Main compound image
s-4'-hydroxybupropion-sulfate
  • Other Name: S-4'-Hydroxybupropion-sulfate
  • InChIKey: GNULCSIJLSXTDL-QMMMGPOBSA-N
  • InChI: InChI=1S/C13H18ClNO5S/c1-8(15-13(2,3)4)12(16)9-5-6-11(10(14)7-9)20-21(17,18)19/h5-8,15H,1-4H3,(H,17,18,19)/t8-/m0/s1
  • SMILES: C[C@@H](C(=O)C1=CC(=C(C=C1)OS(=O)(=O)O)Cl)NC(C)(C)C
  • Exact Mass: 335.05942
  • Molecular Formula: C13H18ClNO5S
  • Compound CID: pubchemlite169501875 pubchem169501875
Hidden Reactions Filter Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products. These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph. To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.

You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
  • Carbon dioxide → Formylmethanofuran
  • Acrolein → Chembl3706542
  • Ethylene oxide → Acetyl-coa
  • Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.

Click on a node or edge to see details here.

Neighbours
All in View
Loading...