FL5FACNSS009

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Upper classes : FL Flavonoid : FL5 Flavonol :  FL5FAC Quercetin (289 pages) :  FL5FACNS Simple substitution (15 pages) :  FL5FACNSS Sulfate incluted (10 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	60534-79-4
KEGG	{{{KEGG}}}
KNApSAcK	C00004964
CDX file
MOL file	FL5FACNSS009.mol

Quercetin 3-acetate 7,3',4'-tri-O-sulfate
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavone 3-acetate 7,3',4'-tri-O-sulfate
Common Name	Quercetin 3-acetate 7,3',4'-tri-O-sulfate 3,5,7,3',4'-Pentahydroxyflavone 3-acetate 7,3',4'-tri-O-sulfate
Symbol
Formula	C17H12O17S3
Exact Mass	583.923661028
Average Mass	584.46498
SMILES	CC(=O)OC(C(=O)2)=C(Oc(c3)c(c(O)cc3OS(O)(=O)=O)2)c(c1)cc(OS(O)(=O)=O)c(c1)OS(O)(=O)=O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
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Spectral Information
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IR Spectra
NMR Spectra
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Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Flaveria bidentis FL5FACNSS009 See above. Cabrera_JL et al. 1976