Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(=O)N[C@H]2[C@@H]3SC(C)(C)[C@H](N3C2=O)C([O-])=O)C(=NO1)C1=C(F)C=CC=C1Cl

InChIKey

InChIKey=UIOFUWFRIANQPC-CPUCHLNUSA-M

Formula

C19H16ClFN3O5S

Mass

452.86

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Penams

Direct Parent

Penicillins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Isoxazole - Azole - Thiazolidine - Tertiary carboxylic acid amide - Carboxylic acid salt - Amino acid or derivatives - Amino acid - Carboxamide group - Azetidine - Tertiary amine - Secondary carboxylic acid amide - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Thioether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as penicillins. These are organic compounds containing the penicillin core structure, which is structurally characterized by a penam ring bearing two methyl groups at position 2, and an amide group at position 6 [starting from the sulfur atom at position 1].

External Descriptors

Not available

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