DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:17:19 UTC
Update Date	2025-03-21 18:35:04 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00103755
Frequency	46.7
Structure
Chemical Formula	C₁₀H₁₃N₅O₅
Molecular Mass	283.0917
SMILES	Nc1nc2c(c(=O)[nH]1)c(=O)[nH]n2C1CC(O)C(CO)O1
InChI Key	YNUDQVFGJYJHQT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	pyrazolopyrimidines
Subclass	pyrazolo[3,4-d]pyrimidines
Direct Parent	pyrazolo[3,4-d]pyrimidines
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives lactams monosaccharides organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrazoles pyrazolones pyrimidones secondary alcohols tetrahydrofurans vinylogous amides
Substituents	lactam monosaccharide pyrimidone pyrazole pyrimidine saccharide organic oxide aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound primary alcohol azole pyrazolo[3,4-d]pyrimidine alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound amine organooxygen compound pyrazolinone

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