Compound Identification
SMILES
NC1=NC(=NS1)C(=N\OCF)\C(=O)NC1C2SCC(C[N+]3=CC=CC4=C3N=CN4OS([O-])(=O)=O)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=RQSHNFRXRRADSW-MRUKODCESA-N
Formula
C19H16FN9O9S3
Mass
629.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
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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 Imidazopyridines 1,3-thiazines Pyridinium derivatives N-substituted imidazoles Thiadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Organic sulfuric acids and derivatives Secondary carboxylic acid amides Amino acids Azetidines Thiohemiaminal derivatives Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Alkyl fluorides Primary amines Carbonyl compounds Organic zwitterions Hydrocarbon derivatives Organic salts Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Imidazopyridine - Meta-thiazine - N-substituted imidazole - Pyridine - Pyridinium - Organic sulfuric acid or derivatives - Tertiary carboxylic acid amide - Thiadiazole - Heteroaromatic compound - Azole - Imidazole - Amino acid - Azetidine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkylthioether - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Amine - Organic zwitterion - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic salt - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary amine - Organohalogen compound - Organooxygen compound - Organofluoride - Organonitrogen 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