A list of suspected surfactants from Schymanski et al. 2014. DOI: 10.1021/es4044374 with representative structures added. Dataset DOI: 10.5281/zenodo.2621971

Updated 21/11/2019 to contain representative explicit structures for species observed in the 2014 study. Note that for some species multiple isomers are possible; only one representative has been added per formula. Structures created using RChemMass (https://github.com/schymane/RChemMass/).

This is the collection associated with list S18 TSCASURF on the NORMAN Suspect List Exchange.

https://www.norman-network.com/?q=suspect-list-exchange

S18

TSCASURF

TSCA Surfactants

Surfactants XLSX (25/07/2017)

TSCA PEG XLSX (25/07/2017)

CompTox TSCA Surfactant List (subset)

Surfactant information compiled from TSCA by James Little while at Eastman Chemical. More information here.

Nov 14 update: added CSVs from major sheets of interest.

A curated NORMAN Network effort to provide information for substances of Unknown or Variable Composition, Complex Reaction Products, or Biological Materials (UVCBs). This also includes UVCB mappings from BioHackathon Europe 2022. Dataset DOI: 10.5281/zenodo.7414795.

v0.1.3: added BioHackathon UVCBs. v0.1.4: added EAWAGSURF. v0.1.5: added molecular formula to chemicals mapping for better table sorting. v0.1.6: added HESI UVCBs. v0.1.7: adjusted source display for annotation content of UVCBs. v0.1.8 added NIST polymers. v0.1.9 updated NIST polymers.