DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:14:47 UTC
Update Date	2025-03-25 00:59:07 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02235136
Frequency	0.5
Structure
Chemical Formula	C₁₃H₁₃N₅O₇
Molecular Mass	351.0815
SMILES	O=c1[nH]c(=O)c2[nH]c(=O)c3ncn(C4OC(CO)C(O)C4O)c3c2[nH]1
InChI Key	ZQNGNOHRCKVXSF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	imidazole[4,5-c]pyridine ribonucleosides and ribonucleotides
Subclass	imidazole[4,5-c]pyridine ribonucleosides and ribonucleotides
Direct Parent	imidazole[4,5-c]pyridine ribonucleosides and ribonucleotides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	2-halopyridines azacyclic compounds heteroaromatic compounds hydrocarbon derivatives hydroxypyridines imidazoles imidazopyridines lactams monosaccharides n-substituted imidazoles organic carbonic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds polyhalopyridines primary alcohols pyridinones pyridopyrimidines pyrimidones secondary alcohols tetrahydrofurans vinylogous amides
Substituents	lactam polyhalopyridine monosaccharide pyrimidone imidazopyridine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound pyridopyrimidine organopnictogen compound 2-halopyridine primary alcohol organoheterocyclic compound azole n-substituted imidazole alcohol imidazole[4,5-c]pyridine ribonucleoside,ribonucleotide or analogue vinylogous amide carbonic acid derivative azacycle tetrahydrofuran heteroaromatic compound hydroxypyridine oxacycle pyridine organic oxygen compound secondary alcohol hydrocarbon derivative organic nitrogen compound pyridinone organooxygen compound

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