DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:02:08 UTC
Update Date	2025-03-25 00:54:24 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02206110
Frequency	0.5
Structure
Chemical Formula	C₂₀H₂₉N₇O₁₄P₂
Molecular Mass	653.1248
SMILES	NC(=O)c1ccn(C2OC(CO[PH](=O)(=O)O[PH](O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)c1
InChI Key	PRGKLHVCYPZSMP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	purine nucleotides
Subclass	purine ribonucleotides
Direct Parent	purine ribonucleoside monophosphates
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	amino acids and derivatives azacyclic compounds carboxylic acids and derivatives heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monosaccharides n-substituted imidazoles organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary amines primary carboxylic acid amides purine nucleosides purines and purine derivatives pyrimidines and pyrimidine derivatives pyrrole carboxamides secondary alcohols substituted pyrroles tetrahydrofurans vinylogous amides
Substituents	primary carboxylic acid amide pyrrole-3-carboxylic acid or derivatives amino acid or derivatives purine ribonucleoside monophosphate monosaccharide substituted pyrrole imidazopyrimidine carboxylic acid derivative pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound pyrrole-3-carboxamide organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole alcohol vinylogous amide azacycle tetrahydrofuran purine nucleoside heteroaromatic compound carboxamide group oxacycle organic oxygen compound pyrrole secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound

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