skip to main content

Content language

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

Concept information

Preferred term

N [15(S) هیدروپروکسی (5Z، 8Z، 11Z، 13E) ایکوزاتترائنویل] تائورین (1)  

Type

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

charge

  • -1

formula

  • C22H36NO6S

inchi

  • InChI=1S/C22H37NO6S/c1-2-3-13-16-21(29-25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(24)23-19-20-30(26,27)28/h4-5,8-11,14,17,21,25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,24)(H,26,27,28)/p-1/b5-4-,10-8-,11-9-,17-14+/t21-/m0/s1

inchikey

  • MGJLNRAMOCXZAS-BPVVGZHASA-M

mass

  • 442.591

monoisotopicmass

  • 442.22688

smiles

  • C(CCC)C[C@@H](/C=C/C=C/C/C=C/C/C=C/CCCC(NCCS([O-])(=O)=O)=O)OO

subset

  • 3_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:132062

Download this concept: