FL7AACGA0017

Flavonoid Top

Molecule Index

Author Index

Journals

Structure Search

Food

New Input

Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAC Cyanidin (170 pages) :  FL7AACGA Anthocyanin (3-Galactoside related) (20 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	1392667-16-1
KEGG	{{{KEGG}}}
KNApSAcK	[3]
CDX file
MOL file	FL7AACGA0017.mol

3- [ [6-O- (2-Carboxyacetyl) -2-O- [2-O- [ (2E) -3- (3,4-dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- (3,4-dihydroxyphenyl) -5,7-dihydroxy-1-benzopyrylium
Structural Information
Systematic Name	3- [ [6-O- (2-Carboxyacetyl) -2-O- [2-O- [ (2E) -3- (3,4-dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- (3,4-dihydroxyphenyl) -5,7-dihydroxy-1-benzopyrylium
Common Name	3- [ [6-O- (2-Carboxyacetyl) -2-O- [2-O- [ (2E) -3- (3,4-dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- (3,4-dihydroxyphenyl) -5,7-dihydroxy-1-benzopyrylium
Symbol
Formula	C39H39O22
Exact Mass	859.193297932
Average Mass	859.7137600000001
SMILES	C(C(C3O)OC(Oc(c4)c(c(c6)ccc(O)c6O)[o+1]c(c5)c4c(cc(O)5)O)C(C3O)OC(C1OC(=O)C=Cc(c2)ccc(c2O)O)OC(C(O)C1O)CO)OC(CC(O)=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 Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Clematis cultivars FL7AACGA0017 See above. Hashimoto_M et al. 2011