Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(NC(=O)NC2=C(C=CC(=C2)C(=O)NC2CCCC2)N2CC3CC(C2)C2=CC=CC(=O)N2C3)=C1

InChIKey

InChIKey=GCIWBKHPEZURJA-UHFFFAOYSA-N

Formula

C31H35N5O4

Mass

541.652

Export to:

JSON SDF CSV

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 - Phenylpiperidine - Aminobenzamide - Aminobenzoic acid or derivatives - N-phenylurea - Benzamide - Benzoic acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Pyridinone - Aralkylamine - Pyridine - Piperidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Secondary carboxylic acid amide - Urea - Tertiary amine - Lactam - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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

Previous Back Next