FL7AAAGL0019

Revision as of 09:00, 25 July 2008

Pelargonidin 3- [ 6- (3-glucosylcaffeyl) glucoside ]

Structural Information
Systematic Name	2- (4-Hydroxyphenyl) -3- [ 6-O- [ (E) -3- [ 4-hydroxy-3- (beta-D-glucopyranosyloxy) phenyl ] -1-oxo-2-propenyl ] -beta-D-glucopyranosyloxy ] -5,7-dihydroxy-1-benzopyrylium
Common Name	Pelargonidin 3- [ 6- (3-glucosylcaffeyl) glucoside ] 2- (4-Hydroxyphenyl) -3- [ 6-O- [ (E) -3- [ 4-hydroxy-3- (beta-D-glucopyranosyloxy) phenyl ] -1-oxo-2-propenyl ] -beta-D-glucopyranosyloxy ] -5,7-dihydroxy-1-benzopyrylium
Symbol
Formula	C36H37O18
Exact Mass	757.1979893800001
Average Mass	757.66818
SMILES	`c(O)(c6)c(cc(c6)C=CC(=O)OC[C@H]([C@@H]5O)O[C@H](C(C(O)5)O)Oc(c3c(c4)ccc(c4)O)cc(c([o+1]3)2)c(cc(O)c2)O)O[C@@H](O1)C(C(O)[C@H](O)[C@@H]1CO)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
Ipomoea nil	FL7AAAGL0019	See above.	Saito_N et al. 1994

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 {{Metabolite
-|SysName=2-(4-Hydroxyphenyl)-3-[6-O-[(E)-3-[4-hydroxy-3-(beta-D-glucopyranosyloxy)phenyl]-1-oxo-2-propenyl]-beta-D-glucopyranosyloxy]-5,7-dihydroxy-1-benzopyrylium
+|SysName=2- (4-Hydroxyphenyl) -3- [ 6-O- [ (E) -3- [ 4-hydroxy-3- (beta-D-glucopyranosyloxy) phenyl ] -1-oxo-2-propenyl ] -beta-D-glucopyranosyloxy ] -5,7-dihydroxy-1-benzopyrylium
-|Common Name=&&Pelargonidin 3-[6-(3-glucosylcaffeyl) glucoside]&&2-(4-Hydroxyphenyl)-3-[6-O-[(E)-3-[4-hydroxy-3-(beta-D-glucopyranosyloxy)phenyl]-1-oxo-2-propenyl]-beta-D-glucopyranosyloxy]-5,7-dihydroxy-1-benzopyrylium&&
+|Common Name=&&Pelargonidin 3- [ 6- (3-glucosylcaffeyl) glucoside ] &&2- (4-Hydroxyphenyl) -3- [ 6-O- [ (E) -3- [ 4-hydroxy-3- (beta-D-glucopyranosyloxy) phenyl ] -1-oxo-2-propenyl ] -beta-D-glucopyranosyloxy ] -5,7-dihydroxy-1-benzopyrylium&&
 |CAS=-
 |KNApSAcK=C00006758
 }}