Structure Information
Structure

Compound Identification

SMILES

[Na+].COC1=CC(=CC(OC)=C1OC)[C@H]1[C@H]([C@H](CO)[C@@H](O)C2=CC3=C(OCO3)C=C12)C([O-])=O

InChIKey

InChIKey=CZDYVNWZTZWNCF-RVCPESJBSA-M

Formula

C22H23NaO9

Mass

454.407

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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 - Tetralin - Benzodioxole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carboxylic acid salt - Secondary alcohol - Acetal - Oxacycle - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic sodium salt - Carbonyl group - Organooxygen compound - Organic salt - Primary alcohol - Organic zwitterion - 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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