Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(O)C=CC=C1OCCCCCNC(=O)[C@H](CC1=CC(Cl)=C(C=C1)[C@@H]1CC(=O)NS1(=O)=O)NS(=O)(=O)C1=CC=CC=C1

InChIKey

InChIKey=LZJDVHWALQMKBR-IGKIAQTJSA-N

Formula

C31H34ClN3O10S2

Mass

708.19

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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 heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - Alpha-amino acid amide - O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzoate ester - Benzenesulfonamide - Amphetamine or derivatives - Benzenesulfonyl group - Benzoic acid or derivatives - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Gamma-sultam - Phenol - Thiazolidinedione - Chlorobenzene - Organosulfonic acid amide - Fatty amide - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Aryl halide - Aryl chloride - Vinylogous acid - Methyl ester - Aminosulfonyl compound - Thiazolidine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Azacycle - Ether - Organoheterocyclic compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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

CHEBI:47500 : organochlorine compound - benzoate ester - thiazolidinone - mixed diacylamine

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