1-O-Sinapoyl beta-D-glucoside

Molecular Formula: C17H22O10


InChI: InChI=1/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1

InChIKey: InChIKey=XRKBRPFTFKKHEF-DGDBGZAXBB
SMILES: COc1cc(\C=C\C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O

Names:
    1-O-Sinapoyl beta-D-glucoside
    1-O-sinapoyl β-D-glucoside
    1-O-Sinapoyl-beta-D-glucose
    1-O-sinapoyl-beta-D-glucose
    1-O-sinapoyl-β-D-glucose
    [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoate

Registries:
    PubChem CID 5280406
    ChEBI 16546
    Kegg C01175
    Kegg C03915
    PubChem ID 15004496
    PubChem ID 4402