Structure Information
Structure

Compound Identification

SMILES

CCC[C@H]1CC(=O)C=CN1[C@@H]([C@@H](C)CC)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=QFUXADVPDSYFDI-QRFRQXIXSA-N

Formula

C21H29NO3

Mass

343.467

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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

Isoleucine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Isoleucine or derivatives - Alpha-amino acid ester - Benzyloxycarbonyl - Fatty acid ester - Tetrahydropyridine - Monocyclic benzene moiety - Hydropyridine - Fatty acyl - Benzenoid - Vinylogous amide - Carboxylic acid ester - Ketone - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Monocarboxylic acid or derivatives - Allylamine - Enamine - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

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