Main compound image
methyl-n-malonyl-n-(2,6-xylyl)-d-alaninate m7
  • Other Name: Methyl N-(malonyl)-N-(2,6-xylyl)-DL-alaninate
  • InChIKey: IRTDHGMDHHAJIE-UHFFFAOYSA-N
  • InChI: InChI=1S/C15H19NO5/c1-9-6-5-7-10(2)14(9)16(11(3)15(20)21-4)12(17)8-13(18)19/h5-7,11H,8H2,1-4H3,(H,18,19)
  • SMILES: CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC(=O)O
  • Exact Mass: 293.12632
  • Molecular Formula: C15H19NO5
  • Compound CID: pubchemlite13456437 pubchem13456437
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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