DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:59:22 UTC
Update Date	2025-03-25 00:53:28 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02199825
Frequency	0.5
Structure
Chemical Formula	C₁₀H₉N₅O₄
Molecular Mass	263.0655
SMILES	Cn1c(=O)[nH]c(=O)c2c(=O)c3c([nH]c(=O)n3C)[nH]c21
InChI Key	VXGYNDHHWYAPFR-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 imidazoles imidazopyridines lactams methylpyridines n-substituted imidazoles organic carbonic acids and derivatives organic oxides organonitrogen compounds organooxygen compounds organopnictogen compounds polyhalopyridines pyrimidones vinylogous amides
Substituents	lactam polyhalopyridine pyrimidone imidazopyridine pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound 2-halopyridine azole n-substituted imidazole vinylogous amide carbonic acid derivative azacycle heteroaromatic compound methylpyridine pyridine organic oxygen compound pyrido[2,3-d]pyrimidine hydrocarbon derivative organic nitrogen compound organooxygen compound

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