Structure Information
Structure

Compound Identification

SMILES

CC(N)=[NH+]CCSCC1=C(SC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N/O)\C2=C(Cl)SC(N)=N2)C3=O)C([O-])=O)C=CN=C1

InChIKey

InChIKey=LGOYAIYJZKFDBR-CLDIZIQQSA-N

Formula

C22H23ClN8O5S4

Mass

643.17

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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 - Aryl thioether - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Aryl chloride - 1,3-thiazol-2-amine - Vinylogous thioester - Aryl halide - Pyridine - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Ketoxime - Carboxylic acid salt - Carboxamide group - Azetidine - Thioenolether - Amino acid or derivatives - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Amidine - Azacycle - Dialkylthioether - Organic 1,3-dipolar compound - Carboxylic acid amidine - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboximidamide - Hemithioaminal - Thioether - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Organic salt - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary amine - Amine - 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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