Isodeoxycholic acid

For research use only. Not for therapeutic Use.

  • CAT Number: I040646
  • CAS Number: 566-17-6
  • Molecular Formula: C24H40O4
  • Molecular Weight: 392.57
  • Purity: ≥95%
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Isodeoxycholic acid (7α,12α-Dihydroxycholanoic acid)(CAT: I040646) is a secondary bile acid and the 3β-epimer of ursodeoxycholic acid (UDCA). This bile acid exhibits notable effects on choleresis (bile flow stimulation) and liver biochemistry, making it a useful tool in hepatobiliary research. Isodeoxycholic acid is studied for its role in bile acid metabolism, cholestasis models, and liver function modulation. Its structural similarity to UDCA allows comparative evaluation of epimer-specific activity and potential therapeutic applications. Suitable for investigating bile flow regulation, hepatic detoxification pathways, and gastrointestinal homeostasis, it supports drug development targeting liver and digestive disorders.


CAS Number 566-17-6
Synonyms

(4R)-4-[(5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

Molecular Formula C24H40O4
Purity ≥95%
IUPAC Name (4R)-4-[(5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChI InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
InChIKey ZHCAAZIHTDCFJX-QLEQUTGBSA-N
SMILES CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCCC4)C)O)O)C
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