Main compound image
bisoprolol metabolite m3 4-(2-hydroxy-3-isopropylaminopropoxy)benzoic acid
  • Other Name: 4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzoic acid
  • InChIKey: WONQRVASZHJNFS-UHFFFAOYSA-N
  • InChI: InChI=1S/C13H19NO4/c1-9(2)14-7-11(15)8-18-12-5-3-10(4-6-12)13(16)17/h3-6,9,11,14-15H,7-8H2,1-2H3,(H,16,17)
  • SMILES: CC(C)NCC(COC1=CC=C(C=C1)C(=O)O)O
  • Exact Mass: 253.13141
  • Molecular Formula: C13H19NO4
  • Compound CID: pubchemlite12540204 pubchem12540204
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.

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