Structure Information
Structure

Compound Identification

SMILES

CO\N=C(\C(=O)N[C@H]1[C@H]2SCC(\C=C\C3=CC(NO3)=C3C=C(Cl)C(=O)C(O)=C3Cl)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1

InChIKey

InChIKey=WXZZXFNEDDLJCK-OVBPTABOSA-N

Formula

C24H18Cl2N6O8S2

Mass

653.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems

Direct Parent

Cephalosporins

Alternative Parents

N-acyl-alpha amino acids and derivatives P-quinomethanes 2,4-disubstituted thiazoles 1,3-thiazines 2-amino-1,3-thiazoles Vinylogous halides Tertiary carboxylic acid amides Alpha-chloroketones Heteroaromatic compounds Isoxazolines Secondary carboxylic acid amides Amino acids Azetidines Oxacyclic compounds Dialkylthioethers Chloroalkenes Carboxylic acids Vinyl chlorides Azacyclic compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives N-organohydroxylamines Organochlorides Hydrocarbon derivatives Primary amines Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - P-quinomethane - Quinomethane - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - 1,3-thiazol-2-amine - Heteroaromatic compound - Alpha-chloroketone - Alpha-haloketone - Azole - Vinylogous halide - Isoxazoline - Thiazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Azetidine - Carboxamide group - Cyclic ketone - Ketone - Amino acid - Secondary carboxylic acid amide - Oxacycle - Azacycle - N-organohydroxylamine - Chloroalkene - Haloalkene - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Vinyl halide - Vinyl chloride - Monocarboxylic acid or derivatives - Hemithioaminal - Thioether - Carbonyl group - Amine - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.

External Descriptors

Not available

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