Structure Information
Structure

Compound Identification

SMILES

O=C1N(C2CCCC2)C(=S)S\C1=C/N1C[C@H]2C[C@@H](C1)C1=CC=CC(=O)N1C2

InChIKey

InChIKey=ZTSUMHXBMLBMSL-GJRBHXFNSA-N

Formula

C20H23N3O2S2

Mass

401.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Lupin alkaloids

Subclass

Cytisine and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Cytisine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cytisine - Pyridinone - Aralkylamine - Piperidine - Pyridine - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Thiazolidine - Heteroaromatic compound - Dithiocarbamic acid ester - Vinylogous amide - Amino acid or derivatives - Lactam - Tertiary amine - Tertiary aliphatic amine - Enamine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cytisine and derivatives. These are lupin alkaloids with a structure based on the cytisine skeleton, which is a tetracyclic ketone containing fused pyridine and piperidine rings that form pyrido[1,2a][1,5]diazocin-8-one.

External Descriptors

Not available

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