Structure Information
Structure

Compound Identification

SMILES

NS(=O)(=O)C1=CC=C(NC(=S)N2CCCC3=CC4CC(CN5CCCCC45)C23)C=C1

InChIKey

InChIKey=TXJLPCXYZHGDRJ-UHFFFAOYSA-N

Formula

C22H30N4O2S2

Mass

446.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Lupin alkaloids

Subclass

Aloperine and related alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

Aloperine and related alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aloperine skeleton - Benzenesulfonamide - N-phenylthiourea - Quinolizidine - Benzenesulfonyl group - Monocyclic benzene moiety - Piperidine - Benzenoid - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary aliphatic amine - Thiourea - Tertiary amine - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aloperine and related alkaloids. These are lupin Alkaloids with a structure based on the aloperine skeleton. Aloperine is a tetracyclic compound made up of a quinolizidine and a decahydroquinoline joined to form 3,15-diazatetracycloheptadecane.

External Descriptors

Not available

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