Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=C(CS[C@@H]2[C@H](NC(=O)CC3=CC=CC=C3)C(=O)N12)SC1=C(Br)C=C(C=C1)C1=CC=CC=C1

InChIKey

InChIKey=LAJMOXJPCBSVGT-ZEQKJWHPSA-N

Formula

C27H21BrN2O4S2

Mass

581.5

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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 - N-acyl-alpha amino acid or derivatives - Brominated biphenyl - Biphenyl - Alpha-amino acid or derivatives - Phenylacetamide - Aryl thioether - Halobenzene - Bromobenzene - Meta-thiazine - Aryl bromide - Aryl halide - Vinylogous thioester - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thioenolether - Azetidine - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen 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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