Main compound image
(2r,3s)-2-(diphenylmethyl)-n-{[2-methoxy-5-(prop-1-en-2-yl)phenyl]methyl}-1-azabicyclo[2.2.2]octan-3-amine
  • Other Name: (2R,3S)-2-benzhydryl-N-[(2-methoxy-5-prop-1-en-2-ylphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
  • InChIKey: CVTMENNEXOZZEZ-IOWSJCHKSA-N
  • InChI: InChI=1S/C31H36N2O/c1-22(2)26-14-15-28(34-3)27(20-26)21-32-30-25-16-18-33(19-17-25)31(30)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-15,20,25,29-32H,1,16-19,21H2,2-3H3/t30-,31+/m0/s1
  • SMILES: CC(=C)C1=CC(=C(C=C1)OC)CN[C@@H]2[C@H](N3CCC2CC3)C(C4=CC=CC=C4)C5=CC=CC=C5
  • Exact Mass: 452.28276
  • Molecular Formula: C31H36N2O
  • Compound CID: pubchemlite154699537 pubchem154699537
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.

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