Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(SCC(=O)N[C@H]2[C@H]3SCC(\C=C\C[N+]4=CC=CC=C4)=C(N3C2=O)C([O-])=O)S1
InChIKey
InChIKey=JDEJRJFXGKFASF-ILLWNSAZSA-N
Formula
C24H24N4O6S3
Mass
560.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
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Subclass
Beta lactams
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Class
Lactams
-
Superclass
Organoheterocyclic compounds
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 Thiazolecarboxylic acids and derivatives 2,4,5-trisubstituted thiazoles Alkylarylthioethers 1,3-thiazines Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azetidines Carboxylic acid esters Carboxylic acid salts Dialkylthioethers Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Alkylarylthioether - Meta-thiazine - Pyridine - Pyridinium - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Azetidine - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Secondary carboxylic acid amide - Dialkylthioether - Thioether - Hemithioaminal - Sulfenyl compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Organosulfur compound - Organic oxide - Organic salt - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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