FL63ACNS0006

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Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol :  FL63AC Catechin and Epicatechin (75 pages) :  FL63ACNS Simple substitution (24 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	1257-08-5
KEGG	{{{KEGG}}}
KNApSAcK	C00008866
CDX file
MOL file	FL63ACNS0006.mol

(-)-Epicatechin 3-O-gallate
Structural Information
Systematic Name	(2R,3R) -2- (3,4-Dihydroxyphenyl) -5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl-3,4,5-trihydroxybenzoate
Common Name	(-)-Epicatechin 3-O-gallate ECG 3-O-Galloylepicatechin (2R) -3,4-Dihydro-2alpha- (3,4-dihydroxyphenyl) -2H-1-benzopyran-3alpha,5,7-triol 3- (3,4,5-trihydroxybenzoate)
Symbol
Formula	C22H18O10
Exact Mass	442.089996796
Average Mass	442.37232000000006
SMILES	Oc(c(O)1)cc(C(=O)OC(C3)C(Oc(c4)c3c(O)cc(O)4)c(c2)ccc(c2O)O)cc(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 Acacia pycnantha FL63ACNS0006 See above. Bradfield_AE et al. 1948 Camellia sinensis FL63ACNS0006 See above. Bradfield_AE et al. 1948 Cistus salviifolius FL63ACNS0006 See above. Bradfield_AE et al. 1948 Davidsonia pruriens FL63ACNS0006 See above. Bradfield_AE et al. 1948 Hamamelis virginiana FL63ACNS0006 See above. Bradfield_AE et al. 1948 Myrica rubra FL63ACNS0006 See above. Bradfield_AE et al. 1948 Rheum sp. FL63ACNS0006 See above. Bradfield_AE et al. 1948 Sedum sediforme FL63ACNS0006 See above. Bradfield_AE et al. 1948 Syzygium samarangense FL63ACNS0006 See above. Bradfield_AE et al. 1948 Vitis vinifera FL63ACNS0006 See above. Bradfield_AE et al. 1948 Acacia pycnantha FL63ACNS0006 See above. Weinges_K et al. 1971 Camellia sinensis FL63ACNS0006 See above. Weinges_K et al. 1971 Cistus salviifolius FL63ACNS0006 See above. Weinges_K et al. 1971 Davidsonia pruriens FL63ACNS0006 See above. Weinges_K et al. 1971 Hamamelis virginiana FL63ACNS0006 See above. Weinges_K et al. 1971 Myrica rubra FL63ACNS0006 See above. Weinges_K et al. 1971 Rheum sp. FL63ACNS0006 See above. Weinges_K et al. 1971 Sedum sediforme FL63ACNS0006 See above. Weinges_K et al. 1971 Syzygium samarangense FL63ACNS0006 See above. Weinges_K et al. 1971 Vitis vinifera FL63ACNS0006 See above. Weinges_K et al. 1971