Compound Identification
SMILES
NC1=NC(\C(=N\O)C(=O)N[C@H]2[C@H]3SCC(SC4=C(SCC[NH3+])C=NC=C4)=C(N3C2=O)C([O-])=O)=C(Cl)S1
InChIKey
InChIKey=CAZTUTWNIILQNT-QDECCPLTSA-N
Formula
C19H18ClN7O5S4
Mass
588.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
-
Level 5
Cephems
-
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 Quaternary ammonium salts Heteroaromatic compounds Ketoximes Thioenol ethers Tertiary amines Amino acids Secondary carboxylic acid amides Azetidines Carboxylic acid salts Dialkylthioethers Carboxylic acids Sulfenyl compounds Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic zwitterions Monoalkylamines Organic salts Organic oxides
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 - Pyridine - Aryl chloride - 1,3-thiazol-2-amine - Vinylogous thioester - Aryl halide - Ketoxime - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Amino acid - Amino acid or derivatives - Thioenolether - Secondary carboxylic acid amide - Carboxylic acid salt - Carboxamide group - Tertiary amine - Azetidine - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Hemithioaminal - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Carbonyl group - Organic zwitterion - Organic oxygen compound - Primary aliphatic amine - Organic salt - Primary amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur 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