Main compound image
azoniaspironortropanol-glucuronide
  • Other Name: Azoniaspironortropanol-glucuronide
  • InChIKey: TXMMLXUYURDAJD-VWTCYHNSSA-O
  • InChI: InChI=1S/C17H27NO7/c19-12-13(20)15(16(22)23)25-17(14(12)21)24-11-7-9-3-4-10(8-11)18(9)5-1-2-6-18/h9-15,17,19-21H,1-8H2/p+1/t9-,10+,11?,12-,13-,14+,15-,17+/m0/s1
  • SMILES: C1CC[N+]2(C1)[C@@H]3CC[C@H]2CC(C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
  • Exact Mass: 358.18658
  • Molecular Formula: C17H28NO7+
  • Compound CID: pubchemlite169502145 pubchem169502145
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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