Structure Information
Structure

Compound Identification

SMILES

CC(C)C[C@H](NC(=O)C1=CC2=C(O1)C=CC(OCCN1CCOCC1)=C2)C(=O)N[C@H]1CCCN(CC1=O)C(=O)CC1=CC=CC(=C1)C1=CC=CC=N1

InChIKey

InChIKey=KRMYDWCAHQJBOD-HEVIKAOCSA-N

Formula

C40H47N5O7

Mass

709.844

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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

Leucine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Leucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 2-phenylpyridine - Phenylacetamide - Benzofuran - 2-heteroaryl carboxamide - Furoic acid or derivatives - Phenol ether - Alkyl aryl ether - Azepane - Monocyclic benzene moiety - Fatty amide - Morpholine - N-acyl-amine - Oxazinane - Pyridine - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Furan - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Cyclic ketone - Carboxamide group - Ketone - Azacycle - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as leucine and derivatives. These are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

CHEBI:40306 : monocarboxylic acid amide - 1-benzofurans - morpholines - phenylpyridine - azepanes

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