DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:14:06 UTC
Update Date	2025-03-21 18:33:27 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00095869
Frequency	28.9
Structure
Chemical Formula	C₁₁H₂₀N₅O₂₀P₅
Molecular Mass	696.939
SMILES	Nc1ncnc2c1ncn2C1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O
InChI Key	CILHEDMFTRAKJT-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 cyclitols and derivatives heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates n-substituted imidazoles organic oxides organooxygen compounds organopnictogen compounds primary amines pyrimidines and pyrimidine derivatives
Substituents	pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam azole n-substituted imidazole azacycle heteroaromatic compound cyclitol or derivatives 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

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