Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CSCC(NC(=O)NC1=CC=CC=C1)C#N)C(O)=O

InChIKey

InChIKey=QOJKMYFKSUSUIZ-DTIOYNMSSA-N

Formula

C13H16N4O3S

Mass

308.36

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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 - Alpha amino acids and derivatives - Cysteine and derivatives

Direct Parent

L-cysteine-S-conjugates

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

L-cysteine-s-conjugate - Alpha-amino acid - N-phenylurea - L-alpha-amino acid - Monocyclic benzene moiety - Benzenoid - Amino acid - Urea - Carboxylic acid - Monocarboxylic acid or derivatives - Dialkylthioether - Sulfenyl compound - Thioether - Carbonitrile - Nitrile - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Organic oxide - Primary aliphatic amine - Cyanide - Carbonyl group - Organic oxygen compound - Amine - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as l-cysteine-s-conjugates. These are compounds containing L-cysteine where the thio-group is conjugated.

External Descriptors

Not available

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