Structure Information
Structure

Compound Identification

SMILES

O=C1OC(=O)\C(=C/C2=CC3=C(OCO3)C=C2)\C\1=C/C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=WLQGATXUBPNDGZ-FUJGBLOQSA-N

Formula

C20H12O7

Mass

364.309

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Furanoid lignans

Subclass

Tetrahydrofuran lignans

Intermediate Tree Nodes

9,9'-epoxylignans

Direct Parent

Dibenzylbutyrolactone lignans

Alternative Parents

Lignan lactones Benzodioxoles Dicarboxylic acids and derivatives Benzenoids Oxolanes Carboxylic acid anhydrides Lactones Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzylbutyrolactone - Lignan lactone - Benzodioxole - Dicarboxylic acid or derivatives - Benzenoid - Carboxylic acid anhydride - Oxolane - Lactone - Oxacycle - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzylbutyrolactone lignans. These are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety.

External Descriptors

Not available

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