DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:50:57 UTC
Update Date	2025-03-25 00:50:24 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02180700
Frequency	0.5
Structure
Chemical Formula	C₁₁H₁₆N₄O
Molecular Mass	220.1324
SMILES	Cc1c(C)n(C)c2[nH]c(N(C)C)nc(=O)c12
InChI Key	SLWREEADWDYFDX-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	aminopyrimidines and derivatives azacyclic compounds dialkylarylamines heteroaromatic compounds hydrocarbon derivatives n-methylpyrroles organic oxides organonitrogen compounds organooxygen compounds organopnictogen compounds pyrimidones substituted pyrroles vinylogous amides
Substituents	vinylogous amide n-methylpyrrole azacycle heteroaromatic compound pyrimidone substituted pyrrole pyrimidine aminopyrimidine organic oxide pyrrolo[2,3-d]pyrimidine organic oxygen compound aromatic heteropolycyclic compound pyrrole organonitrogen compound organopnictogen compound hydrocarbon derivative organic nitrogen compound dialkylarylamine organooxygen compound

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