pentylglucosinolate

InChI: InChI=1/C12H23NO9S2/c1-2-3-4-5-8(13-22-24(18,19)20)23-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)/p-1/t7-,9-,10+,11-,12+/m1/s1/fC12H22NO9S2/q-1

InChIKey: InChIKey=HWFSIYKVSPYQJX-RKAQUSRHDF
SMILES: CCCCCC(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS([O-])(=O)=O

Names:
    pentylglucosinolate

Registries:
    PubChem CID 762392370
    ChEBI 36450