Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC3=C(OC(=O)C4=CC=C(Br)C=C4)C=CC(CCC(=O)CCCCC(C=C2)=C1O)=C3

InChIKey

InChIKey=GAVXIWPUUIUVGN-UHFFFAOYSA-N

Formula

C27H25BrO6

Mass

525.395

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Cyclic diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Meta,para-diphenylether diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta,para-diphenylether diarylheptanoid - Oxyneolignan skeleton - Diaryl ether - Benzoate ester - Phenol ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Anisole - Phenol ether - Alkyl aryl ether - Bromobenzene - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Phenol - Aryl halide - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Ketone - Cyclic ketone - Carboxylic acid ester - Ether - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as meta,para-diphenylether diarylheptanoids. These are cyclic diarylheptanoids where the two benzene rings are linked to each other by an ether group conjugated to the 3-position of one benzene ring and the 4-position of the other ring.

External Descriptors

Not available

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