Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(=O)C1=CC=C2C3CNCC(C3)CN2C1=O

InChIKey

InChIKey=VSLCWNDYPJOMNZ-UHFFFAOYSA-N

Formula

C13H14N2O4

Mass

262.265

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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 - Aryl ketone - Aralkylamine - Pyridinone - Alpha-keto acid - Keto acid - Pyridine - Piperidine - Alpha-hydroxy ketone - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Amino acid - Ketone - Lactam - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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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