DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:02:38 UTC
Update Date	2025-03-25 00:54:34 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02207246
Frequency	0.5
Structure
Chemical Formula	C₁₃H₁₇N₈O₇P
Molecular Mass	428.0958
SMILES	Nc1nc(N)c2c(n1)nc(N)c1ncn(C3OC(COP(=O)(O)O)C(O)C3O)c12
InChI Key	LWDACPUFXNCIFN-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	1,2-diols 2-halopyridines azacyclic compounds heteroaromatic compounds hydrocarbon derivatives hydroxypyridines imidazoles imidazopyridines imidolactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates polyhalopyridines primary amines pyrido[2,3-d]pyrimidines pyrimidines and pyrimidine derivatives secondary alcohols tetrahydrofurans
Substituents	pentose phosphate polyhalopyridine monosaccharide pentose-5-phosphate imidazopyridine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound pyridopyrimidine organopnictogen compound 2-halopyridine imidolactam organoheterocyclic compound azole 1,2-diol n-substituted imidazole alcohol imidazole[4,5-c]pyridine ribonucleoside,ribonucleotide or analogue azacycle tetrahydrofuran heteroaromatic compound hydroxypyridine oxacycle pyridine organic oxygen compound pyrido[2,3-d]pyrimidine phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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