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Spinacetin

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Spinacetin
Chemical structure of spinacetin
Names
IUPAC name 3,4′,5,7-Tetrahydroxy-3′,6′-dimethoxyflavone
Systematic IUPAC name 3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
Other names Quercetagetin 3',6-dimethyl ether
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
PubChem CID
UNII
CompTox Dashboard (EPA)
InChI
  • InChI=1S/C17H14O8/c1-23-10-5-7(3-4-8(10)18)16-15(22)13(20)12-11(25-16)6-9(19)17(24-2)14(12)21/h3-6,18-19,21-22H,1-2H3Key: XWIDINOKCRFVHQ-UHFFFAOYSA-N
  • InChI=1/C17H14O8/c1-23-10-5-7(3-4-8(10)18)16-15(22)13(20)12-11(25-16)6-9(19)17(24-2)14(12)21/h3-6,18-19,21-22H,1-2H3Key: XWIDINOKCRFVHQ-UHFFFAOYAE
SMILES
  • COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)O)OC)O)O)O
Properties
Chemical formula C17H14O8
Molar mass 346.291 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). ☒verify (what is  ?) Infobox references
Chemical compound

Spinacetin is an O-methylated flavonol. It can be found in spinach (Spinacia oleracea).

References

  1. Aehle, Elke; Raynaud-Le Grandic, Sophie; Ralainirina, Robert; Baltora-Rosset, Sylvie; Mesnard, François; Prouillet, Christophe; Mazière, Jean-Claude; Fliniaux, Marc-André (2004). "Development and evaluation of an enriched natural antioxidant preparation obtained from aqueous spinach (Spinacia oleracea) extracts by an adsorption procedure". Food Chemistry. 86 (4): 579–585. doi:10.1016/j.foodchem.2003.10.006.
Flavonols and their conjugates
Backbone
Aglycones
Flavonols
Aglycones
Conjugates
Glycosides of herbacetin
Glycosides of kaempferol
Glycosides of myricetin
Conjugates of quercetin
Sulfates
Glycosides
O-Methylated flavonols
Aglycones
Glycosides
of isorhamnetin
other
Derivative flavonols
Aglycones
Glycosides
Pyranoflavonols
Aglycones
Furanoflavonols
Aglycones
Glycosides
Semisynthetic
Glycosides


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