Structure Information
Structure

Compound Identification

SMILES

CNC1C=C(N)NC(SCC2=C(N3[C@@H](SC2)C(NC(=O)C(=N/OC(C)CC(O)=O)\C2=CSC(N)=N2)C3=O)C([O-])=O)=[N+]1N

InChIKey

InChIKey=GYUVQGLFLNALEZ-OZDHAAFKSA-N

Formula

C22H28N10O7S3

Mass

640.71

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 2,4-disubstituted thiazoles Dicarboxylic acids and derivatives Hydropyrimidines 2-amino-1,3-thiazoles 1,3-thiazines Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid salts Amino acids Ketene acetals Azetidines Secondary carboxylic acid amides Thiohemiaminal derivatives Carboximidamides Azacyclic compounds Dialkylthioethers Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary amines

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Meta-thiazine - 1,3-thiazol-2-amine - Hydropyrimidine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Carboxylic acid salt - Carboxamide group - Ketene acetal or derivatives - Azetidine - Secondary carboxylic acid amide - Amino acid or derivatives - Amino acid - Azacycle - Dialkylthioether - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Hemithioaminal - Thioether - Hydrocarbon derivative - Amine - Organic oxide - Organic zwitterion - Organic nitrogen compound - Organic salt - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - 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

Previous Back Next