Compound Identification
SMILES
NC1NC2C(NCN2COCCO)C(=O)N1
InChIKey
InChIKey=DGPRPMHKGFLKMH-UHFFFAOYSA-N
Formula
C8H17N5O3
Mass
231.256
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
-
Subclass
Purines and purine derivatives
- Level 5 Purinones
-
Subclass
Purines and purine derivatives
-
Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Purinones
Alternative Parents
Alpha amino acids and derivatives Diazinanes Imidazolidines Secondary carboxylic acid amides Orthocarboxylic acid derivatives Ortho amides Lactams Hemiaminals Azacyclic compounds Aminals Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Purinone - 1,3-diazinane - Imidazolidine - Carboxamide group - Hemiaminal - Lactam - Ortho amide - Orthocarboxylic acid derivative - Secondary carboxylic acid amide - Carboxylic acid derivative - Aminal - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Alcohol - Amine - Primary alcohol - Hydrocarbon derivative - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available