Structure Information
Structure

Compound Identification

SMILES

OC(C(=O)NC1[C@@H]2SCC(C(CCCNCC(O)=O)SC3=NNN=N3)=C(N2C1=O)C(O)=O)C1=CC=CC=C1

InChIKey

InChIKey=CGJQCDFISAFRLH-AOQPMZQESA-N

Formula

C22H25N7O7S2

Mass

563.6

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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 - Alpha-amino acid or derivatives - Phenylacetamide - Aryl thioether - Alkylarylthioether - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Thioether - Hemithioaminal - Secondary amine - Sulfenyl compound - Dialkylthioether - Secondary aliphatic amine - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Amine - Organonitrogen compound - Organic nitrogen compound - Aromatic alcohol - 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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