Structure Information
Structure

Compound Identification

SMILES

CC(O)C(=O)C1=CNC2=C(N1)C(=O)N=C(N)N2

InChIKey

InChIKey=JSTINQQZLTUAJB-UHFFFAOYSA-N

Formula

C9H11N5O3

Mass

237.219

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

Not available

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