glycosinolate sinigrin 0 359.03447 359.378 kegg.compound:C08427 InChI=1S/C10H17NO9S2/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)/b11-6-/t5-,7-,8+,9-,10+/m1/s1 pubmed:24333031 C10H17NO9S2 hmdb:HMDB0034070 pubmed:23837634 2-Propenyl glucosinolate chebi_ontology 1-S-[(1Z)-N-(sulfooxy)but-3-enimidoyl]-1-thio-beta-D-glucopyranose reaxys:1440056 wikipedia.en:Sinigrin 1-S-[(1Z)-N-(sulfooxy)but-3-enimidoyl]-1-thio-beta-D-glucopyranose An alkenylglucosinolic acid that consists of 1-thio-β-<small>D</small>-glucopyranose having a 4-[(sulfooxy)imino]but-1-en-4-yl group attached to the anomeric sulfur. PHZOWSSBXJXFOR-GLVDENFASA-N cas:3952-98-5 CHEBI:79317 cas:534-69-0 pubmed:24128451 knapsack:C00001488 C=CC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O