Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C(F)(F)F.C[C@@H](OC(=O)OCC=C)[C@@H]1[C@H]2[C@@H](C)C(CSC3=NC4=C(S3)C=CC(CC[N+]3=CNC=C3)=C4)=C(N2C1=O)C(=O)OCC=C

InChIKey

InChIKey=VAHOOCJRQBGHIG-UJJKLMTHSA-N

Formula

C32H33F3N4O8S2

Mass

722.75

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 Benzothiazoles Pyrroline carboxylic acids Alkylarylthioethers Azepines Benzenoids N-substituted imidazoles Carbonic acid diesters Thiazoles Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Enoate esters Azetidines Carboxylic acid salts Monocarboxylic acids and derivatives Azacyclic compounds Sulfenyl compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides Organonitrogen compounds Organic cations

Molecular Framework

Not available

Substituents

Carbapenem - Alpha-amino acid or derivatives - 1,3-benzothiazole - Aryl thioether - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Alkylarylthioether - N-substituted imidazole - Carbonic acid diester - Benzenoid - Imidazole - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Azole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrroline - Tertiary carboxylic acid amide - Thiazole - Carboxylic acid ester - Carbonic acid derivative - Carboxamide group - Carboxylic acid salt - Azetidine - Carboxylic acid - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Alkyl fluoride - Alkyl halide - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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