Structure Information
Structure

Compound Identification

SMILES

[Na+].CO\N=C(\C(=O)NC1[C@H]2SCC(CSc3nnnn3CC(=O)N3CCN(CC3)c3cc4N(C=C(C(O)=O)C(=O)c4cc3F)C3CC3)=C(N2C1=O)C([O-])=O)c1csc(N)n1

InChIKey

InChIKey=NIEACKUQLYUWNX-PGFOLYEYSA-M

Formula

C34H32FN12NaO9S3

Mass

890.87

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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 - Quinoline-3-carboxylic acid - Fluoroquinolone - N-arylpiperazine - Haloquinoline - Aminoquinoline - Dihydroquinolone - Alpha-amino acid or derivatives - Dihydroquinoline - Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aryl thioether - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Aryl fluoride - Aryl halide - 1,4-diazinane - Dicarboxylic acid or derivatives - Meta-thiazine - Piperazine - Pyridine - 1,3-thiazol-2-amine - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Vinylogous amide - Tetrazole - Azole - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid salt - Amino acid - Amino acid or derivatives - Organic alkali metal salt - Azacycle - Dialkylthioether - Carboxylic acid derivative - Sulfenyl compound - Carboxylic acid - Organic metal halide - Hemithioaminal - Thioether - Organonitrogen compound - Organic nitrogen compound - Organosulfur compound - Organic oxide - Primary amine - Organic salt - Carbonyl group - Organic sodium salt - Organic zwitterion - Organooxygen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - 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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