Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(O2)=CC1=C(OC)C=CC(Br)=C1

InChIKey

InChIKey=SJPWXHQXOVHFOB-UHFFFAOYSA-N

Formula

C21H19BrO6

Mass

447.281

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Aurone flavonoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Aurone flavonoids

Alternative Parents

Phenoxyacetic acid derivatives Benzofurans Coumarans Anisoles Aryl ketones Phenoxy compounds Methoxybenzenes Bromobenzenes Alkyl aryl ethers Aryl bromides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Aldehydes Organic oxides Organobromides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aurone - Phenoxyacetate - Benzofuran - Coumaran - Phenoxy compound - Phenol ether - Aryl ketone - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organobromide - Organooxygen compound - Organic oxygen compound - Aldehyde - Organohalogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aurone flavonoids. These are flavonoids containing a 2-Benzylidene-1-benzofuran-3-one based core. Aurone flavonoids provide the bright yellow color of some important ornamental flowers, such as snapdragon (Antirrhinum majus).

External Descriptors

Not available

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