Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(S[C@H]3C[C@@H](CSC4=NN=NN4C)N(C3)C(=O)OCC3=CC=C(C=C3)[N+]([O-])=O)=C(N2C1=O)C([O-])=O

InChIKey

InChIKey=DJMBNANJVLIYFB-CELYIQNJSA-M

Formula

C25H28N7O8S2

Mass

618.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Carbapenems

Direct Parent

Thienamycins

Alternative Parents

Alpha amino acids and derivatives Benzyloxycarbonyls Nitrobenzenes Nitroaromatic compounds Pyrrolidine carboxylic acids Pyrroline carboxylic acids Azepines Alkylarylthioethers Vinylogous thioesters Tertiary carboxylic acid amides Tetrazoles Heteroaromatic compounds Carbamate esters Secondary alcohols Azetidines Thioenol ethers Carboxylic acid salts Azacyclic compounds Sulfenyl compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organonitrogen compounds Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienamycin - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Alkylarylthioether - Vinylogous thioester - Benzenoid - Monocyclic benzene moiety - Azole - Pyrrolidine - Carbamic acid ester - Heteroaromatic compound - Pyrroline - Tetrazole - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid salt - C-nitro compound - Organic nitro compound - Thioenolether - Secondary alcohol - Sulfenyl compound - Azacycle - Thioether - Organic oxoazanium - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organosulfur compound - Organooxygen compound - Alcohol - Organopnictogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thienamycins. These are beta-lactam antibiotics that differ from penicillins in having the thiazolidine sulfur atom replaced by carbon, the sulfur then becoming the first atom in the side chain.

External Descriptors

Not available

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