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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008075

Quercetin 3-acetate 7,3',4'-tri-O-sulfate

Formula: C17H12O17S3  |  Mol. Weight: 584.50 g/mol

IUPAC: [2-(3,4-disulfooxyphenyl)-5-hydroxy-4-oxo-7-sulfooxychromen-3-yl] acetate

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Overview

Molecular Formula C17H12O17S3
Molecular Weight 584.50 g/mol
Canonical SMILES CC(=O)OC1=C(OC2=CC(=CC(=C2C1=O)O)OS(=O)(=O)O)C3=CC(=C(C=C3)OS(=O)(=O)O)OS(=O)(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy