DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:29:44 UTC
Update Date	2025-03-21 18:41:18 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00133482
Frequency	18.9
Structure
Chemical Formula	C₈H₁₂N₄O₄
Molecular Mass	228.0859
SMILES	Nc1cnn(C2CC(O)C(CO)O2)c(=O)n1
InChI Key	ZPYDYSQNSAQWMR-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 heteromonocyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidolactams monosaccharides organic carbonic acids and derivatives organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines secondary alcohols tetrahydrofurans
Substituents	aromatic heteromonocyclic compound monosaccharide saccharide organic oxide organonitrogen compound organopnictogen compound primary alcohol imidolactam alcohol carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound 1,2,4-triazine amine organooxygen compound

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