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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037559

Parellin

Formula: C18H15ClO6  |  Mol. Weight: 362.80 g/mol

IUPAC: 2-chloro-9-hydroxy-3-methoxy-1,4,7-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde

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Overview

Molecular Formula C18H15ClO6
Molecular Weight 362.80 g/mol
Canonical SMILES CC1=CC(=C(C2=C1C(=O)OC3=C(C(=C(C(=C3O2)C)Cl)OC)C)C=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy