Main compound image
2,4,4-trimethyl-3-oxopentanoate
  • Other Name: 2,4,4-Trimethyl-3-oxopentanoate
  • InChIKey: NVBMXONDBOFHAJ-UHFFFAOYSA-M
  • InChI: InChI=1S/C8H14O3/c1-5(7(10)11)6(9)8(2,3)4/h5H,1-4H3,(H,10,11)/p-1
  • SMILES: CC(C(=O)C(C)(C)C)C(=O)[O-]
  • Exact Mass: 157.08647
  • Molecular Formula: C8H13O3-
  • Compound CID: pubchemlite16061363 pubchem16061363
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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