glucoconringiin

Molecular Formula: C₁₁H₂₀NO₁₀S₂^-

InChI: InChI=1/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)/p-1/t5-,7-,8+,9-,10+/m1/s1/fC11H20NO10S2/q-1

InChIKey: InChIKey=DYAQCRHEYVANDL-YHFFXOSMDX
SMILES: CC(C)(O)CC(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NOS([O-])(=O)=O

Names:
    C08408
    Glucoconringiin
    glucoconringiin
    (2R,3S,4S,5R,6S)-3,4,5-trihydroxy-2-(hydroxymethyl)-6-[C-(2-hydroxy-2-methyl-propyl)-N-sulfonatooxy-carbonimidoyl]sulfanyl-oxane
    2-hydroxy-2-methylpropylglucosinolate
    28463-28-7

Registries:
    PubChem CID 656536
    ChEBI 5403
    Kegg C08408
    PubChem ID 10604