Main compound image
noa 458422
  • Other Name: 2-(4-Chloro-phenyl)-N-[2-(4-hydroxy-3-methoxy-phenyl)-ethyl]-2-prop-2-ynyloxy-acetamide
  • InChIKey: HBYKLTZIVPBSNN-UHFFFAOYSA-N
  • InChI: InChI=1S/C20H20ClNO4/c1-3-12-26-19(15-5-7-16(21)8-6-15)20(24)22-11-10-14-4-9-17(23)18(13-14)25-2/h1,4-9,13,19,23H,10-12H2,2H3,(H,22,24)
  • SMILES: COC1=C(C=CC(=C1)CCNC(=O)C(C2=CC=C(C=C2)Cl)OCC#C)O
  • Exact Mass: 373.10809
  • Molecular Formula: C20H20ClNO4
  • Compound CID: pubchemlite23583625 pubchem23583625
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...