DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:42:10 UTC
Update Date	2025-03-25 00:47:16 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02160552
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₅N₆O₈PS
Molecular Mass	410.041
SMILES	Nc1ncnc2c1nc(S(N)(=O)=O)n2C1CC(O)C(COP(=O)(O)O)O1
InChI Key	TURHRCQYNPQPJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic oxygen compounds
Class	organooxygen compounds
Subclass	carbohydrates and carbohydrate conjugates
Direct Parent	pentose phosphates
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	aminosulfonyl compounds azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds organosulfonamides oxacyclic compounds primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols tetrahydrofurans
Substituents	organosulfonic acid or derivatives pentose phosphate imidazopyrimidine organosulfur compound pyrimidine organosulfonic acid amide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole alcohol azacycle aminosulfonyl compound tetrahydrofuran heteroaromatic compound oxacycle sulfonyl phosphoric acid ester organic sulfonic acid or derivatives monoalkyl phosphate secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate

Showing information for DMID02160552