FL63AGNS0001

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	989-51-5
KEGG	{{{KEGG}}}
KNApSAcK	C00000958
CDX file
MOL file	FL63AGNS0001.mol

epi-Gallocatechin 3-O-gallate
Structural Information
Systematic Name	(2R-cis)-3,4-Dihydro-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid
Common Name	epi-Gallocatechin 3-O-gallate (-)-Epigallocatechin gallate (2R-cis)-3,4-Dihydro-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3-yl ester 3,4,5-trihydroxybenzoic acid
Symbol
Formula	C22H18O11
Exact Mass	458.084911418
Average Mass	458.37172000000004
SMILES	C(c32)C([H])(OC(c(c4)cc(O)c(O)c(O)4)=O)C(Oc(cc(O)cc3O)2)(c(c1)cc(O)c(O)c(O)1)[H]
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 Acacia pycnantha FL63AGNS0001 See above. Bradfield_AE et al. 1948 Cistus salviifolius FL63AGNS0001 See above. Bradfield_AE et al. 1948 Mallotus japonicus FL63AGNS0001 See above. Bradfield_AE et al. 1948 Myrica esculenta FL63AGNS0001 See above. Bradfield_AE et al. 1948 Sedum sediforme FL63AGNS0001 See above. Bradfield_AE et al. 1948 Stryphnodendron adstringens FL63AGNS0001 See above. Bradfield_AE et al. 1948 Syzygium samarangense FL63AGNS0001 See above. Bradfield_AE et al. 1948 Vitis vinifera FL63AGNS0001 See above. Bradfield_AE et al. 1948 Hamamelis virginiana FL63AGNS0001 See above. Friedrich_H et al. 1974 Camellia sinensis FL63AGNS0001 See above. Kada_T et al. 1985 Cistus incanus FL63AGNS0001 See above. Petereit_F et al. 1991 Davidsonia pruriens FL63AGNS0001 See above. Wilkins_CK et al. 1977