Structure Information
Structure

Compound Identification

SMILES

CC[C@H](C)[C@@H](NC(=O)O[C@H]1[C@@H](OC2=C(C=C(Br)C=C2)C1=O)C1=CC2=C(OCO2)C=C1)C(=O)OC

InChIKey

InChIKey=WMDHVFAJVWPXIE-HNXPILFWSA-N

Formula

C24H24BrNO8

Mass

534.359

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavans

Intermediate Tree Nodes

Flavanones

Direct Parent

Flavanonols

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavanonol - Isoleucine or derivatives - Alpha-amino acid ester - Chromone - Alpha-amino acid or derivatives - Chromane - Benzopyran - 1-benzopyran - Benzodioxole - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Fatty acid ester - Benzenoid - Aryl bromide - Aryl halide - Fatty acyl - Methyl ester - Carbamic acid ester - Carboxylic acid ester - Ketone - Acetal - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Aldehyde - Organobromide - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavanonols. These are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a hydroxyl group and a ketone at the carbon C2 and C3, respectively.

External Descriptors

Not available

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