DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:46:11 UTC
Update Date	2025-03-25 00:48:42 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02169711
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₂N₄O₂
Molecular Mass	220.096
SMILES	CCc1c(C)c(=O)[nH]c2[nH]c(N)nc(=O)c12
InChI Key	GMCHPDLPLXMCME-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	pyridopyrimidines
Subclass	pyrido[2,3-d]pyrimidines
Direct Parent	pyrido[2,3-d]pyrimidines
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	2-halopyridines azacyclic compounds heteroaromatic compounds hydrocarbon derivatives lactams methylpyridines organic oxides organooxygen compounds organopnictogen compounds polyhalopyridines primary amines pyridinones pyrimidones vinylogous amides
Substituents	lactam polyhalopyridine pyrimidone pyrimidine organic oxide aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound 2-halopyridine vinylogous amide azacycle heteroaromatic compound methylpyridine pyridine organic oxygen compound pyrido[2,3-d]pyrimidine hydrocarbon derivative primary amine organic nitrogen compound pyridinone amine organooxygen compound

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