Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CC(C)C)NC(=O)C1=C(C=C(NCC(N)CS)C=C1)C1=CC=CC2=CC=CC=C12

InChIKey

InChIKey=XVWPFYDMUFBHBF-UHFFFAOYSA-N

Formula

C27H33N3O3S

Mass

479.64

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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 homopolycyclic compounds

Substituents

Leucine or derivatives - Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Naphthalene - Benzamide - Benzoic acid or derivatives - Phenylalkylamine - Benzoyl - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Secondary amine - Alkylthiol - Monocarboxylic acid or derivatives - Amine - Organooxygen compound - Primary amine - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary aliphatic amine - Organonitrogen compound - Aromatic homopolycyclic 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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