Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(CSC2=NC[C@@H]3[C@H]4[C@H](C(=O)N(C)C4=O)[C@@](C)(N23)C(=O)OC)C=C1

InChIKey

InChIKey=FUKLWTKGZGEAMI-VWEBPMOJSA-N

Formula

C21H23N3O6S

Mass

445.49

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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

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Methyl ester - Carboxylic acid imide - Pyrrolidine - Dicarboximide - 2-imidazoline - Tertiary amine - Carboxylic acid ester - Isothiourea - Lactam - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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