Structure Information
Structure

Compound Identification

SMILES

OCCN(CCO)CCO.CC(SCC1=NC(=NO1)C1=CC=CC=C1)C(=O)NCC(O)=O

InChIKey

InChIKey=HBQNTFPTVZBWJD-UHFFFAOYSA-N

Formula

C20H30N4O7S

Mass

470.54

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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

Not available

Substituents

N-acyl-alpha-amino acid - Phenyl-1,2,4-oxadiazole - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Oxadiazole - 1,2,4-oxadiazole - 1,2-aminoalcohol - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Thioether - Alkanolamine - Carboxylic acid - Azacycle - Oxacycle - Sulfenyl compound - Monocarboxylic acid or derivatives - Dialkylthioether - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Amine - Organic oxide - Alcohol - Organic oxygen compound - Aromatic heteromonocyclic 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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