ISOQUERCITRIN-6''-O-MALONATE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5282159
Name
ISOQUERCITRIN-6''-O-MALONATE
Also reported as
QUERCETIN-3-O-(6'-O-MALONYL-GLUCOSIDE)
IUPAC name
3-(((2R,3S,4S,5R,6S)-6-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-3-oxopropanoic acid
SMILES
C1=CC(=C(C=C1C3=C(C(=O)C2=C(C=C(C=C2O3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(CC(=O)O)=O)O)O)O)O)O
Molecular formula
C24H22O15
Molecular weight
550.43 g/mol
Monoisotopic mass
550.0959 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Equisetum arvense L. | aerial parts | - |
Jim Duke's personal files.
|
| Trifolium pratense L. subsp. pratense | flower | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Trifolium pratense L. subsp. pratense | leaf | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|