Metabolomics Structure Database

 
MW REGNO: 37130
Common Name:Inosine
Systematic Name:9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-1H-purin-6-one
Synonyms: [PubChem Synonyms]
Exact Mass:
268.0808 (neutral)    Calculate m/z:
Formula:C10H12N4O5
InChIKey:UGQMRVRMYYASKQ-KQYNXXCUSA-N
ClassyFire superclass:Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:Purine nucleosides [C0000479]
ClassyFire subclass:Purine nucleosides [C0000479]
ClassyFire direct parent:Aromatic heteropolycyclic compounds
MoNA MS spectra:View spectra
Studies:Available studies

Select appropriate tab below to view additional details:

External database links:

PubChem CID:135398641
CHEBI ID:17596
HMDB ID:HMDB0000195
KEGG ID:C00294
Chemspider ID:5799
METLIN ID:84
BMRB ID:bmse000978
MetaCyc ID:INOSINE
EPA CompTox DB:DTXCID10210012

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

  logo