FL7AAAGL0052

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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	-
KEGG	{{{KEGG}}}
KNApSAcK	C00011089
CDX file
MOL file	FL7AAAGL0052.mol

Pelargonidin 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O-trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) caffeyl) -D-glucopyranoside ] ] -5-O- [ beta-D-glucopyranoside ]
Structural Information
Systematic Name	3,5,7,4'-Tetrahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O-trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) caffeyl) -D-glucopyranoside ] ] -5-O- [ beta-D-glucopyranoside ]
Common Name	Pelargonidin 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O-trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) caffeyl) -D-glucopyranoside ] ] -5-O- [ beta-D-glucopyranoside ] 3,5,7,4'-Tetrahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O-trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) caffeyl) -D-glucopyranoside ] ] -5-O- [ beta-D-glucopyranoside ]
Symbol
Formula	C78H89O44
Exact Mass	1729.472671216
Average Mass	1730.51486
SMILES	C(C(O)1)(C(O)C(COC(=O)C=Cc(c%11)ccc(O)c(OC(C(O)%12)OC(CO)C(O)C(O)%12)%11)OC1OC(C%10O)C(OC(C(O)%10)COC(C=Cc(c9)cc(c(c9)OC(C6O)OC(COC(C=Cc(c7)ccc(c(OC(C8O)OC(C(C(O)8)O)CO)7)O)=O)C(C(O)6)O)O)=O)Oc(c2)c(c(c5)ccc(c5)O)[o+1]c(c3)c2c(OC(C(O)4)OC(C(O)C(O)4)CO)cc3O)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 Ipomoea nil FL7AAAGL0052 See above. Lu_TS et al. 1992