Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC(CSC(=O)OC1=CC=CC=C1C(=O)OCC1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=CEFKPZDGQXWXES-UHFFFAOYSA-N

Formula

C20H19NO7S

Mass

417.43

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

N-acyl-alpha-amino acid - Cysteine or derivatives - Benzoate ester - Benzyloxycarbonyl - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Monocyclic benzene moiety - Benzenoid - Acetamide - Monothioacetal - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Thiocarbonic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Sulfenyl compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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