Structure Information
Structure

Compound Identification

SMILES

CO\N=C(\C(=O)N[C@@H]1[C@H]2SCC(CSC3=NN(CC#C)N=N3)=C(N2C1=O)C(O)=O)C1=CSC(NC=O)=N1

InChIKey

InChIKey=CGCRIFJOEOVLBT-QGEKPWAMSA-N

Formula

C19H17N9O6S3

Mass

563.58

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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 - Aryl thioether - N-arylamide - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - Azole - Tertiary carboxylic acid amide - Tetrazole - Thiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Thioether - Azacycle - Acetylide - Dialkylthioether - Sulfenyl compound - Hemithioaminal - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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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