Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CC1=CC=C(C=C1)C1=CC(CNC2=NC=CS2)=CC=C1)NS(=O)(=O)C1=C(C)C=C(C)C=C1C

InChIKey

InChIKey=JTGCFXHNGMRBLF-UHFFFAOYSA-N

Formula

C29H31N3O4S2

Mass

549.7

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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 ester - Biphenyl - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzylamine - Fatty acid ester - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Fatty acyl - 1,3-thiazol-2-amine - Aminosulfonyl compound - Thiazole - Sulfonyl - Azole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organonitrogen compound - Amine - 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

Not available

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