DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:37:02 UTC
Update Date	2025-03-21 17:57:32 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00008559
Frequency	571.6
Structure
Chemical Formula	C₁₀H₁₃N₅O₉P₂
Molecular Mass	409.0188
SMILES	Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C2OP(=O)(O)OC21
InChI Key	HJMBCNJTGVMDOA-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	2',3'-cyclic purine nucleotides azacyclic compounds dioxaphospholanes heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates n-substituted imidazoles organic oxides organooxygen compounds organopnictogen compounds oxacyclic compounds pentose phosphates primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives ribonucleoside 3'-phosphates tetrahydrofurans
Substituents	pentose phosphate purine ribonucleoside monophosphate imidazopyrimidine pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole ribonucleoside 3'-phosphate azacycle tetrahydrofuran heteroaromatic compound 1,3_dioxaphospholane oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate hydrocarbon derivative purine primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound 2',3'-cyclic purine ribonucleotide

Showing information for DMID00008559