Main compound image
[(3r,6r)-6-(methylamino)-4,4-diphenylheptan-3-yl] acetate
  • Other Name: [(3R,6R)-6-(methylamino)-4,4-diphenylheptan-3-yl] acetate
  • InChIKey: VWCUGCYZZGRKEE-DYESRHJHSA-N
  • InChI: InChI=1S/C22H29NO2/c1-5-21(25-18(3)24)22(16-17(2)23-4,19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-15,17,21,23H,5,16H2,1-4H3/t17-,21-/m1/s1
  • SMILES: CC[C@H](C(C[C@@H](C)NC)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C
  • Exact Mass: 339.21983
  • Molecular Formula: C22H29NO2
  • Compound CID: pubchemlite6101785 pubchem6101785
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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