DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:56:41 UTC
Update Date	2025-03-21 18:05:02 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00054328
Frequency	59.3
Structure
Chemical Formula	C₁₀H₁₂N₅O₇P
Molecular Mass	345.0474
SMILES	Nc1ncnc2c1ncn2C1OC(CO)C2OOP(=O)(O)OC21
InChI Key	CIMTXQUXQXMTAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	imidazopyrimidines
Subclass	purines and purine derivatives
Direct Parent	purines and purine derivatives
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams n-substituted imidazoles organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrimidines and pyrimidine derivatives tetrahydrofurans
Substituents	pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam azole n-substituted imidazole alcohol azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound

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