Structure Information
Structure

Compound Identification

SMILES

CN([C@@H]1[C@@H]2N([C@@H](C(=O)OCC3=CC=C(C=C3)C(O)=O)C(C)(C)S2(=O)=O)C1=O)C(=O)C(F)(F)F

InChIKey

InChIKey=PIIWKLBXRAHYEA-SGMGOOAPSA-N

Formula

C19H19F3N2O8S

Mass

492.42

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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 - Alpha-amino acid ester - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Monocyclic benzene moiety - Benzenoid - Thiazolidine - Tertiary carboxylic acid amide - Sulfone - Amino acid or derivatives - Azetidine - Amino acid - Tertiary amine - Carboxamide group - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Alkyl halide - Amine - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - 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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