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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026756

Epitheaflavic acid 3a(2)-gallate

Formula: C28H20O14  |  Mol. Weight: 580.40 g/mol

IUPAC: 1-[(2S,3S)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-3,4-dihydro-2H-chromen-2-yl]-3,4,6-trihydroxy-5-oxobenzo[7]annulene-8-carboxylic acid

Overview

Molecular Formula C28H20O14
Molecular Weight 580.40 g/mol
Canonical SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C4=C3C=C(C=C(C4=O)O)C(=O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy