Compound Identification
SMILES
COC1=CC=CC=C1S[C@H]1CN[C@@H]([C@H]1CC(O)=O)C(O)=O
InChIKey
InChIKey=GGLOAVBRQWFQCL-QWRKXWFKSA-N
Formula
C14H17NO5S
Mass
311.35
Taxonomic Classification
Taxonomy Tree
-
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 Thiophenol ethers Pyrrolidine carboxylic acids Phenoxy compounds Methoxybenzenes Anisoles Thia fatty acids Alkyl aryl ethers Alkylarylthioethers Dicarboxylic acids and derivatives Amino acids Sulfenyl compounds Dialkylamines Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-arylsulfanyl-substituted kainoid skeleton - Proline or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Pyrrolidine carboxylic acid - Methoxybenzene - Pyrrolidine carboxylic acid or derivatives - Thiophenol ether - Alkyl aryl ether - Thia fatty acid - Alkylarylthioether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Pyrrolidine - Amino acid - Secondary amine - Sulfenyl compound - Azacycle - Thioether - Organoheterocyclic compound - Carboxylic acid - Ether - Secondary aliphatic amine - Organic oxide - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic 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