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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023015

Trigalloylquinic acid

Formula: C28H24O18  |  Mol. Weight: 648.50 g/mol

IUPAC: (3R,5R)-1,3,4,5-tetrahydroxy-2,2,3-tris(3,4,5-trihydroxybenzoyl)cyclohexane-1-carboxylic acid

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Overview

Molecular Formula C28H24O18
Molecular Weight 648.50 g/mol
Canonical SMILES C1C(C(C(C(C1(C(=O)O)O)(C(=O)C2=CC(=C(C(=C2)O)O)O)C(=O)C3=CC(=C(C(=C3)O)O)O)(C(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy