FL63AGNS0015

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	159390-94-0
KEGG	{{{KEGG}}}
KNApSAcK	C00008902
CDX file
MOL file	FL63AGNS0015.mol

Epigallocatechin 3-O-(4-hydroxybenzoate)
Structural Information
Systematic Name	(2R,3R)-3,5,7,3',4',5'-Hexahydroxyflavan 3-O-(4-hydroxybenzoate)
Common Name	Epigallocatechin 3-O-(4-hydroxybenzoate)
Symbol
Formula	C22H18O9
Exact Mass	426.095082174
Average Mass	426.37292
SMILES	c(c1)(O)cc(O3)c(CC(C(c(c4)cc(O)c(O)c(O)4)3)OC(=O)c(c2)ccc(c2)O)c(O)1
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 Cistus salviifolius FL63AGNS0015 See above. Danne_A et al. 1994