FL7AAGGL0035

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	592522-38-8
KEGG	{{{KEGG}}}
KNApSAcK	C00011191
CDX file
MOL file	FL7AAGGL0035.mol

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 Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Dianthus caryophyllus FL7AAGGL0035 See above. Fukui_Y et al. 2003