Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(OCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CC(=O)OC2O)C2=CC=CC=C12

InChIKey

InChIKey=XXQCRRRNRLLOKC-UYHNVOLQSA-N

Formula

C23H28N2O7

Mass

444.484

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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 - Naphthalene - Anisole - Phenol ether - Alkyl aryl ether - N-acyl-amine - Fatty acyl - Fatty amide - Benzenoid - Gamma butyrolactone - Oxolane - Hemiacetal - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Lactone - Oxacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - 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

Not available

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