Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C[C@H]2COC(=O)\C2=C\C2=CC3=C(OCO3)C(OC)=C2)=CC2=C1OCO2

InChIKey

InChIKey=WXZRLZZXAJPLCV-KMUBYUNESA-N

Formula

C22H20O8

Mass

412.394

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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 Anisoles Alkyl aryl ethers Gamma butyrolactones Oxolanes Enoate esters Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzylbutyrolactone - Lignan lactone - Benzodioxole - Anisole - Alkyl aryl ether - Gamma butyrolactone - Benzenoid - Enoate ester - Oxolane - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Ether - Acetal - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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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