m7 ae1124336
- Other Name: 2-Chloro-1-methoxy-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzene
- InChIKey: BNERTNNIWVHSMY-UHFFFAOYSA-N
- InChI: InChI=1S/C11H12ClF3O4S/c1-18-8-3-4-9(20(2,16)17)7(10(8)12)5-19-6-11(13,14)15/h3-4H,5-6H2,1-2H3
- SMILES: COC1=C(C(=C(C=C1)S(=O)(=O)C)COCC(F)(F)F)Cl
- Exact Mass: 332.00969
- Molecular Formula: C11H12ClF3O4S
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Compound CID:
139594376
139594376
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.
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.