Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CC1(C=NN=N1)C1CCOC2=C1C=CC(CN1CCC(F)CC1)=C2)NS(=O)(=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=PCXQUOUJUUELDW-UHFFFAOYSA-N

Formula

C28H34FN5O5S

Mass

571.67

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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 - P-toluenesulfonamide - Tosyl compound - 1-benzopyran - Benzopyran - Chromane - Benzenesulfonamide - Benzenesulfonyl group - Toluene - Aralkylamine - Fatty acid ester - Alkyl aryl ether - Fatty acyl - Piperidine - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Methyl ester - Sulfonyl - Organosulfonic acid or derivatives - Aminosulfonyl compound - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alkyl halide - Organohalogen compound - Organofluoride - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organosulfur compound - Alkyl fluoride - 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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