Structure Information
Structure

Compound Identification

SMILES

CON=C(C(=O)NC1C2SCC(CSC3=CC=[N+](C=C3)N3CCN(CCO)CC3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1

InChIKey

InChIKey=RNLZAEZPDRPNRV-UHFFFAOYSA-O

Formula

C25H31N8O6S3

Mass

635.75

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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

N-acyl-alpha amino acids and derivatives 2,4-disubstituted thiazoles Alkylarylthioethers N-alkylpiperazines 1,3-thiazines Pyridinium derivatives 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines 1,2-aminoalcohols Secondary carboxylic acid amides Amino acids Azetidines Thiohemiaminal derivatives Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Primary amines Primary alcohols Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - N-alkylpiperazine - Alkylarylthioether - 1,4-diazinane - Meta-thiazine - Piperazine - Pyridine - Pyridinium - 1,3-thiazol-2-amine - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Thiazole - Amino acid - Carboxamide group - Tertiary aliphatic amine - Azetidine - Amino acid or derivatives - 1,2-aminoalcohol - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid - Dialkylthioether - Alkanolamine - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Hemithioaminal - Thioether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Primary alcohol - Primary amine - Amine - Hydrocarbon derivative - Alcohol - Organic oxide - Organic cation - 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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