Compound Identification
SMILES
[Na+].CN1N=NN=C1SCC1=C(N2C(SC1)C(NC(=O)CS(=O)(=O)CC#N)C2=O)C([O-])=O
InChIKey
InChIKey=FCUHLZZHVRZQNS-UHFFFAOYSA-M
Formula
C14H14N7NaO6S3
Mass
495.48
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 Alkylarylthioethers 1,3-thiazines Tetrazoles Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Azetidines Carboxylic acid salts Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Sulfenyl compounds Thiohemiaminal derivatives Nitriles Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic sodium salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Alkylarylthioether - Meta-thiazine - Azole - Sulfone - Sulfonyl - Tertiary carboxylic acid amide - Tetrazole - Heteroaromatic compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Azetidine - Azacycle - Organic alkali metal salt - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Sulfenyl compound - Hemithioaminal - Thioether - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic sodium salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic oxygen compound - Organic salt - Organic nitrogen compound - Cyanide - 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