FL7AAAGL0010

Revision as of 09:00, 25 July 2008

Pelargonidin 3- (2G-glucosylrutinoside)

Structural Information
Systematic Name	2- (4-Hydroxyphenyl) -3- [ [ 2-O- (beta-D-glucopyranosyl) -6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -5,7-dihydroxy-1-benzopyrylium
Common Name	Pelargonidin 3- (2G-glucosylrutinoside) 2- (4-Hydroxyphenyl) -3- [ [ 2-O- (beta-D-glucopyranosyl) -6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -5,7-dihydroxy-1-benzopyrylium
Symbol
Formula	C33H41O19
Exact Mass	741.22420413
Average Mass	741.66724
SMILES	`OC(C(O)1)C(C(OC1OCC(C6O)OC(C(C(O)6)OC(O5)C(O)C(O)C(C5CO)O)Oc(c3)c([o+1]c(c4)c3c(cc4O)O)c(c2)ccc(O)c2)C)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
Callistephus chinensis	FL7AAAGL0010	See above.	Dubois_JA et al. 1975
Rubus spp.	FL7AAAGL0010	See above.	Dubois_JA et al. 1975
Callistephus chinensis	FL7AAAGL0010	See above.	Harborne_JB et al. 1964
Rubus spp.	FL7AAAGL0010	See above.	Harborne_JB et al. 1964

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 {{Metabolite
-|SysName=2-(4-Hydroxyphenyl)-3-[[2-O-(beta-D-glucopyranosyl)-6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-1-benzopyrylium
+|SysName=2- (4-Hydroxyphenyl) -3- [ [ 2-O- (beta-D-glucopyranosyl) -6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -5,7-dihydroxy-1-benzopyrylium
-|Common Name=&&Pelargonidin 3-(2G-glucosylrutinoside)&&2-(4-Hydroxyphenyl)-3-[[2-O-(beta-D-glucopyranosyl)-6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-1-benzopyrylium&&
+|Common Name=&&Pelargonidin 3- (2G-glucosylrutinoside) &&2- (4-Hydroxyphenyl) -3- [ [ 2-O- (beta-D-glucopyranosyl) -6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyl ] oxy ] -5,7-dihydroxy-1-benzopyrylium&&
 |CAS=-
 |KNApSAcK=C00006644
 }}