Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1P(O)(O)=O.C[C@@H](O)[C@@H]1[C@H]2CC(SCC#N)=CN2C1=O

InChIKey

InChIKey=MQITWGHRJRIMGB-HSTJYESGSA-N

Formula

C17H21N2O5PS

Mass

396.4

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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

Toluenes Azepines Tertiary carboxylic acid amides Pyrrolines Organic phosphonic acids Thioenol ethers Secondary alcohols Azetidines Sulfenyl compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides Organophosphorus compounds Organopnictogen compounds

Molecular Framework

Not available

Substituents

Carbapenem - Azepine - Toluene - Monocyclic benzene moiety - Benzenoid - Organophosphonic acid - Organophosphonic acid derivative - Pyrroline - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Thioenolether - Secondary alcohol - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Sulfenyl compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Organic oxide - Carbonyl group - Cyanide - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Organosulfur compound - Organopnictogen 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

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