Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C1=CC=CC=C1C(=O)OCC1=C(N2[C@@H](SC1)[C@H](NC(=O)CCCC(NC(=O)C1=CC=CC=C1)C(O)=O)C2=O)C(O)=O

InChIKey

InChIKey=KUEIAQKOBGQVGP-DFEMSUKISA-N

Formula

C36H34N4O12S2

Mass

778.8

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzoate ester - Tosyl compound - Benzamide - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoyl - Medium-chain fatty acid - Heterocyclic fatty acid - Toluene - Fatty acyl - Dicarboxylic acid or derivatives - Fatty amide - Meta-thiazine - Benzenoid - N-acyl-amine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azetidine - Azacycle - Dialkylthioether - Carboxylic acid - Thioether - Carboxylic acid derivative - Hemithioaminal - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen 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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