Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H]1[C@@H]2CON=C2C2=CC3=C(OCO3)C=C2[C@H]1C1=CC(OC)=C(O)C(OC)=C1

InChIKey

InChIKey=SLKFRQBHJVWFOC-BKTGTZMESA-N

Formula

C22H21NO8

Mass

427.409

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Aryltetralin lignans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Aryltetralin lignans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-aryltetralin lignan - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Methoxyphenol - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Benzodioxole - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Methyl ester - Isoxazoline - Carboxylic acid ester - Azacycle - Oxacycle - Acetal - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton.

External Descriptors

Not available

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