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Concept information

Preferred term

گلوکوبراسیسین  

Type

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

alt_id

  • CHEBI:24815
  • CHEBI:5398
  • CHEBI:60794

charge

  • 0

formula

  • C16H20N2O9S2

inchi

  • InChI=1S/C16H20N2O9S2/c19-7-11-13(20)14(21)15(22)16(26-11)28-12(18-27-29(23,24)25)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-22H,5,7H2,(H,23,24,25)/t11-,13-,14+,15-,16+/m1/s1

inchikey

  • DNDNWOWHUWNBCK-JZYAIQKZSA-N

is_conjugate_acid_of

mass

  • 448.46800

monoisotopicmass

  • 448.06102

smiles

  • OC[C@H]1O[C@@H](SC(Cc2c[nH]c3ccccc23)=NOS(O)(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:29028

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