FL7AAGGL0056

Revision as of 09:00, 25 July 2008

Ternatin C4

Structural Information
Systematic Name	3- [ [ 6-O- (3-Hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -3'- [ [ 6-O- [ 4- (beta-D-glucopyranosyloxy) -trans-cinnamoyl ] -beta-D-glucopyranosyl ] oxy ] -5'- [ (beta-D-glucopyranosyl) oxy ] -4',5,7-trihydroxyflavylium
Common Name	Ternatin C4 3- [ [ 6-O- (3-Hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -3'- [ [ 6-O- [ 4- (beta-D-glucopyranosyloxy) -trans-cinnamoyl ] -beta-D-glucopyranosyl ] oxy ] -5'- [ (beta-D-glucopyranosyl) oxy ] -4',5,7-trihydroxyflavylium
Symbol
Formula	C51H59O32
Exact Mass	1183.298944792
Average Mass	1183.99496
SMILES	`O(C(Oc(c8)ccc(c8)C=CC(OCC(O2)C(O)C(C(C(Oc(c(O)3)cc(c(c6OC(O7)C(O)C(C(C7COC(=O)CC(O)=O)O)O)[o+1]c(c(c6)5)cc(O)cc(O)5)cc3OC(C4O)OC(CO)C(C(O)4)O)2)O)O)=O)1)C(C(O)C(O)C1O)CO`
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
Clitoria ternatea	FL7AAGGL0056	See above.	Terahara_N et al. 1998

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 {{Metabolite
-|SysName=3-[[6-O-(3-Hydroxy-1,3-dioxopropyl)-beta-D-glucopyranosyl]oxy]-3'-[[6-O-[4-(beta-D-glucopyranosyloxy)-trans-cinnamoyl]-beta-D-glucopyranosyl]oxy]-5'-[(beta-D-glucopyranosyl)oxy]-4',5,7-trihydroxyflavylium
+|SysName=3- [ [ 6-O- (3-Hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -3'- [ [ 6-O- [ 4- (beta-D-glucopyranosyloxy) -trans-cinnamoyl ] -beta-D-glucopyranosyl ] oxy ] -5'- [ (beta-D-glucopyranosyl) oxy ] -4',5,7-trihydroxyflavylium
-|Common Name=&&Ternatin C4&&3-[[6-O-(3-Hydroxy-1,3-dioxopropyl)-beta-D-glucopyranosyl]oxy]-3'-[[6-O-[4-(beta-D-glucopyranosyloxy)-trans-cinnamoyl]-beta-D-glucopyranosyl]oxy]-5'-[(beta-D-glucopyranosyl)oxy]-4',5,7-trihydroxyflavylium&&
+|Common Name=&&Ternatin C4&&3- [ [ 6-O- (3-Hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] -3'- [ [ 6-O- [ 4- (beta-D-glucopyranosyloxy) -trans-cinnamoyl ] -beta-D-glucopyranosyl ] oxy ] -5'- [ (beta-D-glucopyranosyl) oxy ] -4',5,7-trihydroxyflavylium&&
 |CAS=215378-77-1
 |KNApSAcK=C00014807
 }}