Compound Identification
SMILES
CC(O)CCCCN1C(=O)N(C)C2=C(N(C)C(NCCCOCCOCCOCCCN)=N2)C1=O
InChIKey
InChIKey=AQIZASVHWRJELP-UHFFFAOYSA-N
Formula
C23H42N6O6
Mass
498.625
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
-
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 Alkaloids and derivatives Pyrimidones N-substituted imidazoles Aminoimidazoles Vinylogous amides Heteroaromatic compounds Ureas Secondary alcohols Lactams Dialkyl ethers Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Pyrimidone - Aminoimidazole - Pyrimidine - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Secondary alcohol - Dialkyl ether - Ether - Azacycle - Primary aliphatic amine - Amine - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Primary amine - Organonitrogen compound - 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