Compound Identification
SMILES
O\N=C(\C(=O)CCl)C(=O)NC1C2SCC(C=C)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=FPNIZVGTZSPJIJ-APSNUPSMSA-N
Formula
C13H12ClN3O6S
Mass
373.76
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 1,3-thiazines N-acyl amines Tertiary carboxylic acid amides Alpha-chloroketones Ketoximes Secondary carboxylic acid amides Azetidines Dialkylthioethers Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Organochlorides Hydrocarbon derivatives Alkyl chlorides Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Meta-thiazine - Fatty acyl - Fatty amide - N-acyl-amine - Alpha-haloketone - Alpha-chloroketone - Tertiary carboxylic acid amide - Ketoxime - Azetidine - Carboxamide group - Ketone - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Oxime - Alkyl halide - Alkyl chloride - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aliphatic 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