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(-)-epicatechin gallate

C22H18O10 442.4 g/mol
O H H O O O H O H O H O O H O O H
Name (-)-epicatechin gallate
Alternative name Epicatechin gallate
Formula C22H18O10
Formula Weight 442.40 g/mol
Molecular Weight 442.40 g/mol
Monoisotopic Mass 442.090000 g/mol
InChI Key LSHVYAFMTMFKBA-TZIWHRDSSA-N
IUPAC [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
InChI InChI=1S/C22H18O10/c23-11-6-14(25)12-8-19(32-22(30)10-4-16(27)20(29)17(28)5-10)21(31-18(12)7-11)9-1-2-13(24)15(26)3-9/h1-7,19,21,23-29H,8H2/t19-,21-/m1/s1
SMILES OC1=CC(O)=C2C[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](OC2=C1)C1=CC=C(O)C(O)=C1
Food Berry,  Green tea,  Tea, 
Food Source Strawberry,  Brewed,  Black tea, 
Family Phenolic
Class Flavonoid
Subclass Group Flavan-3-ol
Subclass Flavanol
Metabolite Flavanol metabolite
CASNO 1257-08-5
HMDB HMDB0037944
PubChem 107905
KEGG C09727
FooDB FDB017114
DrugBank DB12039
ChEBI 70255
BioCyc CPD-7630
METLIN 3420.0