DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:49:48 UTC
Update Date	2025-03-25 00:50:00 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02178081
Frequency	0.5
Structure
Chemical Formula	C₁₂H₁₇N₅O₂
Molecular Mass	263.1382
SMILES	CNc1ncnc2c1ncn2C1CC(O)C(CO)C1
InChI Key	XENSYAKMTVIDCK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	purine nucleosides
Subclass	purine nucleosides
Direct Parent	purine nucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1,3-substituted cyclopentyl purine nucleosides azacyclic compounds cyclic alcohols and derivatives cyclopentanols cyclopentyl nucleosides heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams n-substituted imidazoles organopnictogen compounds primary alcohols purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alkylarylamines
Substituents	imidazopyrimidine pyrimidine aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam organoheterocyclic compound azole n-substituted imidazole cyclopentyl nucleoside alcohol azacycle purine nucleoside heteroaromatic compound cyclic alcohol secondary amine secondary aliphatic/aromatic amine cyclopentanol 1,3-substituted cyclopentyl purine nucleoside organic oxygen compound secondary alcohol hydrocarbon derivative purine organic nitrogen compound organooxygen compound amine

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