FL7AAIGL0036

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Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAI Malvidin (52 pages) :  FL7AAIGL Anthocyanin (3-Glucoside related) (40 pages) :  FL7AAIGL0 Normal (38 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	249514-65-6
KEGG	{{{KEGG}}}
KNApSAcK	C00014826
CDX file
MOL file	FL7AAIGL0036.mol

Malvidin 3-O- [ 6-O- (4-O- (4-O- (6-O- (trans-caffeoyl) -beta-D-glucopyranosyl) -trans-p-coumaroyl) -alpha-L-rhamnopyranosyl) -beta-D-glucopyranoside ]
Structural Information
Systematic Name	3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavylium 3-O- [ 6-O- (4-O- (4-O- (6-O- (trans-caffeoyl) -beta-D-glucopyranosyl) -trans-p-coumaroyl) -alpha-L-rhamnopyranosyl) -beta-D-glucopyranoside ]
Common Name	Malvidin 3-O- [ 6-O- (4-O- (4-O- (6-O- (trans-caffeoyl) -beta-D-glucopyranosyl) -trans-p-coumaroyl) -alpha-L-rhamnopyranosyl) -beta-D-glucopyranoside ] 3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavylium 3-O- [ 6-O- (4-O- (4-O- (6-O- (trans-caffeoyl) -beta-D-glucopyranosyl) -trans-p-coumaroyl) -alpha-L-rhamnopyranosyl) -beta-D-glucopyranoside ]
Symbol
Formula	C53H57O26
Exact Mass	1109.313806996
Average Mass	1110.00408
SMILES	C(c(c8)ccc(O)c8O)=CC(=O)OCC(C(O)7)OC(C(O)C7O)Oc(c1)ccc(C=CC(=O)OC(C(C)2)C(C(C(OCC(O3)C(C(C(O)C3Oc(c6)c([o+1]c(c65)cc(O)cc5O)c(c4)cc(OC)c(O)c(OC)4)O)O)O2)O)O)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 Petunia integrifolia subsp. inflata FL7AAIGL0036 See above. Tatsuzawa_F et al. 1999