Structure Information
Structure

Compound Identification

SMILES

CC(OC(=O)OCCN)OC(=O)C1=C(CSC2C(NC(=O)C(=N/OCF)\C3=NSC(N)=N3)C(=O)N12)\C=N\N(C)C(=N)N1CCNCC1

InChIKey

InChIKey=KPOQEUHGKNRAJF-YYFLJRJDSA-N

Formula

C24H33FN12O8S2

Mass

700.72

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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

N-acyl-alpha amino acids and derivatives Primary aromatic amines Piperazines 1,3-thiazines Carbonic acid diesters Enoate esters Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Guanidines Secondary carboxylic acid amides Azetidines N-alkylated hydrazones Acetals Carboximidamides Dialkylthioethers Thiohemiaminal derivatives Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Hydrocarbon derivatives Carbonyl compounds Imines Monoalkylamines Organic oxides Alkyl fluorides Organofluorides Organopnictogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Meta-thiazine - Piperazine - Carbonic acid diester - Primary aromatic amine - 1,4-diazinane - Azole - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary carboxylic acid amide - Thiadiazole - Carboxylic acid ester - N-alkylated hydrazone - Secondary carboxylic acid amide - Guanidine - Carboxamide group - Azetidine - Amino acid or derivatives - Carbonic acid derivative - Acetal - Azacycle - Dialkylthioether - Carboxylic acid derivative - Carboximidamide - Hemithioaminal - Secondary aliphatic amine - Thioether - Secondary amine - Monocarboxylic acid or derivatives - Organonitrogen compound - Organopnictogen compound - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Organic oxide - Imine - Primary aliphatic amine - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organohalogen compound - Organofluoride - 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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