Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(OS(=O)(=O)C(F)(F)F)=C(N2C1=O)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=IWRZEHCVPRPEPY-NRMKKVEVSA-N

Formula

C18H17F3N2O9S

Mass

494.39

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Not available

Direct Parent

Carbapenems

Alternative Parents

Alpha amino acids and derivatives Benzyloxycarbonyls Nitrobenzenes Trifluoromethanesulfonates Nitroaromatic compounds Pyrroline carboxylic acids Azepines Sulfonic acid esters Organosulfonic acid esters Tertiary carboxylic acid amides Sulfonyls Enoate esters Methanesulfonates Secondary alcohols Trihalomethanes Azetidines Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions Organofluorides Organonitrogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Carbapenem - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Pyrroline carboxylic acid or derivatives - Pyrroline carboxylic acid - Nitroaromatic compound - Trifluoromethanesulfonate - Azepine - Organosulfonic acid ester - Sulfonic acid ester - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Sulfonyl - Pyrroline - Organic sulfonic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methanesulfonate - Organosulfonic acid or derivatives - Azetidine - Trihalomethane - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Secondary alcohol - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Monocarboxylic acid or derivatives - Azacycle - Organic zwitterion - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organofluoride - Alkyl halide - Carbonyl group - Halomethane - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organic salt - Organonitrogen compound - Alcohol - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as carbapenems. These are beta-lactam derivatives in which the beta-lactam ring shares the nitrogen atom with a pyrrole-2-carboxylic acid.

External Descriptors

Not available

Previous Back Next