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Concept information

Preferred term

گلیکونودوکلات سدیم  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C26H42NNaO5

inchi

  • InChI=1S/C26H43NO5.Na/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29;/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32);/q;+1/p-1/t15-,16+,17-,18-,19+,20+,21-,24+,25+,26-;/m1./s1

inchikey

  • AAYACJGHNRIFCT-YRJJIGPTSA-M

mass

  • 471.606

monoisotopicmass

  • 471.29607

smiles

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

subset

  • 3_STAR

synonym EXACT

  • sodium [(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]acetate
  • sodium N-(3alpha,7alpha-dihydroxy-5beta-cholan-24-oyl)glycinate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:87818

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