Structure Information
Structure

Compound Identification

SMILES

OCC(NS(=O)(=O)C1=CC=C(Br)C=C1)C(=O)OCC(=O)C12CC3CC(CC(C3)C1)C2

InChIKey

InChIKey=BAYZIQODOVGYCN-UHFFFAOYSA-N

Formula

C21H26BrNO6S

Mass

500.4

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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 homopolycyclic compounds

Substituents

Alpha-amino acid ester - Serine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Alpha-acyloxy ketone - Beta-hydroxy acid - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Hydroxy acid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organohalogen compound - Primary alcohol - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homopolycyclic 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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