Structure Information
Structure

Compound Identification

SMILES

CCC1=C(Br)C(=O)OC2=C1C=CC(OCC(=O)N1CC3CC(C1)C1=CC=CC(=O)N1C3)=C2

InChIKey

InChIKey=LJFZGVSQALSNRY-UHFFFAOYSA-N

Formula

C24H23BrN2O5

Mass

499.361

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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 - Coumarin - Benzopyran - 1-benzopyran - N-acyl-piperidine - Phenol ether - Alkyl aryl ether - Pyridinone - Pyranone - Aryl bromide - Aryl halide - Benzenoid - Pyridine - Pyran - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Lactone - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen 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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