Compound Identification
SMILES
CC(CCN1C=NC2=C1C(=O)N(C)C(=O)N2C)NCC(O)C1=CC=C(O)C=C1
InChIKey
InChIKey=SYGFPBTXRCCAFS-UHFFFAOYSA-N
Formula
C19H25N5O4
Mass
387.44
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 Alkaloids and derivatives 1-hydroxy-2-unsubstituted benzenoids Pyrimidones Aralkylamines N-substituted imidazoles Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Lactams Secondary alcohols Ureas 1,2-aminoalcohols Dialkylamines Azacyclic compounds Aromatic alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Pyrimidone - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Vinylogous amide - Azole - Imidazole - Urea - Secondary alcohol - Lactam - 1,2-aminoalcohol - Azacycle - Secondary aliphatic amine - Secondary amine - Alcohol - Hydrocarbon derivative - Amine - Organic oxygen compound - Aromatic alcohol - Organic oxide - Organic nitrogen compound - 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