Compound Identification
SMILES
C[C@@H](O)CCCCN1C(=O)N(C)C2=C(N3CCCN(C(C)=O)C3=N2)C1=O
InChIKey
InChIKey=BYJBDBXEQHHTHK-LLVKDONJSA-N
Formula
C17H25N5O4
Mass
363.418
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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 Vinylogous amides Tertiary carboxylic acid amides Acetamides Heteroaromatic compounds Ureas Secondary alcohols Lactams Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Pyrimidone - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Azole - Acetamide - Vinylogous amide - Imidazole - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Urea - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Alcohol - Organic oxide - Carbonyl group - Organooxygen compound - Organic oxygen compound - 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