FL7AAGGL0035

Revision as of 09:00, 25 July 2008

Delphinidin 3- (6"-O-4-malyl-glucosyl) -5-glucoside

Structural Information
Systematic Name	2- (3,4,5-Trihydroxyphenyl) -3- [ [ 6-O- (3,4-dihydroxy-1,4-dioxobutyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium
Common Name	Delphinidin 3- (6"-O-4-malyl-glucosyl) -5-glucoside 2- (3,4,5-Trihydroxyphenyl) -3- [ [ 6-O- (3,4-dihydroxy-1,4-dioxobutyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium
Symbol
Formula	C31H35O21
Exact Mass	743.1670831819999
Average Mass	743.597
SMILES	`Oc(c1)cc(OC(C5O)OC(C(O)C5O)CO)c(c2)c([o+1]c(c(c4)cc(O)c(c4O)O)c2OC(C(O)3)OC(C(O)C(O)3)COC(=O)CC(C(O)=O)O)1`
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
Dianthus caryophyllus	FL7AAGGL0035	See above.	Fukui_Y et al. 2003

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 {{Metabolite
-|SysName=2-(3,4,5-Trihydroxyphenyl)-3-[[6-O-(3,4-dihydroxy-1,4-dioxobutyl)-beta-D-glucopyranosyl]oxy]-5-(beta-D-glucopyranosyloxy)-7-hydroxy-1-benzopyrylium
+|SysName=2- (3,4,5-Trihydroxyphenyl) -3- [ [ 6-O- (3,4-dihydroxy-1,4-dioxobutyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium
-|Common Name=&&Delphinidin 3-(6"-O-4-malyl-glucosyl)-5-glucoside&&2-(3,4,5-Trihydroxyphenyl)-3-[[6-O-(3,4-dihydroxy-1,4-dioxobutyl)-beta-D-glucopyranosyl]oxy]-5-(beta-D-glucopyranosyloxy)-7-hydroxy-1-benzopyrylium&&
+|Common Name=&&Delphinidin 3- (6"-O-4-malyl-glucosyl) -5-glucoside&&2- (3,4,5-Trihydroxyphenyl) -3- [ [ 6-O- (3,4-dihydroxy-1,4-dioxobutyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium&&
 |CAS=592522-38-8
 |KNApSAcK=C00011191
 }}