Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(COC(=O)C2=C(CCl)CS[C@@H]3[C@H](NC(=O)C(=N/OC(C(O)=O)C4=CC5=C(OCO5)C=C4)\C4=CSC(N)=N4)C(=O)N23)C=C1

InChIKey

InChIKey=NGPTXNYLKPJYFJ-RBKWIZSDSA-N

Formula

C30H26ClN5O10S2

Mass

716.13

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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 - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Benzodioxole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Meta-thiazine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Primary aromatic amine - Benzenoid - 1,3-thiazol-2-amine - Azole - Thiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Amino acid - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azetidine - Amino acid or derivatives - Ether - Acetal - Carboxylic acid derivative - Oxacycle - Thioether - Carboxylic acid - Hemithioaminal - Dialkylthioether - Azacycle - Alkyl halide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organic oxide - Organochloride - Amine - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Alkyl chloride - Organic oxygen compound - 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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