Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)NC(CCCC(=O)NC1[C@@H]2SCC(COC(=O)CC(C)=O)=C(N2C1=O)C(O)=O)C(O)=O

InChIKey

InChIKey=QMNNWTFMCXENFC-WOOZHMMNSA-N

Formula

C21H27N3O11S

Mass

529.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Beta lactams

Intermediate Tree Nodes

Cephems - Cephalosporins

Direct Parent

Cephalosporin 3'-esters

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cephalosporin 3'-ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Beta-keto acid - Fatty acid ester - Meta-thiazine - N-acyl-amine - Keto acid - Fatty acyl - Fatty amide - 1,3-dicarbonyl compound - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxylic acid ester - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Azetidine - Amino acid - Amino acid or derivatives - Ketone - Azacycle - Dialkylthioether - Carboxylic acid derivative - Hemithioaminal - Carboxylic acid - Thioether - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cephalosporin 3'-esters. These are cephalosporins that are esterified at the 3'-position.

External Descriptors

Not available

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