Structure Information
Structure

Compound Identification

SMILES

COC1=CC=[N+](CC2=C(N3[C@@H](SC2)[C@H](NC(=O)C(=N\OCC#C)\C2=NSC(N)=N2)C3=O)C([O-])=O)C=C1

InChIKey

InChIKey=YFBADXJVVCLHRC-ROXUQJQNSA-N

Formula

C21H19N7O6S2

Mass

529.55

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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 - Alpha-amino acid or derivatives - Alkyl aryl ether - Meta-thiazine - Pyridinium - Pyridine - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Azole - Carboxylic acid salt - Carboxamide group - Azetidine - Amino acid - Secondary carboxylic acid amide - Amino acid or derivatives - Acetylide - Azacycle - Carboxylic acid derivative - Dialkylthioether - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hemithioaminal - Thioether - Amine - Organic nitrogen compound - Organic salt - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - 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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