DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:53:24 UTC
Update Date	2025-03-21 18:03:49 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00046741
Frequency	71.5
Structure
Chemical Formula	C₁₀H₁₄N₆O₅S
Molecular Mass	330.0746
SMILES	Nc1ncnc2c1ncn2C1OC(CS(N)(=O)=O)C(O)C1O
InChI Key	PZCPDXIBWUXRPU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	5'-deoxyribonucleosides
Subclass	5'-deoxyribonucleosides
Direct Parent	5'-deoxyribonucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1,2-diols aminosulfonyl compounds azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monosaccharides n-substituted imidazoles organic oxides organic sulfonamides organopnictogen compounds organosulfonamides oxacyclic compounds primary amines purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols tetrahydrofurans
Substituents	organosulfonic acid or derivatives monosaccharide imidazopyrimidine organosulfur compound pyrimidine organosulfonic acid amide saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound imidolactam organoheterocyclic compound azole 1,2-diol n-substituted imidazole alcohol 5'-deoxyribonucleoside azacycle aminosulfonyl compound tetrahydrofuran heteroaromatic compound oxacycle sulfonyl organic oxygen compound organic sulfonic acid or derivatives secondary alcohol hydrocarbon derivative primary amine purine organic nitrogen compound organic sulfonic acid amide amine organooxygen compound

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