FL7AADGL0026

Revision as of 09:00, 25 July 2008

Peonidin 3-caffeylrutinoside-5-glucoside

Structural Information
Systematic Name	3- [ 6-O- [ 4-O- [ (E) -3- (3,4-Dihydroxyphenyl) propenoyl ] -alpha-L-rhamnopyranosyl ] -beta-D-glucopyranosyloxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium
Common Name	Peonidin 3-caffeylrutinoside-5-glucoside 3- [ 6-O- [ 4-O- [ (E) -3- (3,4-Dihydroxyphenyl) propenoyl ] -alpha-L-rhamnopyranosyl ] -beta-D-glucopyranosyloxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium
Symbol
Formula	C43H49O23
Exact Mass	933.266462874
Average Mass	933.83536
SMILES	`c(O)(c7)c(O)cc(c7)C=CC(=O)OC(C(C)1)C(C(O)C(OCC(O2)C(O)C(C(C(Oc(c(c(c6)cc(c(c6)O)OC)4)cc(c3OC(O5)C(C(O)C(O)C5CO)O)c([o+1]4)cc(c3)O)2)O)O)O1)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
Solanum tuberosum	FL7AADGL0026	See above.	Fossen_T et al. 2003
Ipomoea indivisa	FL7AADGL0026	See above.	Griesbach_RJ et al. 1991
Petunia x hybrida	FL7AADGL0026	See above.	Griesbach_RJ et al. 1991
Ipomoea indivisa	FL7AADGL0026	See above.	Pomilio_AB et al. 1972
Petunia x hybrida	FL7AADGL0026	See above.	Pomilio_AB et al. 1972

@@ Line 1: / Line 1: @@
 {{Metabolite
-|SysName=3-[6-O-[4-O-[(E)-3-(3,4-Dihydroxyphenyl)propenoyl]-alpha-L-rhamnopyranosyl]-beta-D-glucopyranosyloxy]-5-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium
+|SysName=3- [ 6-O- [ 4-O- [ (E) -3- (3,4-Dihydroxyphenyl) propenoyl ] -alpha-L-rhamnopyranosyl ] -beta-D-glucopyranosyloxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium
-|Common Name=&&Peonidin 3-caffeylrutinoside-5-glucoside&&3-[6-O-[4-O-[(E)-3-(3,4-Dihydroxyphenyl)propenoyl]-alpha-L-rhamnopyranosyl]-beta-D-glucopyranosyloxy]-5-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium&&
+|Common Name=&&Peonidin 3-caffeylrutinoside-5-glucoside&&3- [ 6-O- [ 4-O- [ (E) -3- (3,4-Dihydroxyphenyl) propenoyl ] -alpha-L-rhamnopyranosyl ] -beta-D-glucopyranosyloxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium&&
 |CAS=704210-28-6
 |KNApSAcK=C00006874
 }}