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Substance Name: Taurochenodeoxycholic acid
RN: 516-35-8
UNII: 651KU15938
InChIKey: BHTRKEVKTKCXOH-BJLOMENOSA-N

Note

  • A bile salt formed in the liver by conjugation of chenodeoxycholate with taurine, usually as the sodium salt. It acts as detergent to solubilize fats in the small intestine and is itself absorbed. It is used as a cholagogue and choleretic.

Molecular Formula

  • C26-H45-N-O6-S

Molecular Weight

  • 499.7085
 

Classification Codes

  • Cholagogues and Choleretics
  • Detergents
  • Gastrointestinal Agents
  • Surface-Active Agents
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Names and Synonyms

Name of Substance

  • Taurochenodeoxycholic acid

MeSH Heading

  • Taurochenodeoxycholic acid

Synonyms

  • Chenodeoxycholyltaurine
  • Chenyltaurine
  • Taurine chenodeoxycholate
  • Taurochenodeoxycholate
  • Taurochenodeoxycholic acid
  • Taurochenodesoxycholic acid
  • UNII-651KU15938

Systematic Name

  • Ethanesulfonic acid, 2-(((3alpha,5beta,7alpha)-3,7-dihydroxy-24-oxocholan-24-yl)amino)-

Registry Numbers

CAS Registry Number

  • 516-35-8

FDA UNII

  • 651KU15938

System Generated Number

  • 0000516358

Structure Descriptors

InChI

1S/C26H45NO6S/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1

InChIKey

BHTRKEVKTKCXOH-BJLOMENOSA-N

Smiles

C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C