Structure Information
Structure

Compound Identification

SMILES

CNCCCN1C=CC2=C1C=CC=[N+]2CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(=N/OC(C)(C)C(O)=O)\C1=C(Cl)SC(N)=N1)C2=O)C(O)=O

InChIKey

InChIKey=GOGBKZMTLDNFLP-IIZJXZLRSA-O

Formula

C28H32ClN8O7S2

Mass

692.18

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems

Direct Parent

Cephalosporins

Alternative Parents

N-acyl-alpha amino acids and derivatives Pyrrolopyridines 2,4,5-trisubstituted thiazoles 1,3-thiazines Substituted pyrroles 2-amino-1,3-thiazoles Pyridinium derivatives Aryl chlorides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Secondary carboxylic acid amides Amino acids Azetidines Dialkylthioethers Dialkylamines Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Carbonyl compounds Primary amines Organochlorides Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyrrolopyridine - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Dicarboxylic acid or derivatives - Pyridine - Aryl chloride - 1,3-thiazol-2-amine - Aryl halide - Pyridinium - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azole - Thiazole - Tertiary carboxylic acid amide - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Azetidine - Tertiary amine - Amino acid or derivatives - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Primary amine - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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

Previous Back Next