Structure Information
Structure

Compound Identification

SMILES

C[C@H](N)C(=S)N[C@@H](COCC1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=NSXZYTHWKZBIDC-ONGXEEELSA-N

Formula

C13H18N2O3S

Mass

282.36

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Taxonomic Classification

Taxonomy Tree

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

Direct Parent

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Benzylether - Monocyclic benzene moiety - Benzenoid - Thioamide - Amino acid - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Thiocarboxylic acid amide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Primary amine - Hydrocarbon derivative - Thiocarbonyl group - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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