Structure Information
Structure

Compound Identification

SMILES

[K+].COC1=CC=C(CN2CC(C2)SC2=C(N3[C@@H]([C@@H]([C@@H](C)O)C3=O)[C@H]2C)C([O-])=O)C=C1

InChIKey

InChIKey=UOLVXGUSXSEDSS-GDUIAGANSA-M

Formula

C21H25KN2O5S

Mass

456.6

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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 Anisoles Benzylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines Pyrroline carboxylic acids Aralkylamines Alkyl aryl ethers Azepines Vinylogous thioesters Tertiary carboxylic acid amides Trialkylamines Thioenol ethers Secondary alcohols Amino acids Azetidines Carboxylic acid salts Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organic potassium salts Organic oxides Hydrocarbon derivatives Organic zwitterions Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Thienamycin - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Pyrroline carboxylic acid - Methoxybenzene - Pyrroline carboxylic acid or derivatives - Alkyl aryl ether - Azepine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Vinylogous thioester - Pyrroline - Tertiary carboxylic acid amide - Amino acid or derivatives - Azetidine - Carboxamide group - Carboxylic acid salt - Amino acid - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Thioenolether - Sulfenyl compound - Organic alkali metal salt - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic salt - Carbonyl group - Organic oxide - Organic zwitterion - Organic potassium salt - Hydrocarbon derivative - Amine - Organic nitrogen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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