Compound Identification
SMILES
OC(C[N+]1=CC=C(SCC2=C(N3C(SC2)[C@H](NC(=O)CSC2=C(Cl)C=CC(Cl)=C2)C3=O)C(O)=O)C=C1)C(O)=O
InChIKey
InChIKey=ASJAJSVAMDMEII-COFLGROHSA-O
Formula
C24H22Cl2N3O7S3
Mass
631.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
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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 Thiophenol ethers Dichlorobenzenes Alkylarylthioethers Dicarboxylic acids and derivatives Aryl chlorides Alpha hydroxy acids and derivatives 1,3-thiazines Pyridinium derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Azetidines Secondary alcohols Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Azacyclic compounds Sulfenyl compounds Thiohemiaminal derivatives Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 1,4-dichlorobenzene - Thiophenol ether - Halobenzene - Chlorobenzene - Alkylarylthioether - Meta-thiazine - Hydroxy acid - Alpha-hydroxy acid - Aryl chloride - Dicarboxylic acid or derivatives - Pyridine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Pyridinium - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary alcohol - Azetidine - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Hemithioaminal - Thioether - Organic oxide - Organic oxygen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - 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