FL7AAGGL0036

Revision as of 09:00, 15 May 2008

Delphinidin 3,5-diglucoside-6"-O-4, 6"'-O-1-cyclic-malyl diester

Structural Information
Systematic Name	2-(3,4,5-Trihydroxyphenyl)-3,5-[2-hydroxy-1,4-dioxobutane-1,4-diylbis(oxymethylene)bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxytetrahydro-2H-pyran]-6,2-diyloxy]]-7-hydroxy-1-benzopyrylium
Common Name	Delphinidin 3,5-diglucoside-6"-O-4, 6"'-O-1-cyclic-malyl diester 2-(3,4,5-Trihydroxyphenyl)-3,5-[2-hydroxy-1,4-dioxobutane-1,4-diylbis(oxymethylene)bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxytetrahydro-2H-pyran]-6,2-diyloxy]]-7-hydroxy-1-benzopyrylium
Symbol
Formula	C31H33O20
Exact Mass	725.156518496
Average Mass	725.58172
SMILES	`OC(C63)C(O)C(O)C(O6)Oc(c2)c([o+1]c(c5)c(c(cc5O)OC(C(O)4)OC(C(C4O)O)COC(C(CC(=O)OC3)O)=O)2)c(c1)cc(O)c(c1O)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-Flavonoid Relationship Reported

Species	ID	Metabolite Name	Reference
Dianthus caryophyllus	FL7AAGGL0036	See above.	Fukui_Y et al. 2003

@@ Line 1: / Line 1: @@
 {{Metabolite
 |SysName=2-(3,4,5-Trihydroxyphenyl)-3,5-[2-hydroxy-1,4-dioxobutane-1,4-diylbis(oxymethylene)bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxytetrahydro-2H-pyran]-6,2-diyloxy]]-7-hydroxy-1-benzopyrylium
-|Common Name=&&Delphinidin 3,5-diglucoside-6"-O-4, 6"'-O-1-cyclic-malyl diester&&
+|Common Name=&&Delphinidin 3,5-diglucoside-6"-O-4, 6"'-O-1-cyclic-malyl diester&&2-(3,4,5-Trihydroxyphenyl)-3,5-[2-hydroxy-1,4-dioxobutane-1,4-diylbis(oxymethylene)bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxytetrahydro-2H-pyran]-6,2-diyloxy]]-7-hydroxy-1-benzopyrylium&&
 |CAS=-
 |KNApSAcK=C00011192
 }}