Compound Identification
SMILES
CCOC1=C(NCCCCCNC2=NC(=O)C3=C(N2)N(CC)C(=O)N3)C(=O)C1=O
InChIKey
InChIKey=XFGRFRMWSMHNTP-UHFFFAOYSA-N
Formula
C18H24N6O5
Mass
404.427
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 Secondary alkylarylamines Pyrimidones Aminopyrimidines and derivatives Alkyl aryl ethers N-substituted imidazoles Vinylogous esters Vinylogous amides Heteroaromatic compounds Ureas Cyclic ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Hypoxanthine - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - N-substituted imidazole - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous ester - Vinylogous amide - Urea - Cyclic ketone - Azacycle - Ether - Secondary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - 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