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Concept information

Preferred term

sulfoglycolithocholate(2-)  

Type

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

charge

  • -2

formula

  • C26H41NO7S

inchi

  • InChI=1S/C26H43NO7S/c1-16(4-9-23(28)27-15-24(29)30)20-7-8-21-19-6-5-17-14-18(34-35(31,32)33)10-12-25(17,2)22(19)11-13-26(20,21)3/h16-22H,4-15H2,1-3H3,(H,27,28)(H,29,30)(H,31,32,33)/p-2/t16-,17-,18-,19+,20-,21+,22+,25+,26-/m1/s1

inchikey

  • FHXBAFXQVZOILS-OETIFKLTSA-L

is_conjugate_base_of

mass

  • 511.67100

monoisotopicmass

  • 511.26147

smiles

  • [H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)CCC(=O)NCC([O-])=O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@H](C2)OS([O-])(=O)=O

subset

  • 3_STAR

synonym EXACT

  • N-[3alpha-(sulfonatooxy)-5beta-cholan-24-oyl]glycinate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:60007

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