DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:54:49 UTC
Update Date	2025-03-21 18:04:21 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00050084
Frequency	81.6
Structure
Chemical Formula	C₁₀H₁₂N₅O₇P
Molecular Mass	345.0474
SMILES	Nc1nc(O)nc2c1ncn2C1OC(CO)C2OP(=O)(O)OC21
InChI Key	NUTCEPPZHZKDSQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	purine nucleotides
Subclass	cyclic purine nucleotides
Direct Parent	2',3'-cyclic purine nucleotides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds dioxaphospholanes heteroaromatic compounds hydrocarbon derivatives hydroxypyrimidines imidazoles imidolactams n-substituted imidazoles organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary alcohols primary amines purines and purine derivatives ribonucleoside 3'-phosphates tetrahydrofurans
Substituents	hydroxypyrimidine imidazopyrimidine pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam organoheterocyclic compound azole n-substituted imidazole ribonucleoside 3'-phosphate alcohol azacycle tetrahydrofuran heteroaromatic compound 1,3_dioxaphospholane oxacycle organic oxygen compound hydrocarbon derivative purine primary amine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound 2',3'-cyclic purine ribonucleotide

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