Structure Information
Structure

Compound Identification

SMILES

OC(=O)C([O-])=O.COC1=C(OCC[NH+](C)C)C(C(=O)\C=C\C2=CC=C(Cl)C=C2)=C(OC)C2=C1OC=C2

InChIKey

InChIKey=PXSQUZOMPIHSLT-HCUGZAAXSA-N

Formula

C25H26ClNO9

Mass

519.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Furanochalcones

Alternative Parents

Molecular Framework

Not available

Substituents

Furanochalcone - Cinnamic acid or derivatives - Benzofuran - Anisole - Phenol ether - Styrene - Aryl ketone - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Quaternary ammonium salt - Acryloyl-group - Furan - Enone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid salt - Ketone - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as furanochalcones. These are compounds containing a furan ring fused to either ring of a chalcone moiety.

External Descriptors

Not available

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