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Substance Name: Sodium hyodeoxycholate
RN: 10421-49-5
UNII: HBY71R8HO2
InChIKey: DUYSCILLIVEITB-IHUGHQDSSA-M

Molecular Formula

  • C24-H40-O4.Na

Molecular Weight

  • 414.5581
 
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Names and Synonyms

Results Name

  • Sodium hyodeoxycholate

Name of Substance

  • Sodium hyodeoxycholate

Synonyms

  • Sodium hyodeoxycholate
  • Sodium hyodesoxycholate
  • UNII-HBY71R8HO2

Systematic Names

  • 5beta-Cholan-24-oic acid, 3alpha,6alpha-dihydroxy-, monosodium salt
  • Cholan-24-oic acid, 3,6-dihydroxy-, monosodium salt, (3alpha,5beta,6alpha)-

Registry Numbers

CAS Registry Number

  • 10421-49-5

FDA UNII

  • HBY71R8HO2

Related Registry Number

  • 83-49-8 (Parent)

System Generated Number

  • 0010421495

Molecular Formulas

Molecular Formula

  • C24-H40-O4.Na

Molecular Formula Fragments

  • C24-H40-O4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H40O4.Na/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2;/h14-21,25-26H,4-13H2,1-3H3,(H,27,28);/q;+1/p-1/t14-,15-,16?,17-,18?,19?,20+,21+,23-,24-;/m1./s1

InChIKey

DUYSCILLIVEITB-IHUGHQDSSA-M

Smiles

C[C@H](CCC(=O)[O-])[C@H]1CCC2[C@@]1(CCC3C2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.[Na+]