Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=C(NC(=O)N2CC3CC(C2)C2=CC=C(N=C(O)C4=CN=CC=N4)C(=O)N2C3)C=C1

InChIKey

InChIKey=GPTPAGXRWRYTJH-UHFFFAOYSA-N

Formula

C25H24N6O4

Mass

472.505

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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 - Alkyl-phenylketone - N-phenylurea - Piperidinecarboxamide - 1-piperidinecarboxamide - Acetophenone - Phenylketone - Aryl alkyl ketone - Aryl ketone - Benzoyl - Pyridinone - Pyrazine - Pyridine - Piperidine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Ketone - Lactam - Urea - Organoheterocyclic compound - Azacycle - Carboximidic acid derivative - Carboximidic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen 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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