name | (4R)-4-[(5R,7R,8R,9S,10S,13R,14S,17R)-7-hydroxy-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 |
| Synonyms | 7alpha-Hydroxy-3-oxo-5beta-cholan-24-oic Acid; 3-Keto-CDCA; 3-dehydrochenodeoxycholic acid; (5beta,7alpha)-7-hydroxy-3-oxocholan-24-oic acid |
| Molecular Weight | 390.56 |
| Molecular Formula | C24H38O4 |
| Boiling Point | 545.9±25.0 °C at 760 mmHg |
| Melting Point | 111-114°C |
| Purity | >99% |
| Density | 1.124±0.06 g/cm3 |
| Appearance | Powder |
| Shelf Life | 1 Year |
| Storage | Store at -20°C |
| Percent Composition | C 73.81%, H 9.81%, O 16.39% |
| Canonical SMILES | CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(=O)C4)C)O)C |
| InChI | InChI=1S/C24H38O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-15,17-20,22,26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,17-,18+,19+,20-,22+,23+,24-/m1/s1 |
| InChI Key | KNVADAPHVNKTEP-CIGXQKLNSA-N |
※ Please be kindly noted products are not for therapeutic use. We do not sell to patients.
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