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Concept information

Preferred term

4 متوکسی گلوکوبراسیسین  

Type

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

charge

  • 0

formula

  • C17H22N2O10S2

has_functional_parent

inchi

  • InChI=1S/C17H22N2O10S2/c1-27-10-4-2-3-9-13(10)8(6-18-9)5-12(19-29-31(24,25)26)30-17-16(23)15(22)14(21)11(7-20)28-17/h2-4,6,11,14-18,20-23H,5,7H2,1H3,(H,24,25,26)/t11-,14-,15+,16-,17+/m1/s1

inchikey

  • IIAGSABLXRZUSE-UFRBAHOGSA-N

mass

  • 478.49606

monoisotopicmass

  • 478.07159

smiles

  • COc1cccc2[nH]cc(CC(S[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=NOS(O)(=O)=O)c12

subset

  • 3_STAR

synonym EXACT

  • 1-S-[2-(4-methoxy-1H-indol-3-yl)-N-(sulfooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose
  • 4-Methoxyglucobrassicin

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:1890

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