Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C(F)(F)F.CCCCN(C)C1=NC(=NC(=C1)C(=O)NC(CCC(O)=O)C(=O)N1CCN(CC1)C(=O)OCC)C1=CC=CC=C1

InChIKey

InChIKey=PAHSENCRIVUICP-UHFFFAOYSA-N

Formula

C29H39F3N6O9S

Mass

704.72

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Piperazine-1-carboxylic acid - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Trifluoromethanesulfonate - Dialkylarylamine - Aminopyrimidine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrimidine - Imidolactam - Benzenoid - Methanesulfonate - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary carboxylic acid amide - Carbamic acid ester - Alkanesulfonic acid - Carboxamide group - Secondary carboxylic acid amide - Trihalomethane - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Alkyl halide - Organohalogen compound - Halomethane - Organofluoride - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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