Isotrifoliin

Molecular Formula: C₂₁H₂₀O₁₂

InChI: InChI=1/C21H20O12/c22-6-12(27)19-16(29)17(30)21(32-19)33-20-15(28)14-11(26)4-8(23)5-13(14)31-18(20)7-1-2-9(24)10(25)3-7/h1-5,12,16-17,19,21-27,29-30H,6H2/t12-,16-,17-,19-,21+/m1/s1

InChIKey: InChIKey=OPJZLUXFQFQYAI-GNPVFZCLBD
SMILES: [H][C@@]1(O[C@@H](OC2=C(Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H]1O)[C@H](O)CO

CAS number 21637-25-2

Names:
    Isoquercitrin
    Isoquercitroside
    Isotrifoliin
    quercetin 3-O-beta-D-glucoside
    Quercetin 3-O-glucoside
    2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-
    2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
    3,3',4',5,7-Pentahydroxyflavone 3-beta-D-glucofuranoside
    3-[(2S,3R,4R,5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one

Registries:
    PubChem CID 5484006
    CAS 21637-25-2 (from NIST)
    ChEBI 28299
    Kegg C05623
    PubChem ID 11693895
    PubChem ID 7940