517-33-9

7,12-Diketolithocholic acid Chemical Structure
517-33-9

Chemical Structure

7,12-Diketolithocholic acid

Synonym(s): 7,12-Dioxolithocholic acid; 3-Hydroxy-7,12-diketocholanoic acid; 7,12-Diketo-LCA

  • CAS No.: 517-33-9
  • Formula:C24H36O5
  • Molecular Weight:404.54

IUPAC Name: (R)-4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

InChIKey: MAFJMPFLJJCSTB-FQBQTYDJSA-N

SMILES: O[C@@H](C[C@@](CC([C@@]1([H])[C@]2([H])CC[C@@H]([C@]23C)[C@H](C)CCC(O)=O)=O)4[H])CC[C@]4(C)[C@@]1([H])CC3=O

Biological Activity: 7,12-Diketolithocholic acid (7,12-Diketo-LCA) is a bile acid, which can be produced in the host-gut microbial co-metabolism of the bile acid pool[1].

Cat. No. Product Name Purity Description Pricing
HY-41325 		7,12-Diketolithocholic acid 99.93% 7,12-Diketolithocholic acid (7,12-Diketo-LCA) is a bile acid, which can be produced in the host-gut microbial co-metabolism of the bile acid pool.
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This compound is listed in the SVHC (Substances of Very High Concern) candidate list of ECHA (European Chemicals Agency).

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Structural Analogs

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