Structure Information
Structure

Compound Identification

SMILES

CN(C)[C@@]12CC(=O)[C@]3(CCCC[C@@H]13)C(=C2C#CC#CC1=C(C2=CC=CC=C2)[C@]23CCCC[C@H]2[C@]1(CC3=O)N(C)C)C1=CC=CC=C1

InChIKey

InChIKey=XZXUGNWQLUTGAA-NJPLLRKJSA-N

Formula

C42H44N2O2

Mass

608.826

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Cyclohexenone - Benzenoid - Monocyclic benzene moiety - Tertiary aliphatic amine - Tertiary amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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