Compound Identification
SMILES
NC1=NC(\C(=N\O)C(=O)N[C@H]2[C@@H]3SCC(SC4=C(SCCNC=O)C=NC=C4)=C(N3C2=O)C(O)=O)=C(Cl)S1
InChIKey
InChIKey=CLRXTJIPGXJQBW-LVCLBJTLSA-N
Formula
C20H18ClN7O6S4
Mass
616.1
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
-
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 2,4,5-trisubstituted thiazoles Alkylarylthioethers Vinylogous thioesters 1,3-thiazines 2-amino-1,3-thiazoles Aryl chlorides Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Ketoximes Thioenol ethers Azetidines Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Thiohemiaminal derivatives Dialkylthioethers Carboxylic acids Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Primary amines Organic oxides Organochlorides
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 - Alkylarylthioether - Meta-thiazine - Aryl chloride - Aryl halide - 1,3-thiazol-2-amine - Vinylogous thioester - Pyridine - Azole - Heteroaromatic compound - Ketoxime - Tertiary carboxylic acid amide - Thiazole - Thioenolether - Secondary carboxylic acid amide - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Sulfenyl compound - Hemithioaminal - Thioether - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Amine - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Primary amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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