Structure Information
Structure

Compound Identification

SMILES

[Na+].NC1=NC(=CS1)C(=N/OCCF)\C(=O)N[C@H]1[C@H]2CCC(SC3=NC(=CS3)C(=O)OCC3=CC=CC=C3)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=KWTLOEKAUHNAKQ-RXMNJLRESA-M

Formula

C26H22FN6NaO7S3

Mass

668.67

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Not available

Direct Parent

Carbacephems

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Carbacephem - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Aryl thioether - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Tetrahydropyridine - Benzenoid - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Vinylogous thioester - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Thioenolether - Azetidine - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Sulfenyl compound - Organic metal halide - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as carbacephems. These are a new class of beta-lactam antibiotics similar in structure to the cephalosporins. They differ from cephalosporins, however, in the substitution of a sulfur atom in the dihydrothiazine ring with a methylene group to form a tetrahydropyridine ring.

External Descriptors

Not available

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