DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:04:41 UTC
Update Date	2025-03-21 18:28:41 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00073402
Frequency	40.6
Structure
Chemical Formula	C₁₀H₁₃N₅O₆S₂
Molecular Mass	363.0307
SMILES	Nc1ncnc2c1ncn2C1OC(CSS(=O)(=O)O)C(O)C1O
InChI Key	FYCIVABMDFIVRL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	5'-deoxyribonucleosides
Subclass	5'-deoxy-5'-thionucleosides
Direct Parent	5'-deoxy-5'-thionucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1,2-diols azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives s-alkyl thiosulfates secondary alcohols sulfenyl compounds tetrahydrofurans
Substituents	monosaccharide imidazopyrimidine organosulfur compound pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole 1,2-diol n-substituted imidazole alcohol sulfenyl compound azacycle tetrahydrofuran 5'-deoxy-5'-thionucleoside heteroaromatic compound s-alkyl thiosulfate oxacycle organic oxygen compound secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound amine organooxygen compound

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