Structure Information
Structure

Compound Identification

SMILES

O=C1[C@@H](OCC2=CC=CC=C2)[C@H](COCC2=CC=CC=C2)[C@H]2[C@H]3O[C@H]3CN12

InChIKey

InChIKey=NANKLNVMRYCAJE-SYAJIYQZSA-N

Formula

C22H23NO4

Mass

365.429

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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

Benzylethers Pyrrolidine-2-ones N-alkylpyrrolidines Morpholines Tertiary carboxylic acid amides Lactams Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzylether - Pyrrolizidinone - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Lactam - Oxacycle - Azacycle - Dialkyl ether - Carboxylic acid derivative - Oxirane - Ether - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic 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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