Structure Information
Structure

Compound Identification

SMILES

NCCCC[C@H](N)C(O)=O.CC1=C(N2[C@@H](SC1)[C@@H](NC(=O)C(N)C1=CC=CC=C1)C2=O)C(O)=O

InChIKey

InChIKey=CSXICSKZWGBACI-FURSUUSOSA-N

Formula

C22H31N5O6S

Mass

493.58

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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

Not available

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Phenylacetamide - Medium-chain fatty acid - Amino fatty acid - Aralkylamine - Meta-thiazine - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Fatty acid - Tertiary carboxylic acid amide - Amino acid or derivatives - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary amine - Amine - Organic nitrogen compound - Organooxygen compound - Primary aliphatic amine - Organic oxygen compound - Organonitrogen 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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