Structure Information
Structure

Compound Identification

SMILES

N#C[C@H]1[C@H](O[C@H]([C@@H]1C#N)C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=XTSGCMGSOWSAGZ-TVFCKZIOSA-N

Formula

C18H14N2O

Mass

274.323

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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

Not available

Direct Parent

7,7'-epoxylignans

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

7,7p-epoxylignan - Dibenzylbutane lignan skeleton - Monocyclic benzene moiety - Benzenoid - Oxolane - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 7,7'-epoxylignans. These are lignans with a structure based on a 2,5-diaryl-3, 4-dimethyltetrahydrofuran skeleton.

External Descriptors

Not available

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