A curated collection of transformation products and metabolic reactions extracted from Hazardous Substances Data Bank content available through PubChem. The dataset includes parent compounds, metabolites, transformation pathways, and supporting toxicological or metabolic literature references.
Every version stays downloadable as CSV; only the current version is active in the public graph.
Version 1(viewing)
Published Jul 25, 2026 · 1,285 reaction(s)
LCSB-ECI; Krier, J.; Palm, E.; Chirsir, P.; Komolo, J.; Lontsie Zanmene, M.; Gómez Navarro, O.; Schymanski, E.; PubChem Team; Bolton, E.; Thiessen, P.; Zhang, J. S68 | HSDBTPS. Zenodo. DOI: 10.5281/zenodo.3827487.