Structure Information
Structure

Compound Identification

SMILES

CCCN1C2=NC(=NC2=C2NC(CC3=NC=NC=C3)CC2C1=O)C1CCCC1

InChIKey

InChIKey=NXPFJYHKABIJCF-UHFFFAOYSA-N

Formula

C21H26N6O

Mass

378.48

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Aralkylamines Pyrimidines and pyrimidine derivatives Pyrrolidines Imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Enamines Dialkylamines Carboximidamides Carboxamidines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Aralkylamine - Pyrimidine - Imidazole - Pyrrolidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Carboxylic acid amidine - Secondary aliphatic amine - Enamine - Amidine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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