Structure Information
Structure

Compound Identification

SMILES

CN1C=C(CN2C[C@@H]3C[C@H](C2)C2=CC=C(NS(=O)(=O)C4=CC=CS4)C(=O)N2C3)C2=CC=CC=C12

InChIKey

InChIKey=UXSNFWPUXNZJLR-ZWKOTPCHSA-N

Formula

C25H26N4O3S2

Mass

494.63

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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 - N-alkylindole - 3-alkylindole - Indole - Indole or derivatives - Pyridinone - Aralkylamine - Pyridine - N-methylpyrrole - Piperidine - Benzenoid - Substituted pyrrole - Organosulfonic acid amide - Heteroaromatic compound - Pyrrole - Aminosulfonyl compound - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Lactam - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - 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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