FL7AACGL0094

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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	-
KEGG	{{{KEGG}}}
KNApSAcK	C00011084
CDX file
MOL file	FL7AACGL0094.mol

Cyanidin 3-O- [ 6-O- (malonyl) -beta-D-glucopyranoside ] -7-O- [ 6-O- (trans-p-coumaryl) -beta-D-glucopyranoside ] -3'-O- [ 6-O- (trans-4-O- (6-O- (trans-4-O- (beta-D-glucopyranosyl) -p-coumaryl) -beta-D-glucopyranoside ]
Structural Information
Systematic Name	3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 6-O- (malonyl) -beta-D-glucopyranoside ] -7-O- [ 6-O- (trans-p-coumaryl) -beta-D-glucopyranoside ] -3'-O- [ 6-O- (trans-4-O- (6-O- (trans-4-O- (beta-D-glucopyranosyl) -p-coumaryl) -beta-D-glucopyranoside ]
Common Name	Cyanidin 3-O- [ 6-O- (malonyl) -beta-D-glucopyranoside ] -7-O- [ 6-O- (trans-p-coumaryl) -beta-D-glucopyranoside ] -3'-O- [ 6-O- (trans-4-O- (6-O- (trans-4-O- (beta-D-glucopyranosyl) -p-coumaryl) -beta-D-glucopyranoside ] 3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 6-O- (malonyl) -beta-D-glucopyranoside ] -7-O- [ 6-O- (trans-p-coumaryl) -beta-D-glucopyranoside ] -3'-O- [ 6-O- (trans-4-O- (6-O- (trans-4-O- (beta-D-glucopyranosyl) -p-coumaryl) -beta-D-glucopyranoside ]
Symbol
Formula	C75H81O40
Exact Mass	1621.430412472
Average Mass	1622.42164
SMILES	Oc(c1)c(OC(C(O)7)OC(COC(C=Cc(c8)ccc(OC(C%11O)OC(C(O)C%11O)COC(C=Cc(c9)ccc(OC(O%10)C(C(C(O)C%10CO)O)O)c9)=O)c8)=O)C(O)C7O)cc(c(c(OC(O6)C(O)C(O)C(C(COC(=O)CC(=O)O)6)O)5)[o+1]c(c2c5)cc(OC(C4O)OC(C(C(O)4)O)COC(=O)C=Cc(c3)ccc(c3)O)cc(O)2)c1
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 Bletilla striata FL7AACGL0094 See above. Saito_N et al. 1995