DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:19:44 UTC
Update Date	2025-03-21 18:36:15 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00109699
Frequency	24.4
Structure
Chemical Formula	C₁₁H₁₈N₄O₈S
Molecular Mass	366.0845
SMILES	Nc1c(C(=O)NCCS(=O)(=O)O)ncn1C1OC(CO)C(O)C1O
InChI Key	SCRZSQVNVNWYDK-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 amino acids and derivatives azacyclic compounds carbonyl compounds carbonylimidazoles carboxylic acids and derivatives heteroaromatic compounds hydrocarbon derivatives imidazoles monosaccharides n-substituted imidazoles organic oxides organopnictogen compounds organosulfonic acids oxacyclic compounds primary alcohols primary amines secondary alcohols secondary carboxylic acid amides sulfonyls tetrahydrofurans vinylogous amides
Substituents	organosulfonic acid or derivatives carbonyl group aromatic heteromonocyclic compound amino acid or derivatives organosulfonic acid monosaccharide organosulfur compound carboxylic acid derivative 2-heteroaryl carboxamide saccharide organic oxide imidazole organonitrogen compound organopnictogen compound imidazole-4-carbonyl group primary alcohol organoheterocyclic compound azole n-substituted imidazole alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound carboxamide group 1-ribosyl-imidazolecarboxamide oxacycle secondary carboxylic acid amide sulfonyl organic oxygen compound organic sulfonic acid or derivatives secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound amine organooxygen compound

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