Compound Identification
SMILES
CN1C(CC(N)C(O)=O)=NC2=C1C(=O)N(C)C(=O)N2C
InChIKey
InChIKey=GNDLPXOVFGYSKO-UHFFFAOYSA-N
Formula
C11H15N5O4
Mass
281.272
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
-
Subclass
Purines and purine derivatives
- Level 5 Xanthines
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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
Xanthines
Alternative Parents
6-oxopurines Alpha amino acids Alkaloids and derivatives Pyrimidones Aralkylamines N-substituted imidazoles Heteroaromatic compounds Vinylogous amides Lactams Amino acids Ureas Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Alpha-amino acid - Alpha-amino acid or derivatives - Purinone - Alkaloid or derivatives - Pyrimidone - Aralkylamine - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Imidazole - Vinylogous amide - Azole - Urea - Amino acid or derivatives - Lactam - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Primary aliphatic amine - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.
External Descriptors
Not available