Quercetin 3,4',7-trissulfate

Molecular Formula: C15H10O16S3


InChI: InChI=1/C15H10O16S3/c16-8-3-6(1-2-10(8)30-33(22,23)24)14-15(31-34(25,26)27)13(18)12-9(17)4-7(5-11(12)28-14)29-32(19,20)21/h1-5,16-17H,(H,19,20,21)(H,22,23,24)(H,25,26,27)/f/h19,22,25H

InChIKey: InChIKey=OHGDJKUWKHBWFH-OUPXVBTDCY
SMILES: Oc1cc(ccc1OS(O)(=O)=O)C2=C(OS(O)(=O)=O)C(=O)c3c(O)cc(OS(O)(=O)=O)cc3O2

Names:
    Quercetin 3,4',7-trissulfate
    quercetin 3,4',7-trissulfate
    5-hydroxy-2-(3-hydroxy-4-sulfooxy-phenyl)-4-oxo-3,7-disulfooxy-chromene

Registries:
    PubChem CID 5280632
    ChEBI 28167
    Kegg C03898
    PubChem ID 17184590
    PubChem ID 6630