Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)NC(CCCC(=O)NC1[C@@H]2SCC(CO)=C(N2C1=O)C(O)=O)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=DAAMJXFBBCNCTF-ZKPZBSICSA-N

Formula

C30H33N3O9S

Mass

611.67

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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 - Alpha-amino acid ester - Diphenylmethane - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Fatty acid ester - Meta-thiazine - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Fatty amide - N-acyl-amine - Carbamic acid ester - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Azetidine - Amino acid - Carboxamide group - Carboxylic acid ester - Thioether - Hemithioaminal - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Alcohol - Primary alcohol - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Amine - 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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