Compound Identification
SMILES
C[C@H](O\N=C(/C(=O)N[C@H]1C2SCC(C[N+]3=CC=CC4=C(N)NN=C34)=C(N2C1=O)C([O-])=O)C1=C(Cl)SC(N)=N1)C(O)=O
InChIKey
InChIKey=UZKQBAHQBRZQMH-FJBYFVLYSA-N
Formula
C22H20ClN9O7S2
Mass
622.03
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 Pyrazolopyridines 2,4,5-trisubstituted thiazoles Dicarboxylic acids and derivatives Aryl chlorides 2-amino-1,3-thiazoles 1,3-thiazines Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Pyrazoles Amino acids Carboxylic acid salts Tertiary amines Azetidines Secondary carboxylic acid amides Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Pyrazolopyridine - 2,4,5-trisubstituted 1,3-thiazole - Meta-thiazine - Dicarboxylic acid or derivatives - 1,3-thiazol-2-amine - Aryl chloride - Pyridine - Aryl halide - Pyridinium - Heteroaromatic compound - Azole - Pyrazole - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid salt - Hemithioaminal - Dialkylthioether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Thioether - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Organic zwitterion - Organic salt - Hydrocarbon derivative - Amine - Organic oxide - 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