Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](OCC1=CC=CC=C1)[C@H](O)C(=O)N[C@@H](CC(N)=O)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=PUSGTFJZOZBFOF-LCGRTSHQSA-N

Formula

C31H40N4O8

Mass

596.681

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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

Asparagine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Asparagine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Proline or derivatives - Alpha-amino acid amide - Benzyloxycarbonyl - Benzylether - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Fatty acid ester - Fatty amide - Monosaccharide - N-acyl-amine - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Secondary alcohol - Primary carboxylic acid amide - Organoheterocyclic compound - Ether - Dialkyl ether - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine 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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