Compound Identification
SMILES
[O-]C(=O)C1=C(C[N+]23CCC(CC2)CC3)CS[C@@H]2[C@H](NC(=O)CSC3=C(Cl)C=CC(Cl)=C3)C(=O)N12
InChIKey
InChIKey=ORVLYAGFEGYGFL-QYFHAUOXSA-N
Formula
C23H25Cl2N3O4S2
Mass
542.49
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 - Cephalosporins
Direct Parent
3'-quaternary ammonium cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives Dichlorobenzenes Thiophenol ethers Quinuclidines Alkylarylthioethers 1,3-thiazines Aryl chlorides Piperidines Tetraalkylammonium salts Tertiary carboxylic acid amides Carboxylic acid salts Tertiary amines Azetidines Amino acids Secondary carboxylic acid amides Carboxylic acids Thiohemiaminal derivatives Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Sulfenyl compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3'-quaternary ammonium cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Quinuclidine - Aryl thioether - Thiophenol ether - 1,4-dichlorobenzene - Halobenzene - Alkylarylthioether - Chlorobenzene - Meta-thiazine - Aryl chloride - Piperidine - Monocyclic benzene moiety - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tetraalkylammonium salt - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Tertiary amine - Thioether - Hemithioaminal - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organic salt - Organooxygen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-quaternary ammonium cephalosporins. These are cephalosporins that are substituted at the 3'-position by a quaternary ammonium group.
External Descriptors
Not available