Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C(F)(F)F.CC1=CC(C)=[N+](C)C(SCC2=C(N3C(SC2)C(NC(=O)C(=N/OC(C)(C)C(O)=O)\C2=CSC(N)=N2)C3=O)C(O)=O)=N1

InChIKey

InChIKey=GUWUFEHQYNSKTC-QBRZJGSHSA-N

Formula

C26H28F3N7O9S3

Mass

735.73

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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 1,3-thiazines 2-amino-1,3-thiazoles Pyrimidines and pyrimidine derivatives Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Sulfenyl compounds Dialkylthioethers Alkyl fluorides Carbonyl compounds Organofluorides Primary amines Organic zwitterions Organic oxides Hydrocarbon derivatives

Molecular Framework

Not available

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - Pyrimidine - Dicarboxylic acid or derivatives - 1,3-thiazol-2-amine - Azole - Tertiary carboxylic acid amide - Thiazole - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid salt - Amino acid - Secondary carboxylic acid amide - Azetidine - Thioether - Carboxylic acid derivative - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Azacycle - Carboxylic acid - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Primary amine - Amine - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Organic oxygen 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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