Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=C(NC(=S)N2CCCC3=C[C@@H]4CC(CN5CCCC[C@H]45)[C@H]23)C=C1

InChIKey

InChIKey=KEECMEYAPMBZSF-FQMOWQLGSA-N

Formula

C24H31N3OS

Mass

409.59

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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 - Alkyl-phenylketone - N-phenylthiourea - Quinolizidine - Acetophenone - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Monocyclic benzene moiety - Piperidine - Benzenoid - Ketone - Tertiary aliphatic amine - Tertiary amine - Thiourea - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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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