Main compound image
benz(a)anthracene-3,4-diol, 7,12-dimethyl-
  • Other Name: Benz(a)anthracene-3,4-diol, 7,12-dimethyl-
  • InChIKey: UOGIXWFTUIUULQ-UHFFFAOYSA-N
  • InChI: InChI=1S/C20H16O2/c1-11-13-5-3-4-6-14(13)12(2)19-15(11)7-8-17-16(19)9-10-18(21)20(17)22/h3-10,21-22H,1-2H3
  • SMILES: CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC(=C3O)O
  • Exact Mass: 288.11503
  • Molecular Formula: C20H16O2
  • Compound CID: pubchemlite51458 pubchem51458
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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