DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:09:40 UTC
Update Date	2025-03-25 00:57:16 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02223725
Frequency	0.5
Structure
Chemical Formula	C₁₂H₁₇N₃O₇S
Molecular Mass	347.0787
SMILES	NC(=O)c1ncn(C2OC(CO)C(O)C2O)c1SCCC(=O)O
InChI Key	ZLGDMGWMZJNZFZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	imidazole ribonucleosides and ribonucleotides
Subclass	1-ribosyl-imidazolecarboxamides
Direct Parent	1-ribosyl-imidazolecarboxamides
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	2-heteroaryl carboxamides alkylarylthioethers azacyclic compounds carbonyl compounds carbonylimidazoles carboxylic acids heteroaromatic compounds hydrocarbon derivatives imidazoles monocarboxylic acids and derivatives monosaccharides n-substituted imidazoles organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds primary alcohols primary carboxylic acid amides secondary alcohols sulfenyl compounds tetrahydrofurans vinylogous amides vinylogous thioesters
Substituents	primary carboxylic acid amide carbonyl group carboxylic acid aromatic heteromonocyclic compound monosaccharide alkylarylthioether organosulfur compound carboxylic acid derivative 2-heteroaryl carboxamide aryl thioether saccharide organic oxide imidazole organonitrogen compound organopnictogen compound imidazole-4-carbonyl group primary alcohol organoheterocyclic compound azole n-substituted imidazole alcohol vinylogous thioester vinylogous amide sulfenyl compound azacycle tetrahydrofuran heteroaromatic compound carboxamide group 1-ribosyl-imidazolecarboxamide oxacycle monocarboxylic acid or derivatives organic oxygen compound thioether secondary alcohol hydrocarbon derivative organic nitrogen compound organooxygen compound

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