skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

tauronorcholate (1)  

Type

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

charge

  • -1

formula

  • C25H42NO7S

inchi

  • InChI=1S/C25H43NO7S/c1-14(10-22(30)26-8-9-34(31,32)33)17-4-5-18-23-19(13-21(29)25(17,18)3)24(2)7-6-16(27)11-15(24)12-20(23)28/h14-21,23,27-29H,4-13H2,1-3H3,(H,26,30)(H,31,32,33)/p-1/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1

inchikey

  • FLCYLDUFOVBENV-SRNOMOOLSA-M

mass

  • 500.670

monoisotopicmass

  • 500.26875

smiles

  • C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@]4([H])[C@@H](CC(NCCS([O-])(=O)=O)=O)C)[H])C)O)[H])C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191405

Download this concept: