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CAS#: 517-33-9 Product: 3-Hydroxy-7,12-Diketocholanoic Acid No suppilers available for the product. |
| Name | 3-Hydroxy-7,12-Diketocholanoic Acid |
|---|---|
| Synonyms | (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-Hydroxy-7,12-Diketo-10,13-Dimethyl-2,3,4,5,6,8,9,11,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Valeric Acid; Lmst04010192; 3Alpha-Hydroxy-7,12-Dioxo-5Beta-Cholan-24-Oic Acid |
| Molecular Structure |  |
| Molecular Formula | C24H36O5 |
| Molecular Weight | 404.55 |
| CAS Registry Number | 517-33-9 |
| SMILES | [C@@H]3(CC[C@H]4[C@@H]2C(C[C@@H]1C[C@@H](CC[C@@]1([C@H]2CC([C@]34C)=O)C)O)=O)[C@@H](CCC(=O)O)C |
| InChI | 1S/C24H36O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-18,22,25H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,22+,23+,24-/m1/s1 |
| InChIKey | MAFJMPFLJJCSTB-FQBQTYDJSA-N |
| Density | 1.176g/cm3 (Cal.) |
|---|---|
| Boiling point | 582.211°C at 760 mmHg (Cal.) |
| Flash point | 319.95°C (Cal.) |
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