Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC=C(C=C1)C(=O)CC[NH2+]C(C(C)CC)C([O-])=O

InChIKey

InChIKey=QOEQXOGESSAQMR-UHFFFAOYSA-N

Formula

C17H25NO4

Mass

307.39

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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 homomonocyclic compounds

Substituents

Isoleucine or derivatives - Alkyl-phenylketone - Alpha-amino acid - Phenylketone - Phenol ether - Aryl ketone - Aryl alkyl ketone - Benzoyl - Phenoxy compound - Alkyl aryl ether - Benzenoid - Beta-aminoketone - Monocyclic benzene moiety - Quaternary ammonium salt - Ketone - Carboxylic acid salt - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic homomonocyclic 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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