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Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1C1=C(C(O2)C2=CC(C)=CC(C)=C2)C(Br)=C(NS(C)(=O)=O)C=C1

InChIKey

InChIKey=NHQBWVABHCUBGR-UHFFFAOYSA-N

Formula

C23H22BrNO4S

Mass

488.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

O-methylated flavonoids

Intermediate Tree Nodes

Not available

Direct Parent

5-O-methylated flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-methoxyflavonoid-skeleton - Dibenzopyran - Benzopyran - Sulfanilide - 2-benzopyran - 1-benzopyran - Anisole - M-xylene - Xylene - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid amide - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Oxacycle - Ether - Organosulfur compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C5 atom of the flavonoid backbone.

External Descriptors

Not available

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