DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:57:33 UTC
Update Date	2025-03-21 18:05:20 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00056347
Frequency	56.6
Structure
Chemical Formula	C₉H₁₂N₆O₄
Molecular Mass	268.092
SMILES	Nc1nnc2ncn(C3OC(CO)C(O)C3O)c2n1
InChI Key	IWJSDVVUZBRSTP-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	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles monosaccharides n-substituted imidazoles organopnictogen compounds oxacyclic compounds primary alcohols primary amines secondary alcohols tetrahydrofurans
Substituents	monosaccharide saccharide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol azole n-substituted imidazole alcohol 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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