Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)S(=O)(=O)N1CCCC2=C[C@@H]3C[C@@H](C[NH+]4CCCC[C@@H]34)[C@@H]12

InChIKey

InChIKey=OEHFYGYYYQJAMU-KSCDAYEDSA-O

Formula

C22H31N2O3S

Mass

403.56

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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 - Quinolizidine - Benzenesulfonamide - Benzenesulfonyl group - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Alkyl aryl ether - Benzenoid - Piperidine - Organosulfonic acid amide - Monocyclic benzene moiety - Quaternary ammonium salt - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary aliphatic amine - Azacycle - Ether - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Amine - Organic cation - 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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