Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC=CC=C1N1CCN(CC1)C(=O)CC(=O)CN1CC2CC(C1)C1=CC=CC(=O)N1C2

InChIKey

InChIKey=IVQFQGDBWCBXFQ-UHFFFAOYSA-N

Formula

C27H34N4O4

Mass

478.593

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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 - Phenylpiperazine - N-arylpiperazine - Aminophenyl ether - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Alkyl aryl ether - Pyridinone - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Piperidine - Pyridine - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Alpha-aminoketone - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Carboxamide group - Ketone - Lactam - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen 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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