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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000244

4,6,7-trimethoxy-9-[6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3-benzodioxol-5-yl]-1H-benzo[f][2]benzofuran-3-one

Formula: C28H28O13  |  Mol. Weight: 572.50 g/mol

IUPAC: 4,6,7-trimethoxy-9-[6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3-benzodioxol-5-yl]-1H-benzo[f][2]benzofuran-3-one

Overview

Molecular Formula C28H28O13
Molecular Weight 572.50 g/mol
Canonical SMILES COC1=C(C=C2C(=C1)C(=C3COC(=O)C3=C2OC)C4=CC5=C(C=C4OC6C(C(C(C(O6)CO)O)O)O)OCO5)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy