DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:10:27 UTC
Update Date	2025-03-25 00:57:32 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02225428
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₅N₅O₆
Molecular Mass	301.1022
SMILES	CC(=O)Nc1nn(C2OC(CO)C(O)C2O)c(=O)nc1N
InChI Key	RDANTMDWQKGJMZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic nitrogen compounds
Class	organonitrogen compounds
Subclass	n-arylamides
Direct Parent	n-acetylarylamines
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1,2,4-triazines acetamides amino acids and derivatives azacyclic compounds carbonyl compounds carboxylic acids and derivatives heteroaromatic compounds hydrocarbon derivatives imidolactams monosaccharides organic carbonic acids and derivatives organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	carbonyl group n-acetylarylamine aromatic heteromonocyclic compound amino acid or derivatives monosaccharide carboxylic acid derivative saccharide organic oxide organopnictogen compound primary alcohol imidolactam organoheterocyclic compound acetamide alcohol carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound carboxamide group oxacycle secondary carboxylic acid amide organic oxygen compound secondary alcohol triazine hydrocarbon derivative primary amine 1,2,4-triazine amine organooxygen compound

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