Compound Identification
SMILES
OC(=O)C[C@H]1[C@H](CN[C@@H]1C(O)=O)SC1=NC2=CC=CC=C2S1
InChIKey
InChIKey=WRRXBMRHBIWFML-JWYUURKGSA-N
Formula
C14H14N2O4S2
Mass
338.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Kainoids
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Kainoids
Direct Parent
4-arylsulfanyl-substituted kainoids
Alternative Parents
Proline and derivatives L-alpha-amino acids Benzothiazoles Pyrrolidine carboxylic acids Thia fatty acids Alkylarylthioethers Dicarboxylic acids and derivatives Benzenoids Thiazoles Heteroaromatic compounds Amino acids Dialkylamines Carboxylic acids Azacyclic compounds Sulfenyl compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-arylsulfanyl-substituted kainoid skeleton - Proline or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - 1,3-benzothiazole - Aryl thioether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Thia fatty acid - Alkylarylthioether - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Pyrrolidine - Thiazole - Amino acid - Azacycle - Secondary amine - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid - Secondary aliphatic amine - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4-arylsulfanyl-substituted kainoids. These are kainoids carrying an aryl sulfanyl group at the 4-position of the pyrrolidine ring.
External Descriptors
Not available