FL7AACGA0019

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	1392667-27-4
KEGG	{{{KEGG}}}
KNApSAcK	[3]
CDX file
MOL file	FL7AACGA0019.mol

3- [ [2-O- [2-O- [ (2E) -3- (3,4-Dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- [3- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -5,7-dihydroxy-1-benzopyrylium
Structural Information
Systematic Name	3- [ [2-O- [2-O- [ (2E) -3- (3,4-Dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- [3- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -5,7-dihydroxy-1-benzopyrylium
Common Name	3- [ [2-O- [2-O- [ (2E) -3- (3,4-Dihydroxyphenyl) -1-oxo-2-propen-1-yl] -beta-D-glucopyranosyl] -beta-D-galactopyranosyl] oxy] -2- [3- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -5,7-dihydroxy-1-benzopyrylium
Symbol
Formula	C42H45O25
Exact Mass	949.22499199
Average Mass	949.7917
SMILES	c(c1O)c(C=CC(OC(C(OC(C3Oc(c7)c([o+1]c(c76)cc(cc6O)O)c(c4)ccc(O)c4OC(O5)C(O)C(C(O)C(C(O)=O)5)O)C(C(C(O3)CO)O)O)2)C(C(O)C(O2)CO)O)=O)ccc1O
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 FL7AACGA0019 See above. Hashimoto_M et al. 2011