FL3FECGS0047

Revision as of 09:00, 25 July 2008

6-Hydroxyluteolin 7- [ 6"- (3-hydroxy-3-methylglutaryl) glucoside ] -3-glucuronide

Structural Information
Systematic Name	5- [ 7- [ [ 6-O- (4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl) -beta-D-glucopyranosyl ] oxy ] -5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl ] -2-hydroxyphenyl beta-D-glucopyranosiduronic acid
Common Name	6-Hydroxyluteolin 7- [ 6"- (3-hydroxy-3-methylglutaryl) glucoside ] -3-glucuronide 5- [ 7- [ [ 6-O- (4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl) -beta-D-glucopyranosyl ] oxy ] -5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl ] -2-hydroxyphenyl beta-D-glucopyranosiduronic acid
Symbol
Formula	C33H36O22
Exact Mass	784.169822836
Average Mass	784.62574
SMILES	`C(C(O)1)(O)C(C(Oc(c2)c(O)ccc2C(=C5)Oc(c(C(=O)5)3)cc(OC(O4)C(O)C(C(C4COC(CC(C)(O)CC(O)=O)=O)O)O)c(O)c3O)OC1C(O)=O)O`
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Species-Flavonoid Relationship Reported

Species	ID	Metabolite Name	Reference
Frullania cesatiana	FL3FECGS0047	See above.	Kraut_L et al. 1995

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 {{Metabolite
-|SysName=5-[7-[[6-O-(4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl]-2-hydroxyphenyl beta-D-glucopyranosiduronic acid
+|SysName=5- [ 7- [ [ 6-O- (4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl) -beta-D-glucopyranosyl ] oxy ] -5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl ] -2-hydroxyphenyl beta-D-glucopyranosiduronic acid
-|Common Name=&&6-Hydroxyluteolin 7-[6"-(3-hydroxy-3-methylglutaryl)glucoside]-3-glucuronide&&5-[7-[[6-O-(4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl]-2-hydroxyphenyl beta-D-glucopyranosiduronic acid&&
+|Common Name=&&6-Hydroxyluteolin 7- [ 6"- (3-hydroxy-3-methylglutaryl) glucoside ] -3-glucuronide&&5- [ 7- [ [ 6-O- (4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl) -beta-D-glucopyranosyl ] oxy ] -5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl ] -2-hydroxyphenyl beta-D-glucopyranosiduronic acid&&
 |CAS=165460-14-0
 |KNApSAcK=C00013692
 }}