FL7AACGL0074

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Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAC Cyanidin (170 pages) :  FL7AACGL Anthocyanin (3-Glucoside related) (132 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	145815-06-1
KEGG	{{{KEGG}}}
KNApSAcK	C00006850
CDX file
MOL file	FL7AACGL0074.mol

Cyanidin 3- (6"-caffeyl-6"'-ferulylsophoroside) -5-glucoside
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-caffeyl-6"'-ferulylsophoroside) -5-glucoside
Common Name	Cyanidin 3- (6"-caffeyl-6"'-ferulylsophoroside) -5-glucoside 3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-caffeyl-6"'-ferulylsophoroside) -5-glucoside
Symbol
Formula	C52H55O27
Exact Mass	1111.2930715539999
Average Mass	1111.9769
SMILES	Oc(c8)cc(c(c86)cc(c(c(c7)cc(O)c(c7)O)[o+1]6)O[C@H](O2)C(O[C@H]([C@@H]4O)OC(COC(=O)C=Cc(c5)cc(OC)c(c5)O)[C@@H](O)[C@H]4O)C(O)[C@H]([C@H]2COC(=O)C=Cc(c3)ccc(O)c3O)O)O[C@H](O1)[C@H]([C@@H](O)[C@@H](O)C1CO)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 Ipomoea batatas FL7AACGL0074 See above. Odake_K et al. 1992 Raphanus sativus FL7AACGL0074 See above. Otsuki_T et al. 2002