FL7AACGL0042

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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	68156-54-7
KEGG	{{{KEGG}}}
KNApSAcK	C00006812
CDX file
MOL file	FL7AACGL0042.mol

Cyanidin 3- (4"'-caffeylrutinoside)
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3- (4"'-caffeylrutinoside)
Common Name	Cyanidin 3- (4"'-caffeylrutinoside) 3,5,7,3',4'-Pentahydroxyflavylium 3- (4"'-caffeylrutinoside)
Symbol
Formula	C36H37O18
Exact Mass	757.1979893800001
Average Mass	757.66818
SMILES	c(c6O)c(O)c(c2c6)cc(OC(O3)C(O)C(C(O)C3COC(C4O)OC(C)C(OC(C=Cc(c5)ccc(c(O)5)O)=O)C4O)O)c([o+1]2)c(c1)cc(O)c(c1)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 Silene dioica FL7AACGL0042 See above. Kamsteeg._J et al. 1978