DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:16:43 UTC
Update Date	2025-03-25 00:59:49 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02239454
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₄N₅O₁₀PS
Molecular Mass	427.0199
SMILES	O=P(O)(O)OC1C(CO)OC(n2cnc3c(NS(=O)(=O)O)ncnc32)C1O
InChI Key	FGBICWIWXYWKBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	ribonucleoside 3'-phosphates
Subclass	ribonucleoside 3'-phosphates
Direct Parent	ribonucleoside 3'-phosphates
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	azacyclic compounds heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkyl phosphates monosaccharides n-substituted imidazoles organic oxides organonitrogen compounds organopnictogen compounds oxacyclic compounds pentose phosphates primary alcohols purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols sulfuric acid monoamides tetrahydrofurans
Substituents	pentose phosphate monosaccharide imidazopyrimidine pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound organopnictogen compound primary alcohol imidolactam organoheterocyclic compound azole n-substituted imidazole ribonucleoside 3'-phosphate alcohol organic sulfuric acid or derivatives azacycle tetrahydrofuran heteroaromatic compound oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate sulfuric acid monoamide secondary alcohol hydrocarbon derivative purine organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound

Showing information for DMID02239454