Main compound image
dha+gsh+o
  • Other Name: Dha+gsh+O
  • InChIKey: PHHOOXOELQKEGG-UHFFFAOYSA-N
  • InChI: InChI=1S/C18H29ClN8O7S/c1-8(2)22-17-24-16(19)25-18(26-17)27(34)9(3)35-7-11(14(31)21-6-13(29)30)23-12(28)5-4-10(20)15(32)33/h8-11,34H,4-7,20H2,1-3H3,(H,21,31)(H,23,28)(H,29,30)(H,32,33)(H,22,24,25,26)
  • SMILES: CC(C)NC1=NC(=NC(=N1)Cl)N(C(C)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)O
  • Exact Mass: 536.15684
  • Molecular Formula: C18H29ClN8O7S
  • Compound CID: pubchemlite177546097 pubchem177546097
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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