DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:53:36 UTC
Update Date	2025-03-21 18:03:54 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00047201
Frequency	70.6
Structure
Chemical Formula	C₁₁H₁₄N₅O₆P
Molecular Mass	343.0682
SMILES	Nc1ncnc2c1ncn2C1C(O)C2OP(=O)(O)OC2C1CO
InChI Key	FTHOMFAYZPDUNZ-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 cyclic alcohols and derivatives dioxaphospholanes heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams n-substituted imidazoles organic oxides organic phosphoric acids and derivatives organopnictogen compounds oxacyclic compounds primary alcohols primary amines pyrimidines and pyrimidine derivatives secondary alcohols
Substituents	pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam azole n-substituted imidazole alcohol azacycle heteroaromatic compound 1,3_dioxaphospholane cyclic alcohol oxacycle organic oxygen compound secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine organooxygen compound

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