DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:46:08 UTC
Update Date	2025-03-21 18:00:47 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00029300
Frequency	127.7
Structure
Chemical Formula	C₁₁H₁₇N₅O₁₁P₂
Molecular Mass	457.04
SMILES	Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C(OP(=O)(O)O)C1O
InChI Key	UGYQSGJEJMTOMD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic oxygen compounds
Class	organooxygen compounds
Subclass	carbohydrates and carbohydrate conjugates
Direct Parent	hexose phosphates
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds oxanes primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols
Substituents	imidazopyrimidine pyrimidine organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound oxane imidolactam organoheterocyclic compound azole n-substituted imidazole alcohol azacycle heteroaromatic compound oxacycle phosphoric acid ester monoalkyl phosphate secondary alcohol hexose phosphate hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate

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