Compound Identification
SMILES
NC1(F)NC2=C(N=CN2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2F)C(=O)N1
InChIKey
InChIKey=KGYXJIWWUBOMFA-IVYYIIBHSA-N
Formula
C10H13F2N5O4
Mass
305.242
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
2-heteroaryl carboxamides N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Oxolanes Secondary carboxylic acid amides Fluorohydrins Secondary alcohols Lactams Ortho amides Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Amines Primary alcohols Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purinone - 2-heteroaryl carboxamide - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Oxolane - Carboxamide group - Fluorohydrin - Halohydrin - Lactam - Secondary carboxylic acid amide - Secondary alcohol - Ortho amide - Carboxylic acid derivative - Oxacycle - Azacycle - Organohalogen compound - Primary alcohol - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organic nitrogen compound - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic 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