Compound Identification
SMILES
COC1=CC(CN(C)CCCCCCCCN2C(=O)C3C(N=CN3C)N(C)C2=O)=CC(OC)=C1OC
InChIKey
InChIKey=MDAKIRYYLDKSKS-UHFFFAOYSA-N
Formula
C26H41N5O5
Mass
503.644
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
Purinones Alpha amino acids and derivatives Alkaloids and derivatives Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Anisoles Pyrimidones N-acyl ureas Aralkylamines Alkyl aryl ethers Diazinanes Imidazolines Dicarboximides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Formamidines Carboximidamides Carboxamidines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - Purinone - Alpha-amino acid or derivatives - Alkaloid or derivatives - Phenoxy compound - Methoxybenzene - Phenylmethylamine - Phenol ether - Benzylamine - Anisole - Aralkylamine - Ureide - Pyrimidone - N-acyl urea - Alkyl aryl ether - Benzenoid - Pyrimidine - 1,3-diazinane - Monocyclic benzene moiety - 2-imidazoline - Dicarboximide - Urea - Tertiary aliphatic amine - Tertiary amine - Carbonic acid derivative - Amino acid or derivatives - Formamidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Ether - Carboxylic acid derivative - Carboxylic acid amidine - Amidine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - 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