DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:42:11 UTC
Update Date	2025-03-25 00:47:16 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02160573
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₂N₄O₂
Molecular Mass	220.096
SMILES	Nc1ncnc2c1ccn2C1CC(CO)O1
InChI Key	GEMVKUIBSWPPTR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	pyrrolopyrimidines
Subclass	pyrrolo[2,3-d]pyrimidines
Direct Parent	pyrrolo[2,3-d]pyrimidines
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidolactams organopnictogen compounds oxacyclic compounds oxetanes primary alcohols primary amines pyrimidines and pyrimidine derivatives substituted pyrroles
Substituents	alcohol azacycle heteroaromatic compound substituted pyrrole pyrimidine oxacycle pyrrolo[2,3-d]pyrimidine organic oxygen compound aromatic heteropolycyclic compound pyrrole oxetane organonitrogen compound organopnictogen compound hydrocarbon derivative primary amine organic nitrogen compound primary alcohol imidolactam amine organooxygen compound

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