syn521195
- Other Name: 2-(4-Chlorophenyl)-N-[2-(3-hydroxy-4-prop-2-enoxyphenyl)ethyl]-2-prop-2-ynoxyacetamide
- InChIKey: QIUKZMWEKZCWNT-UHFFFAOYSA-N
- InChI: InChI=1S/C22H22ClNO4/c1-3-13-27-20-10-5-16(15-19(20)25)11-12-24-22(26)21(28-14-4-2)17-6-8-18(23)9-7-17/h2-3,5-10,15,21,25H,1,11-14H2,(H,24,26)
- SMILES: C=CCOC1=C(C=C(C=C1)CCNC(=O)C(C2=CC=C(C=C2)Cl)OCC#C)O
- Exact Mass: 399.12374
- Molecular Formula: C22H22ClNO4
-
Compound CID:
139596768
139596768
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.