DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:31:00 UTC
Update Date	2025-03-21 18:41:50 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00136348
Frequency	18.4
Structure
Chemical Formula	C₁₁H₁₄N₅O₆P
Molecular Mass	343.0682
SMILES	COC1C2OP(=O)(O)OCC2OC1n1cnc2c(N)ncnc21
InChI Key	RILJRDKXGCYSFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	purine nucleotides
Subclass	cyclic purine nucleotides
Direct Parent	3',5'-cyclic purine nucleotides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds dialkyl ethers heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams n-substituted imidazoles organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives tetrahydrofurans
Substituents	ether imidazopyrimidine dialkyl ether pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole azacycle tetrahydrofuran heteroaromatic compound 3',5'-cyclic purine ribonucleotide oxacycle organic oxygen compound hydrocarbon derivative purine primary amine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound

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