FL7AAAGL0040

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Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAA Pelargonidin (96 pages) :  FL7AAAGL Anthocyanin (3-Glucoside related) (75 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	165070-67-7
KEGG	{{{KEGG}}}
KNApSAcK	C00006779
CDX file
MOL file	FL7AAAGL0040.mol

Pelargonidin 3- (6"-malonylglucoside) -7- (6"'-caffeylglucoside)
Structural Information
Systematic Name	3,5,7,4'-Tetrahydroxyflavylium 3- (6"-malonylglucoside) -7- (6"'-caffeylglucoside)
Common Name	Pelargonidin 3- (6"-malonylglucoside) -7- (6"'-caffeylglucoside) 3,5,7,4'-Tetrahydroxyflavylium 3- (6"-malonylglucoside) -7- (6"'-caffeylglucoside)
Symbol
Formula	C39H39O21
Exact Mass	843.19838331
Average Mass	843.7143599999999
SMILES	C(C(=O)OCC(O2)C(O)C(C(C2Oc(c3)cc(c(c5)c3[o+1]c(c5OC(C6O)OC(COC(=O)CC(O)=O)C(O)C6O)c(c4)ccc(O)c4)O)O)O)=Cc(c1)ccc(O)c1O
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 Senecio cruentus FL7AAAGL0040 See above. Toki_K et al. 1995