Structure Information
Structure

Compound Identification

SMILES

NC1=NC(\C(=N/O)C(=O)N[C@H]2[C@H]3CCC(SC4=NC(=CS4)C4=CC=NC=C4)=C(N3C2=O)C(O)=O)=C(Cl)S1

InChIKey

InChIKey=IHKXRGULQQWINB-XAFWMDSLSA-N

Formula

C21H16ClN7O5S3

Mass

578.03

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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 - 2,4,5-trisubstituted 1,3-thiazole - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Tetrahydropyridine - Pyridine - Aryl halide - Vinylogous thioester - 1,3-thiazol-2-amine - Aryl chloride - Azole - Ketoxime - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiazole - Secondary carboxylic acid amide - Azetidine - Tertiary amine - Thioenolether - Amino acid or derivatives - Carboxamide group - Amino acid - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Amine - Hydrocarbon derivative - Organochloride - Organohalogen compound - 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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