Structure Information
Structure

Compound Identification

SMILES

C[C@H](NC(=O)[C@@H](O)[C@H](N)CSCC1CCCCC1)C1=CC=CC2=CC=CC=C12

InChIKey

InChIKey=WLYBMNMEJOMQSQ-USCONSEESA-N

Formula

C23H32N2O2S

Mass

400.58

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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 homopolycyclic compounds

Substituents

Beta amino acid or derivatives - Naphthalene - Fatty amide - Monosaccharide - N-acyl-amine - Benzenoid - Fatty acyl - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Sulfenyl compound - Thioether - Dialkylthioether - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Primary aliphatic amine - Alcohol - Organosulfur compound - Organic nitrogen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Aromatic homopolycyclic 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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