Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H]3CCC4=C(C=C(Br)C=C4)C3=C(N2C1=O)C(O)=O

InChIKey

InChIKey=PTSQKCDEDUHJNW-HSZYHJKUSA-N

Formula

C17H16BrNO4

Mass

378.222

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Not available

Direct Parent

Carbapenems

Alternative Parents

Tetralins Alpha amino acids and derivatives Isoindoles and derivatives Pyrroline carboxylic acids Azepines Aryl bromides Tertiary carboxylic acid amides Secondary alcohols Azetidines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organobromides Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Carbapenem - Alpha-amino acid or derivatives - Tetralin - Isoindole or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Aryl bromide - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Pyrroline - Secondary alcohol - Azetidine - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organooxygen compound - Organobromide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as carbapenems. These are beta-lactam derivatives in which the beta-lactam ring shares the nitrogen atom with a pyrrole-2-carboxylic acid.

External Descriptors

Not available

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