Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3-Oxocholan-24-oic acid
RN: 1553-56-6
UNII: 96JBM35FXF
InChIKey: KIQFUORWRVZTHT-OPTMKGCMSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C24-H38-O3

Molecular Weight

  • 374.5612
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 3-Oxocholan-24-oic acid

Synonyms

  • (5-beta)-3-Oxocholan-24-oic acid
  • 3-Ketolithocholic acid
  • 3-Oxo-5-beta-cholan-24-oic acid
  • 3-Oxocholanic acid
  • 3-Oxolithocholic acid
  • 5-beta-Cholanic acid-3-one
  • Dehydrolithocholic acid
  • UNII-96JBM35FXF

Systematic Names

  • 5-beta-Cholan-24-oic acid, 3-oxo-
  • Cholan-24-oic acid, 3-oxo-, (5-beta)- (9CI)

Registry Numbers

CAS Registry Number

  • 1553-56-6

FDA UNII

  • 96JBM35FXF

System Generated Number

  • 0001553566

Structure Descriptors

InChI

1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-16,18-21H,4-14H2,1-3H3,(H,26,27)/t15-,16-,18+,19-,20+,21+,23+,24-/m1/s1

InChIKey

KIQFUORWRVZTHT-OPTMKGCMSA-N

Smiles

C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C