Compound Identification
SMILES
CC1(C)O[C@@H]2[C@@H](CF)O[C@H]([C@@H]2O1)N1C=NC2=C1NC=NC2=O
InChIKey
InChIKey=SMQSEGYGDOZALH-WOUKDFQISA-N
Formula
C13H15FN4O4
Mass
310.285
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
-
Subclass
Purines and purine derivatives
-
Level 5
Purinones
- Level 6 Hypoxanthines
-
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
Purinones
Direct Parent
Hypoxanthines
Alternative Parents
6-oxopurines Pyrimidones Ketals Monosaccharides N-substituted imidazoles 1,3-dioxolanes Vinylogous amides Heteroaromatic compounds Oxolanes Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organopnictogen compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Hypoxanthine - Ketal - Pyrimidone - Monosaccharide - N-substituted imidazole - Pyrimidine - Meta-dioxolane - Azole - Imidazole - Oxolane - Heteroaromatic compound - Vinylogous amide - Acetal - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available