Main compound image
quinine-quinone
  • Other Name: Quinine-quinone
  • InChIKey: VKKJOCGTNRGRHK-MBDDYFIWSA-N
  • InChI: InChI=1S/C19H20N2O3/c1-2-11-10-21-6-5-12(11)7-17(21)19(24)15-9-18(23)20-16-4-3-13(22)8-14(15)16/h2-4,8-9,11-12,17,19,24H,1,5-7,10H2/t11-,12-,17-,19+/m0/s1
  • SMILES: C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=CC(=O)N=C4C3=CC(=O)C=C4)O
  • Exact Mass: 324.14739
  • Molecular Formula: C19H20N2O3
  • Compound CID: pubchemlite169502181 pubchem169502181
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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