FL5FFAGS0028

Flavonoid Top

Molecule Index

Author Index

Journals

Structure Search

Food

New Input

Upper classes : FL Flavonoid : FL5 Flavonol :  FL5FFA Herbacetin and O-methyl derivatives (70 pages) :  FL5FFAGS O-Glycoside (Without 3-glycoside and 3-galactoside related) (27 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	190328-85-9
KEGG	{{{KEGG}}}
KNApSAcK	C00013831
CDX file
MOL file	FL5FFAGS0028.mol

Herbacetin 7-methyl ether 3- (2"- (E) -feruloylglucoside)
Structural Information
Systematic Name	5,8-Dihydroxy-3- [ [ 2-O- [ (2E) -3- (4-hydroxy-3-methoxyphenyl) -1-oxo-2-propenyl ] -beta-D-glucopyranosyl ] oxy ] -2- (4-hydroxyphenyl) -7-methoxy-4H-1-benzopyran-4-one
Common Name	Herbacetin 7-methyl ether 3- (2"- (E) -feruloylglucoside) 5,8-Dihydroxy-3- [ [ 2-O- [ (2E) -3- (4-hydroxy-3-methoxyphenyl) -1-oxo-2-propenyl ] -beta-D-glucopyranosyl ] oxy ] -2- (4-hydroxyphenyl) -7-methoxy-4H-1-benzopyran-4-one
Symbol
Formula	C32H30O15
Exact Mass	654.15847029
Average Mass	654.5716
SMILES	OC(C2O)C(C(OC(=C(c(c5)ccc(O)c5)3)C(c(c4O)c(c(c(OC)c4)O)O3)=O)OC(CO)2)OC(=O)C=Cc(c1)cc(OC)c(O)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

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Ranunculus sardous FL5FFAGS0028 See above. Markham_KR et al. 1997