DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:30:59 UTC
Update Date	2025-03-21 18:41:49 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00136294
Frequency	18.4
Structure
Chemical Formula	C₈H₁₁N₅O₄
Molecular Mass	241.0811
SMILES	Nc1nn2cc(C(O)C(O)CO)nc2c(=O)[nH]1
InChI Key	NXUFZZGNCYVSIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	triazines
Subclass	1,2,4-triazines
Direct Parent	1,2,4-triazines
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	aromatic alcohols azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles lactams n-substituted imidazoles organic oxides organopnictogen compounds primary alcohols primary amines secondary alcohols
Substituents	aromatic alcohol alcohol lactam azacycle heteroaromatic compound organic oxide organic oxygen compound aromatic heteropolycyclic compound imidazole organonitrogen compound secondary alcohol organopnictogen compound hydrocarbon derivative primary amine organic nitrogen compound primary alcohol 1,2,4-triazine amine organooxygen compound azole n-substituted imidazole

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