FL5FAAGS0099

Revision as of 09:00, 25 July 2008

Kaempferol 3-sophoroside-7-cellobioside

Structural Information
Systematic Name	3- [ (2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl) oxy ] -7- [ (4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl) oxy ] -5-hydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one
Common Name	Kaempferol 3-sophoroside-7-cellobioside 3- [ (2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl) oxy ] -7- [ (4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl) oxy ] -5-hydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one
Symbol
Formula	C39H50O26
Exact Mass	934.2590317720001
Average Mass	934.7987
SMILES	`O(C(C7CO)C(O)C(O)C(O7)Oc(c6)cc(c(c65)C(=O)C(=C(O5)c(c4)ccc(O)c4)OC(O3)C(C(C(O)C(CO)3)O)OC(C2O)OC(CO)C(C(O)2)O)O)C(C(O)1)OC(CO)C(C(O)1)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
Brassica oleracea	FL5FAAGS0099	See above.	Nielsen_JK et al. 1998

@@ Line 1: / Line 1: @@
 {{Metabolite
-|SysName=3-[(2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-7-[(4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
+|SysName=3- [ (2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl) oxy ] -7- [ (4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl) oxy ] -5-hydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one
-|Common Name=&&Kaempferol 3-sophoroside-7-cellobioside&&3-[(2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-7-[(4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one&&
+|Common Name=&&Kaempferol 3-sophoroside-7-cellobioside&&3- [ (2-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl) oxy ] -7- [ (4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl) oxy ] -5-hydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one&&
 |CAS=220342-42-7
 |KNApSAcK=C00013766
 }}