Structure Information
Structure

Compound Identification

SMILES

CC(O)C(=O)C1CNC2=C(N1)C(=O)N=C(N)N2

InChIKey

InChIKey=HKCYZTKHPLJZDR-UHFFFAOYSA-N

Formula

C9H13N5O3

Mass

239.235

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Pterins and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pterins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pterin - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Acyloin - Pyrimidine - Alpha-aminoketone - Heteroaromatic compound - Vinylogous amide - Alpha-hydroxy ketone - 1,3-aminoalcohol - Secondary alcohol - Ketone - Azacycle - Secondary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Primary amine - Carbonyl group - Organic nitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.

External Descriptors

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