FL7AAAGL0043

Revision as of 09:00, 15 May 2008

Pelargonidin 3-(6"-p-coumaryl-2"'-sinapylsambubioside)-5-glucoside

Structural Information
Systematic Name	7-Hydroxy-2-(4-hydroxyphenyl)-5-[beta-D-glucopyranosyloxy]-3-[6-O-[(E)-3-(4-hydroxyphenyl)propenoyl]-2-O-[2-O-[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)propenoyl]-beta-D-xylopyranosyl]-beta-D-glucopyranosyloxy]-1-benzopyrylium
Common Name	Pelargonidin 3-(6"-p-coumaryl-2"'-sinapylsambubioside)-5-glucoside 7-Hydroxy-2-(4-hydroxyphenyl)-5-[beta-D-glucopyranosyloxy]-3-[6-O-[(E)-3-(4-hydroxyphenyl)propenoyl]-2-O-[2-O-[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)propenoyl]-beta-D-xylopyranosyl]-beta-D-glucopyranosyloxy]-1-benzopyrylium
Symbol
Formula	C52H55O25
Exact Mass	1079.3032423099999
Average Mass	1079.9780999999998
SMILES	`c(c8)c(ccc8O)C=CC(OCC(C(O)5)OC(C(OC(O7)C(C(O)C(C7)O)OC(=O)C=Cc(c6)cc(c(O)c6OC)OC)C5O)Oc(c4)c([o+1]c(c42)cc(O)cc2OC(C3O)OC(CO)C(C(O)3)O)c(c1)ccc(c1)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
Matthiola incana	FL7AAAGL0043	See above.	Saito_N et al. 1996

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 {{Metabolite
 |SysName=7-Hydroxy-2-(4-hydroxyphenyl)-5-[beta-D-glucopyranosyloxy]-3-[6-O-[(E)-3-(4-hydroxyphenyl)propenoyl]-2-O-[2-O-[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)propenoyl]-beta-D-xylopyranosyl]-beta-D-glucopyranosyloxy]-1-benzopyrylium
-|Common Name=&&Pelargonidin 3-(6"-p-coumaryl-2"'-sinapylsambubioside)-5-glucoside&&
+|Common Name=&&Pelargonidin 3-(6"-p-coumaryl-2"'-sinapylsambubioside)-5-glucoside&&7-Hydroxy-2-(4-hydroxyphenyl)-5-[beta-D-glucopyranosyloxy]-3-[6-O-[(E)-3-(4-hydroxyphenyl)propenoyl]-2-O-[2-O-[(E)-3-(3,5-dimethoxy-4-hydroxyphenyl)propenoyl]-beta-D-xylopyranosyl]-beta-D-glucopyranosyloxy]-1-benzopyrylium&&
 |CAS=175738-03-1
 |KNApSAcK=C00006782
 }}