FL7AACGL0101

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{{Metabolite
 
{{Metabolite
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|SysName=3,5,7,3',4'-Pentahydroxyflavylium 3-O-[2-O-(6-O-(trans-3-O-(beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranosyl)-6-O-(trans-4-O-(6-O-(trans-caffeyl)-beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranoside]-5-O-[beta-D-glucopyranoside]
+
|SysName=3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ]  
−
|Common Name=&&Cyanidin 3-O-[2-O-(6-O-(trans-3-O-(beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranosyl)-6-O-(trans-4-O-(6-O-(trans-caffeyl)-beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranoside]-5-O-[beta-D-glucopyranoside]&&3,5,7,3',4'-Pentahydroxyflavylium 3-O-[2-O-(6-O-(trans-3-O-(beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranosyl)-6-O-(trans-4-O-(6-O-(trans-caffeyl)-beta-D-glucopyranosyl)caffeyl)-beta-D-glucopyranoside]-5-O-[beta-D-glucopyranoside]&&
+
|Common Name=&&Cyanidin 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ] &&3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ] &&
 
|CAS=756795-04-7
 
|CAS=756795-04-7
 
|KNApSAcK=C00011110
 
|KNApSAcK=C00011110
 
}}
 
}}

Revision as of 09:00, 25 July 2008


IDs and Links
LipidBank [1]
LipidMaps [2]
CAS 756795-04-7
KEGG {{{KEGG}}}
KNApSAcK

C00011110

CDX file
MOL file FL7AACGL0101.mol
Cyanidin 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ]
FL7AACGL0101.png
Structural Information
Systematic Name 3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ]
Common Name
  • Cyanidin 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ]
  • 3,5,7,3',4'-Pentahydroxyflavylium 3-O- [ 2-O- (6-O- (trans-3-O- (beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranosyl) -6-O- (trans-4-O- (6-O- (trans-caffeyl) -beta-D-glucopyranosyl) caffeyl) -beta-D-glucopyranoside ] -5-O- [ beta-D-glucopyranoside ]
Symbol
Formula C72H79O40
Exact Mass 1583.414762408
Average Mass 1584.37366
SMILES c(O)(c(O)%11)cc(cc%11)c(c1O[C@@H]([C@H]4O[C@H](O8)C(O)C(O)[C@@H](O)[C@@H](COC(C=Cc(c%10)cc(c(O)c%10)O[C@H](O9)C(O)C([C@H]([C@@H](CO)9)O)O)=O)8)OC(COC(=O)C=Cc(c7)cc(c(c7)O[C@H](O5)[C@@H](O)[C@H]([C@H](C5COC(C=Cc(c6)ccc(O)c(O)6)=O)O)O)O)[C@@H]([C@@H]4O)O)[o+1]c(c2)c(c(O[C@H](O3)[C@H]([C@H]([C@@H](O)C3CO)O)O)cc2O)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

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