Structure Information
Structure

Compound Identification

SMILES

CN(N1C(=O)C2CC=C3C(CC4C(=O)C(=CC(=O)C4(C3C3=CC(F)=C(O)C=C3)C3=CC=CC=C3)C3=CC=CC=C3)C2C1=O)C1=C(Cl)C=CC(=N1)C(F)(F)F

InChIKey

InChIKey=KDJQEVSLFVNZEA-UHFFFAOYSA-N

Formula

C41H30ClF4N3O5

Mass

756.15

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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 heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Anthraquinone - 1,4-anthraquinone - Stilbene - Cyclohexylphenol - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - 2-halophenol - 2-fluorophenol - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexenone - Fluorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - 2-pyrrolidone - Pyrrolidone - Pyridine - Pyrrolidine - Dicarboximide - Heteroaromatic compound - Ketone - Lactam - Carboxylic acid hydrazide - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Organochloride - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic 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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