Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NS(=O)(=O)C1=CC2=C(OC(=O)C(NC(C)=O)=C2)C=C1

InChIKey

InChIKey=ZBOVLDNRXIGMKN-SFHVURJKSA-N

Formula

C21H20N2O7S

Mass

444.46

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylalanine or derivatives - Alpha-amino acid ester - Coumarin - Amphetamine or derivatives - Benzopyran - 1-benzopyran - N-acetylarylamine - N-arylamide - Fatty acid ester - Pyranone - Monocyclic benzene moiety - Pyran - Organosulfonic acid amide - Fatty acyl - Benzenoid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methyl ester - Acetamide - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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