DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:20:35 UTC
Update Date	2025-03-21 18:36:39 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00111744
Frequency	23.8
Structure
Chemical Formula	C₁₂H₁₅N₅O₅
Molecular Mass	309.1073
SMILES	CC(=O)Nc1ncnc2c1cnn2C1OC(CO)C(O)C1O
InChI Key	WPVHFEWEFPIPPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	pyrazolo[3,4-d]pyrimidine glycosides
Subclass	pyrazolo[3,4-d]pyrimidine glycosides
Direct Parent	pyrazolo[3,4-d]pyrimidine glycosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	acetamides azacyclic compounds carbonyl compounds carboxylic acids and derivatives heteroaromatic compounds hydrocarbon derivatives imidolactams monosaccharides n-acetylarylamines organic oxides organopnictogen compounds oxacyclic compounds primary alcohols pyrazoles pyrazolo[3,4-d]pyrimidines pyrimidines and pyrimidine derivatives secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	carbonyl group n-acetylarylamine pyrazolo[3,4-d]pyrimidine glycoside monosaccharide n-arylamide carboxylic acid derivative pyrazole pyrimidine saccharide organic oxide pyrazolopyrimidine aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound primary alcohol imidolactam organoheterocyclic compound acetamide azole pyrazolo[3,4-d]pyrimidine alcohol azacycle tetrahydrofuran heteroaromatic compound carboxamide group oxacycle secondary carboxylic acid amide organic oxygen compound secondary alcohol hydrocarbon derivative organic nitrogen compound organooxygen compound

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