DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:40:09 UTC
Update Date	2025-03-21 17:58:38 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00015728
Frequency	274.7
Structure
Chemical Formula	C₁₀H₁₃N₅O₃S
Molecular Mass	283.0739
SMILES	Nc1ncnc2c1ncn2C1OC(CS)C(O)C1O
InChI Key	HLJHWWUZHBUUAC-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 alkylthiols azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monosaccharides n-substituted imidazoles organopnictogen compounds organosulfur compounds oxacyclic compounds primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols tetrahydrofurans
Substituents	monosaccharide imidazopyrimidine organosulfur compound pyrimidine saccharide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole 1,2-diol n-substituted imidazole alcohol azacycle tetrahydrofuran 5'-deoxy-5'-thionucleoside heteroaromatic compound oxacycle organic oxygen compound secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound amine alkylthiol organooxygen compound

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