Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CC2(CN3CC4CC(C3)C3=CC=CC(=O)N3C4)C(=O)NC(=O)N(CC3=CC=CC=C3)C2=O)C=C1

InChIKey

InChIKey=HUTKOILPIRFWEJ-UHFFFAOYSA-N

Formula

C31H32N4O5

Mass

540.62

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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 - Barbiturate - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - N-acyl urea - Pyridinone - Aralkylamine - Pyrimidone - Ureide - Monocyclic benzene moiety - 1,3-diazinane - Piperidine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Dicarboximide - Urea - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carbonic acid derivative - Lactam - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organopnictogen compound - Organic oxide - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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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