Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(NC(=O)C1=C(C=C(NCC([NH3+])CS)C=C1)C1=CC=CC2=CC=CC=C12)C([O-])=O

InChIKey

InChIKey=PKMVDYSKPDHRLR-UHFFFAOYSA-N

Formula

C26H31N3O3S

Mass

465.61

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