Structure Information
Structure

Compound Identification

SMILES

OS(=O)(=O)C(F)(F)F.CCOC(=O)CNC1=NC(=NC(=C1)C(=O)NC(CCC(O)=O)C(=O)N1CCN(CC1)C(=O)OCC)C1=CC=CC=C1

InChIKey

InChIKey=NIPOCZHMECLZJA-UHFFFAOYSA-N

Formula

C28H35F3N6O11S

Mass

720.67

Export to:

JSON SDF CSV

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

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

Previous Back Next