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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007094

2-[(1S,2S,3R,6R,10R,11S,12S)-7-(1,3-benzodioxol-5-yl)-9-oxo-2-tetracyclo[8.2.1.03,12.06,11]trideca-4,7-dienyl]acetic acid

Formula: C22H20O5  |  Mol. Weight: 364.40 g/mol

IUPAC: 2-[(1S,2S,3R,6R,10R,11S,12S)-7-(1,3-benzodioxol-5-yl)-9-oxo-2-tetracyclo[8.2.1.03,12.06,11]trideca-4,7-dienyl]acetic acid

Overview

Molecular Formula C22H20O5
Molecular Weight 364.40 g/mol
Canonical SMILES C1C2C(C3C2C4C1C(=O)C=C(C4C=C3)C5=CC6=C(C=C5)OCO6)CC(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy