Structure Information
Structure

Compound Identification

SMILES

[Na+].CS(=O)(=O)NC1=CC=CC(=C1)[C@@H](N)C(=O)NC1[C@@H]2SCC(C=C)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=FFIVPTIZKRRCHD-REYHQDNZSA-M

Formula

C18H19N4NaO6S2

Mass

474.48

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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 Alpha amino acid amides Sulfanilides Phenylacetamides Aralkylamines Organosulfonamides 1,3-thiazines Organic sulfonamides Tertiary carboxylic acid amides Aminosulfonyl compounds Azetidines Carboxylic acid salts Secondary carboxylic acid amides Amino acids Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organic sodium salts Organic zwitterions

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Sulfanilide - Phenylacetamide - Aralkylamine - Meta-thiazine - Monocyclic benzene moiety - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Dialkylthioether - Hemithioaminal - Carboxylic acid derivative - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organic alkali metal salt - Primary aliphatic amine - Hydrocarbon derivative - Organic sodium salt - Organic oxygen compound - Organic salt - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Organic zwitterion - 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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