Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC1=CC(=CC(=C1)C#CCOC(=O)NCC1=CC=CC(CN)=C1)C#CCOC(=O)NC1CC(N(C1)C(=O)CCCC1=CC(CN)=CC=C1)C(=O)OC

InChIKey

InChIKey=ZYCVYBZUSFGDKG-UHFFFAOYSA-N

Formula

C42H47N5O9

Mass

765.864

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Proline or derivatives - N-acyl-alpha-amino acid - Benzylamine - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Methyl ester - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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