Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)C1=C(C=CC(=O)N1C2)C1=CC=C(OC(F)(F)F)C=C1

InChIKey

InChIKey=MEACAACQYFVMMP-DZGCQCFKSA-N

Formula

C22H21F3N2O5

Mass

450.414

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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 - 3-phenylpyridine - N-acyl-piperidine - Phenoxy compound - Phenol ether - Pyridinone - Monocyclic benzene moiety - Benzenoid - Pyridine - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Trihalomethane - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organohalogen compound - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Halomethane - Organic oxide - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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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