DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:49:49 UTC
Update Date	2025-03-25 00:50:01 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02178128
Frequency	0.5
Structure
Chemical Formula	C₁₂H₁₈N₄O₁₀P₂
Molecular Mass	440.0498
SMILES	CNc1nccc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O
InChI Key	WGQKJISPAQGHHX-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 methylpyridines monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organic pyrophosphates organopnictogen compounds oxacyclic compounds pentose phosphates polyhalopyridines secondary alcohols secondary alkylarylamines tetrahydrofurans
Substituents	pentose phosphate polyhalopyridine monosaccharide pentose-5-phosphate imidazopyridine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound 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 methylpyridine secondary amine organic pyrophosphate secondary aliphatic/aromatic amine oxacycle pyridine organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound amine

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