m3 phenyl-1-ethanoic acid-4-(1,1-dimethyl ethanoic acid)
- Other Name: 2-[4-(Carboxymethyl)phenyl]-2-methylpropanoic acid
- InChIKey: ZGOVDJDLOGPTTH-UHFFFAOYSA-N
- InChI: InChI=1S/C12H14O4/c1-12(2,11(15)16)9-5-3-8(4-6-9)7-10(13)14/h3-6H,7H2,1-2H3,(H,13,14)(H,15,16)
- SMILES: CC(C)(C1=CC=C(C=C1)CC(=O)O)C(=O)O
- Exact Mass: 222.08921
- Molecular Formula: C12H14O4
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Compound CID:
70014779
70014779
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.