Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C1=C(C[N+]23CCC(CC2)CC3)CS[C@@H]2[C@H](NC(=O)CSC3=C(Cl)C=CC(Cl)=C3)C(=O)N12

InChIKey

InChIKey=ORVLYAGFEGYGFL-QYFHAUOXSA-N

Formula

C23H25Cl2N3O4S2

Mass

542.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems - Cephalosporins

Direct Parent

3'-quaternary ammonium cephalosporins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3'-quaternary ammonium cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Quinuclidine - Aryl thioether - Thiophenol ether - 1,4-dichlorobenzene - Halobenzene - Alkylarylthioether - Chlorobenzene - Meta-thiazine - Aryl chloride - Piperidine - Monocyclic benzene moiety - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tetraalkylammonium salt - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Tertiary amine - Thioether - Hemithioaminal - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organic salt - Organooxygen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3'-quaternary ammonium cephalosporins. These are cephalosporins that are substituted at the 3'-position by a quaternary ammonium group.

External Descriptors

Not available

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