Structure Information
Structure

Compound Identification

SMILES

CC1=NC2=CN=NN2C(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)C(=N\OCC2=CC(O)=C(O)C=C2C(O)=O)\C2=CSC(N)=N2)C3=O)C(O)=O)=C1

InChIKey

InChIKey=ILSZIYLBIAMISR-QVNHZKGGSA-N

Formula

C27H23N9O9S3

Mass

713.72

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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 - Dihydroxybenzoic acid - Alpha-amino acid or derivatives - Hydroxybenzoic acid - Benzoic acid or derivatives - Benzoic acid - Triazolopyrimidine - Aryl thioether - Benzoyl - Catechol - 2,4-disubstituted 1,3-thiazole - 1-hydroxy-2-unsubstituted benzenoid - Alkylarylthioether - Phenol - Meta-thiazine - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Benzenoid - Pyrimidine - Tertiary carboxylic acid amide - 1,2,3-triazole - Triazole - Thiazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Sulfenyl compound - Hemithioaminal - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Azacycle - Amine - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - 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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