DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:49:53 UTC
Update Date	2025-03-25 00:50:01 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02178269
Frequency	0.5
Structure
Chemical Formula	C₉H₁₀N₄O₃
Molecular Mass	222.0753
SMILES	Cn1c(=O)c2c(N)c(O)cnc2n(C)c1=O
InChI Key	PPAWMUVLPNXJEY-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 hydroxypyridines lactams methylpyridines organic oxides organooxygen compounds organopnictogen compounds polyhalopyridines primary amines pyrimidones ureas vinylogous amides
Substituents	lactam polyhalopyridine pyrimidone pyrimidine urea organic oxide aromatic heteropolycyclic compound organonitrogen compound organopnictogen compound 2-halopyridine vinylogous amide carbonic acid derivative azacycle heteroaromatic compound hydroxypyridine methylpyridine pyridine organic oxygen compound pyrido[2,3-d]pyrimidine hydrocarbon derivative primary amine organic nitrogen compound amine organooxygen compound

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