Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 7alpha-Hydroxy-3-oxo-4-cholestenoic acid
RN: 115538-85-7
InChIKey: SATGKQGFUDXGAX-MYWFJNCASA-N

Note

  • Unconjugated bile acid found in human blood.

Molecular Formula

  • C27-H42-O4

Molecular Weight

  • 430.6248
 
* 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

  • 7alpha-Hydroxy-3-oxo-4-cholestenoic acid

Synonym

  • 7-Hoca

Systematic Name

  • Cholest-4-en-26-oic acid, 7-hydroxy-3-oxo-, (7alpha)-

Registry Numbers

CAS Registry Number

  • 115538-85-7

System Generated Number

  • 0115538857

Structure Descriptors

InChI

1S/C27H42O4/c1-16(6-5-7-17(2)25(30)31)20-8-9-21-24-22(11-13-27(20,21)4)26(3)12-10-19(28)14-18(26)15-23(24)29/h14,16-17,20-24,29H,5-13,15H2,1-4H3,(H,30,31)/t16-,17?,20-,21+,22+,23-,24+,26+,27-/m1/s1

InChIKey

SATGKQGFUDXGAX-MYWFJNCASA-N

Smiles

C[C@H](CCCC(C)C(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](CC4=CC(=O)CC[C@]34C)O)C