Structure Information
Structure

Compound Identification

SMILES

CC[N+](C)(C\C=C\C1=C(N2C(SC1)C(NC(=O)CC1=CC=CC=C1)C2=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)CC(N)=O

InChIKey

InChIKey=INKCCQMQQMQYMF-DEDYPNTBSA-O

Formula

C36H39N4O5S

Mass

639.79

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems

Direct Parent

Cephalosporins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Phenylacetamide - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Tetraalkylammonium salt - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Quaternary ammonium salt - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Carboxylic acid ester - Primary carboxylic acid amide - Secondary carboxylic acid amide - Hemithioaminal - Monocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid derivative - Azacycle - Thioether - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.

External Descriptors

Not available

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