FL7AACGL0061

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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	163812-24-6
KEGG	{{{KEGG}}}
KNApSAcK	C00006837
CDX file
MOL file	FL7AACGL0061.mol

Cyanidin 3- (6"-ferulyl-2"'-sinapylsambubioside) -5-glucoside
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-ferulyl-2"'-sinapylsambubioside) -5-glucoside
Common Name	Cyanidin 3- (6"-ferulyl-2"'-sinapylsambubioside) -5-glucoside 3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-ferulyl-2"'-sinapylsambubioside) -5-glucoside
Symbol
Formula	C53H57O27
Exact Mass	1125.308721618
Average Mass	1126.0034799999999
SMILES	c(c(O)1)cc(c(c(OC(O5)C(OC(O8)C(C(O)C(C8)O)OC(=O)C=Cc(c7)cc(c(O)c(OC)7)OC)C(C(C5COC(=O)C=Cc(c6)ccc(O)c(OC)6)O)O)2)[o+1]c(c4)c(c(cc4O)OC(O3)C(C(C(O)C3CO)O)O)c2)cc(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 Matthiola incana FL7AACGL0061 See above. Saito_N et al. 1995