Compound Identification
SMILES
CN1C2=C(N(CC(=O)N3CC4(CCN(CCC5=CC=CC=C5)CC4)OC3=O)C=N2)C(=O)N(C)C1=O
InChIKey
InChIKey=DSRGPEAMMDAUGF-UHFFFAOYSA-N
Formula
C24H28N6O5
Mass
480.525
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
- Level 5 Xanthines
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
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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 Azaspirodecane derivatives Alkaloids and derivatives Phenethylamines Aralkylamines Pyrimidones Piperidines Oxazolidinones N-substituted imidazoles Vinylogous amides Carbamate esters Dicarboximides Heteroaromatic compounds Trialkylamines Ureas Lactams Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Azaspirodecane - Purinone - Phenethylamine - Alkaloid or derivatives - Aralkylamine - Pyrimidone - Monocyclic benzene moiety - N-substituted imidazole - Oxazolidinone - Piperidine - Benzenoid - Pyrimidine - Azole - Dicarboximide - Imidazole - Oxazolidine - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Tertiary aliphatic amine - Tertiary amine - Urea - Lactam - Amino acid or derivatives - Azacycle - Oxacycle - Carboxylic acid derivative - Organic oxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organooxygen 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