Metabolomics Structure Database

 
MW REGNO: 46279
Common Name:2-Deoxy-D-ribitol
Systematic Name:pentane-1,2,3,5-tetrol
RefMet Name:2-Deoxy-D-ribitol
Synonyms: [PubChem Synonyms]
Exact Mass:
136.0736 (neutral)    Calculate m/z:
Formula:C5H12O4
InChIKey:ZDAWZDFBPUUDAY-UHFFFAOYSA-N
ClassyFire superclass:Organic oxygen compounds [C0004603]
ClassyFire class:Organooxygen compounds [C0000323]
ClassyFire subclass:Alcohols and polyols [C0000129]
ClassyFire direct parent:Secondary alcohols [C0001661]
SMILES:C(CO)C(C(CO)O)O
Studies:Available studies (via RefMet name)

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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

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