FL7AACGL0054

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	-
KEGG	{{{KEGG}}}
KNApSAcK	C00006825
CDX file
MOL file	FL7AACGL0054.mol

Cyanidin 3-(6"-caffeylglucoside)-5-(6"'-malonylglucoside)
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3-(6"-caffeylglucoside)-5-(6"'-malonylglucoside)
Common Name	Cyanidin 3-(6"-caffeylglucoside)-5-(6"'-malonylglucoside) 3,5,7,3',4'-Pentahydroxyflavylium 3-(6"-caffeylglucoside)-5-(6"'-malonylglucoside)
Symbol
Formula	C39H39O22
Exact Mass	859.193297932
Average Mass	859.7137600000001
SMILES	O(C(O6)C(O)C(O)C(O)C6COC(CC(O)=O)=O)c(c1)c(c2)c([o+1]c(c(c5)cc(c(c5)O)O)c2OC(O3)C(C(C(C(COC(C=Cc(c4)ccc(O)c4O)=O)3)O)O)O)cc1O
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 Perilla ocimoides FL7AACGL0054 See above. Tomas-Barberan_FA et al. 1987 Salvia coccinea FL7AACGL0054 See above. Tomas-Barberan_FA et al. 1987 Perilla ocimoides FL7AACGL0054 See above. Yoshida_K et al. 1990 Salvia coccinea FL7AACGL0054 See above. Yoshida_K et al. 1990