Compound Identification
SMILES
CN1C2=C(N(CC(=O)NC3=CC4=C(COC4=O)C=C3)C=N2)C(=O)N(C)C1=O
InChIKey
InChIKey=WWKMCKAKPMYVOD-UHFFFAOYSA-N
Formula
C17H15N5O5
Mass
369.337
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
Phthalides 6-oxopurines Alkaloids and derivatives N-arylamides Pyrimidones N-substituted imidazoles Benzenoids Vinylogous amides Heteroaromatic compounds Ureas Secondary carboxylic acid amides Lactones Lactams Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Isobenzofuranone - Phthalide - Purinone - Isocoumaran - Alkaloid or derivatives - N-arylamide - Pyrimidone - N-substituted imidazole - Benzenoid - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Lactam - Lactone - Urea - Secondary carboxylic acid amide - Oxacycle - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - 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