DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 12:20:19 UTC
Update Date	2025-03-24 21:35:22 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01825977
Frequency	0.7
Structure
Chemical Formula	C₂₆H₃₇N₇O₂₁P₃+
Molecular Mass	876.125
SMILES	Nc1ncnc2c1ncn2C1OC(CO[PH](=O)(=O)OP(=O)(O)O[PH](O)(O)OCC2OC([n+]3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)C(O)C2O)C(O)C1O
InChI Key	VTZWARDHSXUSMY-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	purine nucleosides
Subclass	purine nucleosides
Direct Parent	purine nucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	alpha amino acids amino acids azacyclic compounds carbonyl compounds carboxylic acids dicarboxylic acids and derivatives glutamic acid and derivatives heteroaromatic compounds hydrocarbon derivatives hydroxypyridines imidazoles imidolactams monosaccharides n-acyl-alpha amino acids n-substituted imidazoles organic cations organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary amines purines and purine derivatives pyridinecarboxylic acids and derivatives pyrimidines and pyrimidine derivatives secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	pyridine carboxylic acid or derivatives carbonyl group carboxylic acid amino acid or derivatives amino acid monosaccharide alpha-amino acid or derivatives imidazopyrimidine carboxylic acid derivative pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound alpha-amino acid organopnictogen compound organic cation imidolactam organoheterocyclic compound azole n-substituted imidazole n-acyl-alpha amino acid or derivatives alcohol azacycle n-acyl-alpha-amino acid tetrahydrofuran purine nucleoside heteroaromatic compound hydroxypyridine glutamic acid or derivatives carboxamide group oxacycle secondary carboxylic acid amide pyridine organic oxygen compound secondary alcohol dicarboxylic acid or derivatives hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound

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