Structure Information
Structure

Compound Identification

SMILES

CO[C@H]1[C@@H](O)[C@@H](OC1=C)N1C=C(C#N)C2=C1NC=NC2=O

InChIKey

InChIKey=ICXWUWMRRVXBIT-GIPNMCIBSA-N

Formula

C13H12N4O4

Mass

288.263

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Pyrrolo[2,3-d]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolo[2,3-d]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolo[2,3-d]pyrimidine - Pyrimidone - Pyrimidine - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Tetrahydrofuran - Pyrrole - Secondary alcohol - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.

External Descriptors

Not available

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