Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)[N+]12CCCC1CCC2=O

InChIKey

InChIKey=LVDBPEIEHDRDNL-UHFFFAOYSA-N

Formula

C12H20NO3

Mass

226.295

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolizidines

Subclass

Pyrrolizidinones

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolizidinones

Alternative Parents

Pyrrolidine carboxylic acids Pyrrolidine-2-ones N-alkylpyrrolidines Quaternary ammonium salts Lactams Carboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Pyrrolizidinone - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Pyrrolidine - Quaternary ammonium salt - Lactam - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic cation - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolizidinones. These are compounds containing a pyrrolizidine moiety which bears a ketone. Pyrrolizidine is a bicyclic ring system made up of two fused pyrrolidine ring sharing a nitrogen atom.

External Descriptors

Not available

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