Molecular Identity
Epigallocatechin
(2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
PubChem CID: 72277
(-)-epigallocatechin is a flavan-3,3',4',5,5',7-hexol having (2R,3R)-configuration. It has a role as an antioxidant, a plant metabolite and a food component. It is a catechin and a flavan-3,3',4',5,5',7-hexol. It is an enantiomer of a (+)-epigallocatechin.
2D Structure
Properties
C15H14O7
Molecular Formula
306.27
Molecular Weight
g/mol
306.0740
Exact Mass
Da
0
XLogP
Drug-like (Lipinski: < 5)
131
TPSA
Good oral absorption (< 140 A²)
6
H-Bond Donors
7
H-Bond Acceptors
380
Complexity
SMILES
Canonical SMILES
SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OIsomeric SMILES
SMILES: C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OSynonyms(20)
(-)-EpigallocatechinEpigallocatechin970-74-1EpigallocatecholL-Epigallocatechinepi-GallocatechinAntiscurvy factor C2(-)-EpigallocatecholGalloepicatechin3,3',4',5,5',7-Flavanhexol(-)-epi-GallocatechinSunphenon EGC(-)-3,3',4',5,5',7-Flavanhexol2,3-cis-epigallocatechin(2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Epigallocatechin
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