Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC(=C(NC(=S)N2CCCC3=CC4CC(CN5CCCCC45)C23)C=C1)[N+]([O-])=O

InChIKey

InChIKey=HXYXHJMOMICXML-UHFFFAOYSA-N

Formula

C24H32N4O3S

Mass

456.61

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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 - Nitrophenyl ether - N-phenylthiourea - Quinolizidine - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Piperidine - Benzenoid - C-nitro compound - Organic nitro compound - Tertiary amine - Thiourea - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Ether - Azacycle - Organic oxoazanium - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic zwitterion - Organic salt - 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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