Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CSC3=NC4=CC=CC=C4S3)=C(N2C1=O)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=RUMJJBNCEGNKJF-OCYQJKLISA-N

Formula

C25H23N3O6S2

Mass

525.59

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 Benzothiazoles Nitrobenzenes Nitroaromatic compounds Pyrroline carboxylic acids Azepines Alkylarylthioethers Thiazoles Tertiary carboxylic acid amides Enoate esters Heteroaromatic compounds Azetidines Secondary alcohols Organic oxoazanium compounds Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organonitrogen compounds Organic zwitterions

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Carbapenem - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - 1,3-benzothiazole - Aryl thioether - Nitroaromatic compound - Pyrroline carboxylic acid or derivatives - Pyrroline carboxylic acid - Azepine - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Azole - Thiazole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrroline - Tertiary carboxylic acid amide - Heteroaromatic compound - Azetidine - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary alcohol - Thioether - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Organosulfur compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organic zwitterion - Organic oxide - Organooxygen 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