Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@]1(CC2=CC=C(F)C=C2)[C@@H]2[C@H](CN1C(=O)C1=CC=CC=C1)CC1=C2C=C(N1CC1=CC=C(C=C1)S(C)(=O)=O)C(=O)N1CCCC1

InChIKey

InChIKey=MJQKHCWYHYTJAR-TZHCILSOSA-N

Formula

C38H38FN3O6S

Mass

683.8

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha-amino acid - Alpha-amino acid ester - Amphetamine or derivatives - Benzoic acid or derivatives - Benzenesulfonyl group - Benzamide - 2-heteroaryl carboxamide - N-acylpyrrolidine - Benzoyl - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Halobenzene - Fatty acid ester - Fluorobenzene - Substituted pyrrole - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Aryl halide - Sulfonyl - Sulfone - Pyrrolidine - Pyrrole - Tertiary carboxylic acid amide - Methyl ester - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organofluoride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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