Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)NC(CSCC(=O)NC1=NC=C(S1)C1=C(N2C(C(NC(=O)CSC3=CC(Cl)=C(Cl)C=C3)C2=O)S(=O)C1)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)OC(C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=HOPQYKFRFIDHGQ-UHFFFAOYSA-N

Formula

C54H49Cl2N5O10S4

Mass

1127.15

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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 - N-acyl-alpha amino acid or derivatives - Diphenylmethane - Cysteine or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Aryl thioether - Thiophenol ether - N-arylamide - 1,2-dichlorobenzene - 2,5-disubstituted 1,3-thiazole - Chlorobenzene - Alkylarylthioether - Halobenzene - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Aryl halide - Aryl chloride - Meta-thiazine - Tertiary carboxylic acid amide - Thiazole - Carbamic acid ester - Azole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Azetidine - Carboxamide group - Carboxylic acid ester - Sulfoxide - Secondary carboxylic acid amide - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Sulfinyl compound - Thioether - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - 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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