Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=GWSLXXSCIUOULO-CXEDLLGBSA-N

Formula

C31H30N12O10S3

Mass

826.84

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