FL7AAGGL0027

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Upper classes : FL Flavonoid : FL7 Anthocyani(di)n : FL7A Anthocyani(di)n :  FL7AAG Delphinidin (107 pages) :  FL7AAGGL Anthocyanin (3-Glucoside related) (75 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	176260-02-9
KEGG	{{{KEGG}}}
KNApSAcK	C00006892
CDX file
MOL file	FL7AAGGL0027.mol

Delphinidin 3- (6",6"'-di-p-coumarylsophoroside) -5- (6-malonylglucoside)
Structural Information
Systematic Name	3,5,7,3',4',5'-Hexahydroxyflavylium 3- (6",6"'-di-p-coumarylsophoroside) -5- (6-malonylglucoside)
Common Name	Delphinidin 3- (6",6"'-di-p-coumarylsophoroside) -5- (6-malonylglucoside) 3,5,7,3',4',5'-Hexahydroxyflavylium 3- (6",6"'-di-p-coumarylsophoroside) -5- (6-malonylglucoside)
Symbol
Formula	C54H55O29
Exact Mass	1167.282900798
Average Mass	1167.9971
SMILES	[C@H]([C@@H](O)1)(Oc(c8)c(c3)c(cc8O)[o+1]c(c(O[C@H](O6)C(C([C@@H](O)[C@@H](COC(=O)C=Cc(c7)ccc(O)c7)6)O)O[C@H]([C@H](O)4)OC(COC(=O)C=Cc(c5)ccc(O)c5)[C@H]([C@H]4O)O)3)c(c2)cc(c(O)c2O)O)OC([C@H](O)[C@@H]1O)COC(CC(O)=O)=O
Physicochemical Information
Melting Point
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Density
Optical Rotation
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Spectral Information
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Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Ajuga reptans FL7AAGGL0027 See above. Terahara_N et al. 1996