Compound Identification
SMILES
CN(C[C@H](O)C1=CC(O)=CC=C1)C1=NC2=C(N1C)C(=O)N(C)C(=O)N2C.CN(C[C@@H](O)C1=CC(O)=CC=C1)C1=NC2=C(N1C)C(=O)N(C)C(=O)N2C
InChIKey
InChIKey=SYGUTEMRPYXBFS-IZIBOJBPSA-N
Formula
C34H42N10O8
Mass
718.772
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 Dialkylarylamines 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Pyrimidones N-substituted imidazoles Aminoimidazoles Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Lactams Secondary alcohols Ureas Azacyclic compounds Aromatic alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Dialkylarylamine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Pyrimidone - Monocyclic benzene moiety - Pyrimidine - Benzenoid - N-substituted imidazole - Aminoimidazole - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Lactam - Urea - Secondary alcohol - Azacycle - Organonitrogen compound - Aromatic alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Alcohol - Amine - 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