Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](CC1=CSC=N1)NC(=O)[C@H](CC1=CC=CC=C1)CS(=O)(=O)C(C)(C)C(=O)N(C)CCC1=CC=CC=N1

InChIKey

InChIKey=PLNBWIQUDHGTKU-RCZVLFRGSA-N

Formula

C29H36N4O6S2

Mass

600.75

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Fatty acid ester - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Methyl ester - Thiazole - Tertiary carboxylic acid amide - Sulfonyl - Sulfone - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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