glucosinolate glucobrassicin(1-) -1 447.05375 447.467 metacyc.compound:CPD-1863 CHEBI:64962 O=S(=O)([O-])ON=C(Cc1cnc2ccccc12)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O reaxys:4167525 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)/p-1/t11-,13-,14+,15-,16+/m1/s1 1-S-[2-(1H-indol-3-yl)-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose kegg.compound:C05837 DNDNWOWHUWNBCK-JZYAIQKZSA-M C16H19N2O9S2 chebi_ontology 1-S-[2-(1H-indol-3-yl)-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose wikipedia.en:Glucobrassicin An indolylmethylglucosinolate that is the conjugate base of glucobrassicin, obtained by deprotonation of the sulfo group. glucobrassicin glucobrassicin anion