Structure Information
Structure

Compound Identification

SMILES

OC(CC(O)=O)OCC1=C(N2C(SC1)C(NC(=O)CCCC(=O)C(O)=O)C2=O)C(O)=O

InChIKey

InChIKey=KQAYETGNHYAWFU-UHFFFAOYSA-N

Formula

C17H20N2O11S

Mass

460.41

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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

Aliphatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Beta-hydroxy acid - Meta-thiazine - Alpha-keto acid - Fatty amide - Hydroxy acid - Keto acid - N-acyl-amine - Fatty acyl - Tertiary carboxylic acid amide - Alpha-hydroxy ketone - Secondary carboxylic acid amide - Carboxamide group - Hemiacetal - Azetidine - Ketone - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Aliphatic 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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