FL63ACNS0022

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	108907-45-5
KEGG	{{{KEGG}}}
KNApSAcK	C00008896
CDX file
MOL file	FL63ACNS0022.mol

Epicatechin 3-O-p-hydroxybenzoate
Structural Information
Systematic Name	(2R,3R) -3,5,7,3',4'-Pentahydroxyflavan 3-O-p-hydroxybenzoate
Common Name	Epicatechin 3-O-p-hydroxybenzoate (2R,3R) -3,5,7,3',4'-Pentahydroxyflavan 3-O-p-hydroxybenzoate
Symbol
Formula	C22H18O8
Exact Mass	410.100167552
Average Mass	410.37352000000004
SMILES	C(C2)(OC(=O)c(c4)ccc(c4)O)C(Oc(c3)c2c(O)cc(O)3)c(c1)ccc(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 Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Camellia sinensis var. assamica FL63ACNS0022 See above. Hashimoto_F et al. 1987