Main compound image
3-[5-[(6-ethylimino-8-propan-2-yl-7h-purin-3-yl)methyl]-2-methoxyphenoxy]cyclopentan-1-ol
  • Other Name: 3-[5-[(6-ethylimino-8-propan-2-yl-7H-purin-3-yl)methyl]-2-methoxyphenoxy]cyclopentan-1-ol
  • InChIKey: MMRJDHODQQEOAQ-UHFFFAOYSA-N
  • InChI: InChI=1S/C23H31N5O3/c1-5-24-22-20-23(27-21(26-20)14(2)3)28(13-25-22)12-15-6-9-18(30-4)19(10-15)31-17-8-7-16(29)11-17/h6,9-10,13-14,16-17,29H,5,7-8,11-12H2,1-4H3,(H,26,27)
  • SMILES: CCN=C1C2=C(N=C(N2)C(C)C)N(C=N1)CC3=CC(=C(C=C3)OC)OC4CCC(C4)O
  • Exact Mass: 425.24269
  • Molecular Formula: C23H31N5O3
  • Compound CID: pubchemlite135449988 pubchem135449988
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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