Structure Information
Structure

Compound Identification

SMILES

CCC(C)[C@H](NC(=O)C1=CC(CN)=CC=C1)C(=O)NCCCCC(C(C)=O)[N+]([O-])=O

InChIKey

InChIKey=JGEMXHFPKRNAAN-FPCQFERPSA-N

Formula

C21H32N4O5

Mass

420.51

Export to:

JSON SDF CSV

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 - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Benzamide - Benzoic acid or derivatives - Phenylmethylamine - Benzylamine - Benzoyl - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Benzenoid - N-acyl-amine - Fatty acyl - Carboxamide group - Organic nitro compound - Secondary carboxylic acid amide - Ketone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Primary amine - Organic zwitterion - Amine - Carbonyl group - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Primary aliphatic amine - Organooxygen compound - Organonitrogen compound - 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

Previous Back Next