Metabolomics Structure Database

 
MW REGNO: 133867
Common Name:5-(6-Aminopurin-9-Yl)-2-(Hydroxymethyl)Oxolan-3-Ol
Systematic Name:5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Synonyms: [PubChem Synonyms]
Exact Mass:
251.1018 (neutral)    Calculate m/z:
Formula:C10H13N5O3
InChIKey:OLXZPDWKRNYJJZ-UHFFFAOYSA-N
ClassyFire superclass:Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:Purine nucleosides [C0000479]
ClassyFire subclass:Purine 2'-deoxyribonucleosides [C0002177]
Massbank MS spectra:View MS spectra
SMILES:C1C(C(CO)OC1n1cnc2c(N)ncnc12)O
Studies:Available studies(via PubChem CID)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:636
CHEMBL ID:CHEMBL416340
Plant Metabolite Hub(Pmhub):MS000000142

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