Structure Information
Structure

Compound Identification

SMILES

CCCCN1C(N)C=C(N)N=C1C1=C(N2[C@@H](SC1)C(NC(=O)C(=N/OC(C)(C)C(O)=O)\C1=NSC(N)=N1)(C=S)C2=O)C(O)=O

InChIKey

InChIKey=XTJIWXGOGJNUDC-VLFKDFFRSA-N

Formula

C24H30N10O7S3

Mass

666.75

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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 Aminopyrimidines and derivatives Dicarboxylic acids and derivatives 1,3-thiazines Imidolactams Hydropyrimidines Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Secondary carboxylic acid amides Amino acids Ketene acetals Propargyl-type 1,3-dipolar organic compounds Thioaldehydes Dialkylthioethers Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Thiohemiaminal derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary amines

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aminopyrimidine - Meta-thiazine - Imidolactam - 1,6-dihydropyrimidine - Dicarboxylic acid or derivatives - Hydropyrimidine - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Azole - Carboxamide group - Ketene acetal or derivatives - Azetidine - Amino acid - Amino acid or derivatives - Secondary carboxylic acid amide - Amidine - Azacycle - Dialkylthioether - Carboxylic acid amidine - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hemithioaminal - Thioether - Thioaldehyde - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Thiocarbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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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