sec-butylglucosinolate

InChI: InChI=1/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1/t5?,6-,7-,8+,9-,11+/m1/s1/fC11H20NO9S2/q-1

InChIKey: InChIKey=TUSWQPFNQXCPGB-VMRXMNBEDY
SMILES: CCC(C)C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS([O-])(=O)=O

Names:
    Glucocochlearin
    glucocochlearin
    sec-butylglucosinolate
    1-methylpropylglucosinolate

Registries:
    PubChem CID 656534
    ChEBI 5402
    Kegg C08407
    PubChem ID 10603