Structure Information
Structure

Compound Identification

SMILES

CCSCCC(N)C(O)C(=O)NOC1=CC=CC=C1

InChIKey

InChIKey=QLTQDNNSWQOSAM-UHFFFAOYSA-N

Formula

C13H20N2O3S

Mass

284.37

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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

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Beta amino acid or derivatives - Phenoxy compound - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Secondary alcohol - Dialkylthioether - Sulfenyl compound - Thioether - Alcohol - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary aliphatic amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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