Compound Identification
SMILES
CCN1C2=C(NC(\C=C\C3=CC(OC)=CC(OC)=C3)=N2)C(=O)N(CC)C1=O
InChIKey
InChIKey=OLBIZARPBIBQBZ-BQYQJAHWSA-N
Formula
C19H22N4O4
Mass
370.409
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 Dimethoxybenzenes Alkaloids and derivatives Styrenes Phenoxy compounds Anisoles Pyrimidones Alkyl aryl ethers Vinylogous amides Heteroaromatic compounds Imidazoles Lactams Ureas Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Dimethoxybenzene - M-dimethoxybenzene - Alkaloid or derivatives - Anisole - Phenol ether - Phenoxy compound - Styrene - Methoxybenzene - Pyrimidone - Alkyl aryl ether - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Azole - Imidazole - Urea - Lactam - Azacycle - Ether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen 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