Structure Information
Structure

Compound Identification

SMILES

ClC1=C(Cl)C=C(CNC(=O)NC2=NC(COCC3CCCN4CCCCC34)=CS2)C=C1

InChIKey

InChIKey=NPBRDAQDFICHFF-UHFFFAOYSA-N

Formula

C22H28Cl2N4O2S

Mass

483.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Lupin alkaloids

Subclass

Lupinine-type alkaloids

Intermediate Tree Nodes

Not available

Direct Parent

Lupinine-type alkaloids

Alternative Parents

Quinolizines Quinolizidines Dichlorobenzenes 2,4-disubstituted thiazoles Piperidines Aryl chlorides Heteroaromatic compounds Ureas Trialkylamines Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Lupinine - Quinolizine - Quinolizidine - 1,2-dichlorobenzene - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Thiazole - Urea - Tertiary aliphatic amine - Tertiary amine - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Organohalogen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as lupinine-type alkaloids. These are lupin alkaloids with a structure based on the lupinine skeleton, which is a bicyclic compound consisting of a quinolizidine.

External Descriptors

Not available

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