Compound Identification
SMILES
[Li+].OCC1=C(N2[C@H]([C@@H](NC(=O)C(O)C3=CC(Cl)=CC=C3)C2=O)S(=O)(=O)C1)C([O-])=O
InChIKey
InChIKey=WZJCZXVCHJJSCE-UMSLLVMRSA-M
Formula
C16H14ClLiN2O8S
Mass
436.74
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 Phenylacetamides Chlorobenzenes 1,3-thiazines Aryl chlorides Tertiary carboxylic acid amides Sulfones Secondary carboxylic acid amides Secondary alcohols Azetidines Carboxylic acid salts Organic lithium salts Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic metal halides Organonitrogen compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Aromatic alcohols Organic oxides Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Phenylacetamide - Halobenzene - Chlorobenzene - Meta-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Sulfone - Tertiary carboxylic acid amide - Secondary alcohol - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Organic metal halide - Organic lithium salt - Azacycle - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Organic zwitterion - Organic salt - Alcohol - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic alcohol - Organic oxide - Primary alcohol - 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