Structure Information
Structure

Compound Identification

SMILES

CCC(C)C(NC(=O)OC(C)(C)C)C(=O)OC1=C(Cl)C=C2C(CC)=CC(=O)OC2=C1

InChIKey

InChIKey=WOOGCEFZOMKTLA-UHFFFAOYSA-N

Formula

C22H28ClNO6

Mass

437.92

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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 heteropolycyclic compounds

Substituents

Isoleucine or derivatives - Alpha-amino acid ester - Coumarin - Benzopyran - 1-benzopyran - Fatty acid ester - Pyranone - Fatty acyl - Benzenoid - Pyran - Aryl chloride - Aryl halide - Heteroaromatic compound - Carbamic acid ester - Carboxylic acid ester - Lactone - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic 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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