DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:53:07 UTC
Update Date	2025-03-25 00:51:14 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02185589
Frequency	0.5
Structure
Chemical Formula	C₉H₁₄N₅O₁₃P₃
Molecular Mass	492.9801
SMILES	Nc1ncnc2c1ncn2C1OC(CO)(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)C1O
InChI Key	ASMRBPABQJUDKG-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 oxetanes primary amines pyrimidines and pyrimidine derivatives secondary alcohols
Substituents	pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam azole n-substituted imidazole alcohol azacycle heteroaromatic compound oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate oxetane secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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