Structure Information
Structure

Compound Identification

SMILES

COC1=C2C(=O)OCC2=C(C2=CC3=C(OCO3)C=C2)C2=CC3=C(OCO3)C=C12

InChIKey

InChIKey=WOELDRZIQLRDQB-UHFFFAOYSA-N

Formula

C21H14O7

Mass

378.336

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Arylnaphthalene lignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Arylnaphthalene lignans

Alternative Parents

Lignan lactones Furanonaphthodioxoles Phthalides Naphthalenes Benzodioxoles Anisoles Alkyl aryl ethers Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Arylnaphthalene lignan skeleton - Lignan lactone - Linear furanonaphthodioxole - Naphthofuran - Isobenzofuranone - Phthalide - Naphthalene - Isocoumaran - Benzodioxole - Anisole - Alkyl aryl ether - Benzenoid - Carboxylic acid ester - Lactone - Acetal - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as arylnaphthalene lignans. These are lignans containing the arylnaphthalene skeleton, especially 9-(2H-1,3-benzodioxol-5-yl)-1H,3H-naphtho[2,3-c]furan-1-one or a derivative thereof. Arylnaphthalene lignans occur in nature and exhibit diverse biological activities.

External Descriptors

Not available

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