FL7AACGA0020

トップ

化合物検索

著者索引

雑誌索引

構造検索

食品情報

新規入力

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	1392667-32-1
KEGG	{{{KEGG}}}
KNApSAcK	[3]
CDX file
MOL file	FL7AACGA0020.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- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -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- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -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- (beta-D-glucopyranuronosyloxy) -4-hydroxyphenyl] -5,7-dihydroxy-1-benzopyrylium
Symbol
Formula	C45H47O28
Exact Mass	1035.22538592
Average Mass	1035.83788
SMILES	O(C1Oc(c6)c([o+1]c(c7)c6c(cc(O)7)O)c(c4)ccc(O)c4OC(O5)C(O)C(C(C5C(O)=O)O)O)C(COC(CC(O)=O)=O)C(C(C(OC(C(OC(=O)C=Cc(c3)ccc(O)c(O)3)2)OC(CO)C(O)C2O)1)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 FL7AACGA0020 See above. Hashimoto_M et al. 2011