Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC=C(NC(=S)N2CCCC3=C[C@H]4C[C@H](C[NH+]5CCCC[C@H]45)[C@H]23)C=C1

InChIKey

InChIKey=FXFWLFLEWLWTAF-KKSHJYNMSA-O

Formula

C25H34N3O2S

Mass

440.63

Export to:

JSON SDF CSV

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 - Benzoate ester - N-phenylthiourea - Quinolizidine - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Piperidine - Benzenoid - Quaternary ammonium salt - Thiourea - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Amine - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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

Previous Back Next