Glucotropeolin

Molecular Formula: C₁₄H₁₈NO₉S₂^-

InChI: InChI=1/C14H19NO9S2/c16-7-9-11(17)12(18)13(19)14(23-9)25-10(15-24-26(20,21)22)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-19H,6-7H2,(H,20,21,22)/p-1/b15-10+/t9-,11-,12-,13-,14+/m1/s1/fC14H18NO9S2/q-1

InChIKey: InChIKey=QQGLQYQXUKHWPX-NLMKMVTKDL
SMILES: C1=CC=C(C=C1)CC(=NOS(=O)(=O)[O-])SC2C(C(C(C(O2)CO)O)O)O

Names:
    benzylglucosinolate
    CHEBI:17127
    Glucotropaeolin
    Glucotropeolin
    (2S,3R,4S,5S,6R)-2-(C-benzyl-N-sulfonatooxy-carbonimidoyl)sulfanyl-3,4,5-trihydroxy-6-(hydroxymethyl)oxane
    1-S-[2-phenyl-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose

Registries:
    PubChem CID 9548604
    PubChem ID 8143695