Compound Identification
SMILES
CC(C)(C)OC(=O)NC1=NC(=CS1)C(=C(Cl)Cl)C(=O)NC1[C@@H]2SCC(CSC3=NN=NN3CC(O)=O)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=SJDYDVNEABRNHL-TYJDENFWSA-N
Formula
C22H22Cl2N8O8S3
Mass
693.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
-
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 Alkylarylthioethers 2,4-disubstituted thiazoles Dicarboxylic acids and derivatives 1,3-thiazines Vinylogous halides Heteroaromatic compounds Carbamate esters Tertiary carboxylic acid amides Tetrazoles Secondary carboxylic acid amides Azetidines Ketene acetals Sulfenyl compounds Thiohemiaminal derivatives Vinyl chlorides Azacyclic compounds Dialkylthioethers Chloroalkenes Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Meta-thiazine - Dicarboxylic acid or derivatives - Heteroaromatic compound - Azole - Vinylogous halide - Carbamic acid ester - Tertiary carboxylic acid amide - Tetrazole - Thiazole - Azetidine - Carboxamide group - Ketene acetal or derivatives - Secondary carboxylic acid amide - Azacycle - Chloroalkene - Haloalkene - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Vinyl halide - Vinyl chloride - Hemithioaminal - Thioether - Carbonyl group - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen 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