FL7AACGL0068

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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	107500-82-3,29013-15-8
KEGG	{{{KEGG}}}
KNApSAcK	C00006844
CDX file
MOL file	FL7AACGL0068.mol

Cyanidin 3- (6"-ferulylsophoroside) -5-glucoside
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-ferulylsophoroside) -5-glucoside
Common Name	Cyanidin 3- (6"-ferulylsophoroside) -5-glucoside 3,5,7,3',4'-Pentahydroxyflavylium 3- (6"-ferulylsophoroside) -5-glucoside
Symbol
Formula	C43H49O24
Exact Mass	949.261377496
Average Mass	949.83476
SMILES	[C@@H](C(COC(=O)C=Cc(c7)ccc(c7OC)O)1)(O)[C@@H](O)[C@@H](O[C@H](O6)[C@@H](O)[C@H]([C@@H](O)C6CO)O)[C@@H](Oc(c2)c(c(c5)ccc(c(O)5)O)[o+1]c(c4)c(c(cc4O)O[C@@H]([C@@H](O)3)OC([C@@H]([C@@H]3O)O)CO)2)O1
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 Brassica oleracea FL7AACGL0068 See above. Hrazdina_G et al. 1977 Brassica oleracea FL7AACGL0068 See above. Idaka_E et al. 1987