Compound Identification
SMILES
CC1(C)OC2C(CN=[N+]=N)OC(C2O1)N1C=NC2=C1NC(N)=NC2=O
InChIKey
InChIKey=KYWJUCLBVKOXEP-UHFFFAOYSA-O
Formula
C13H17N8O4
Mass
349.33
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
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Level 5
Purinones
- Level 6 Hypoxanthines
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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 Aminopyrimidines and derivatives Ketals Primary aromatic amines N-substituted imidazoles Monosaccharides Vinylogous amides Oxolanes 1,3-dioxolanes Heteroaromatic compounds Azo compounds Azo imides Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Hypoxanthine - Aminopyrimidine - Ketal - Pyrimidone - Monosaccharide - N-substituted imidazole - Pyrimidine - Primary aromatic amine - Meta-dioxolane - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Oxolane - Azo compound - Azo imide - Azacycle - Oxacycle - Acetal - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Amine - Organooxygen compound - Primary amine - Organic cation - 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