Structure Information
Structure

Compound Identification

SMILES

CNC(=O)[C@H]1[C@@H](O)[C@@]2(O)C3=C(OC)C=C(OC)C=C3O[C@]2([C@@H]1C1=CC=CC=C1)C1=CC=C(Br)C=C1

InChIKey

InChIKey=AMMOFSKKTLXRAP-PXIJUOARSA-N

Formula

C27H26BrNO6

Mass

540.41

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzofurans

Subclass

Flavaglines

Intermediate Tree Nodes

Not available

Direct Parent

Flavaglines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavagline skeleton - Stilbene - Coumaran - Anisole - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Secondary carboxylic acid amide - 1,2-diol - Carboxamide group - Ether - Carboxylic acid derivative - Oxacycle - Organic oxide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavaglines. These are heterocyclic compounds with a structure characterized by a cyclopenta[b]benzofuran skeleton.

External Descriptors

Not available

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