syn 505503
- Other Name: 2-(4-Chlorophenyl)-N-[2-(3,4-dihydroxyphenyl)ethyl]-2-prop-2-ynoxyacetamide
- InChIKey: SOBDGHQSQPRREQ-UHFFFAOYSA-N
- InChI: InChI=1S/C19H18ClNO4/c1-2-11-25-18(14-4-6-15(20)7-5-14)19(24)21-10-9-13-3-8-16(22)17(23)12-13/h1,3-8,12,18,22-23H,9-11H2,(H,21,24)
- SMILES: C#CCOC(C1=CC=C(C=C1)Cl)C(=O)NCCC2=CC(=C(C=C2)O)O
- Exact Mass: 359.09244
- Molecular Formula: C19H18ClNO4
-
Compound CID:
139597123
139597123
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.