Metabolomics Structure Database

 
MW REGNO: 68211
Common Name:3,4-Dihydroxystyrene
Systematic Name:4-vinylbenzene-1,2-diol
RefMet Name:3,4-Dihydroxystyrene
Synonyms:4-Vinylbenzene-1,2-diol; Vinylcatechol; 4-Vinylcatechol; 3,4-Styrenediol [PubChem Synonyms]
Exact Mass:
136.0524 (neutral)    Calculate m/z:
Formula:C8H8O2
InChIKey:FBTSUTGMWBDAAC-UHFFFAOYSA-N
ClassyFire superclass:Benzenoids [C0002448]
ClassyFire class:Phenols [C0000134]
ClassyFire subclass:Benzenediols [C0001286]
ClassyFire direct parent:Catechols [C0000135]
SMILES:C=Cc1cc(O)c(O)cc1
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

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