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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024395

3'-(2'',3'',4'',6''-Tetrakisgalloylglucosyl)-phloroacetophenone

Formula: C42H34O25  |  Mol. Weight: 938.70 g/mol

IUPAC: [6-(3-acetyl-2,4,6-trihydroxyphenyl)-3,4,5-tris[(3,4,5-trihydroxybenzoyl)oxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

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Overview

Molecular Formula C42H34O25
Molecular Weight 938.70 g/mol
Canonical SMILES CC(=O)C1=C(C=C(C(=C1O)C2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy