FL7AAGGL0060

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	104078-08-2
KEGG	{{{KEGG}}}
KNApSAcK	C00014811
CDX file
MOL file	FL7AAGGL0060.mol

Delphinidin 3- (6-malonylglucoside) -5-glucoside
Structural Information
Systematic Name	3',4',5',7-Tetrahydroxy-3- [ [ 6-O- (3-hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) flavylium
Common Name	Delphinidin 3- (6-malonylglucoside) -5-glucoside 3',4',5',7-Tetrahydroxy-3- [ [ 6-O- (3-hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) flavylium
Symbol
Formula	C30H33O20
Exact Mass	713.156518496
Average Mass	713.5710200000001
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(O3)C(O)C(C(C3COC(CC(O)=O)=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 FL7AAGGL0060 See above. Fukui_Y et al. 2003 Cichorium intybus FL7AAGGL0060 See above. NOrbaek_R et al. 2002