Structure Information
Structure

Compound Identification

SMILES

OC1=C(C=CC(OC(=O)C=C)=C1C(N1CCCCC1)C1=CC=CC=C1Cl)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=SCVRUMANYXQERE-UHFFFAOYSA-N

Formula

C28H26ClNO4

Mass

475.97

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Benzophenone - Diphenylmethane - Aryl-phenylketone - Phenol ester - Phenoxy compound - Aryl ketone - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Halobenzene - Chlorobenzene - Aralkylamine - Acrylic acid ester - Benzenoid - Aryl halide - Piperidine - Aryl chloride - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous acid - Acrylic acid or derivatives - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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