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Substance Name: Glycocholate sodium
RN: 863-57-0
UNII: V06CXA1W3K
InChIKey: OABYVIYXWMZFFJ-ZUHYDKSRSA-M

Note

  • The glycine conjugate of CHOLIC ACID. It acts as a detergent to solubilize fats for absorption and is itself absorbed.

Molecular Formula

  • C26-H43-N-O6.Na

Molecular Weight

  • 487.6088
 

Classification Code

  • Mutation Data
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Names and Synonyms

Results Name

  • Glycocholate sodium

Name of Substance

  • Glycocholic acid, sodium salt

Synonyms

  • EINECS 212-730-9
  • Glycocholate sodium
  • Glycocholate sodium salt
  • Glycocholic acid sodium salt
  • Monosodium glycocholic acid
  • NSC 35609
  • Sodium glycocholate
  • UNII-V06CXA1W3K

Systematic Names

  • Glycine, N-((3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxy-24-oxocholan-24-yl)-, monosodium salt (9CI)
  • Glycine, N-choloyl-, monosodium salt
  • Sodium N-(3-alpha,7-alpha,12-alpha-trihydroxy-24-oxocholan-24-yl)glycinate

Registry Numbers

CAS Registry Number

  • 863-57-0

FDA UNII

  • V06CXA1W3K

System Generated Number

  • 0000863570

Molecular Formulas

Molecular Formula

  • C26-H43-N-O6.Na

Molecular Formula Fragments

  • C26-H43-N-O6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C26H43NO6.Na/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29;/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33);/q;+1/p-1/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-;/m1./s1

InChIKey

OABYVIYXWMZFFJ-ZUHYDKSRSA-M

Smiles

C1[C@@H]2[C@@H]3[C@@H]([C@@]4([C@@H](C[C@@H](O)CC4)C[C@@H]3O)C)C[C@@H]([C@@]2([C@@H]([C@@H](CCC(NCC(=O)[O-])=O)C)C1)C)O.[Na+]