DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:27:55 UTC
Update Date	2025-03-21 18:40:15 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00129253
Frequency	19.7
Structure
Chemical Formula	C₁₁H₁₇N₅O₁₀P₂
Molecular Mass	441.0451
SMILES	Nc1ncnc2c1ncn2C1OC(CO)C(COP(=O)(O)O)C1OP(=O)(O)O
InChI Key	SMBXVLSGLCITBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	imidazopyrimidines
Subclass	purines and purine derivatives
Direct Parent	purines and purine derivatives
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrimidines and pyrimidine derivatives tetrahydrofurans
Substituents	pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam azole n-substituted imidazole alcohol azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

Showing information for DMID00129253