hydroxymethyl derivative
- Other Name: 2-(Hydroxymethyl)-5-(2-hydroxy-2-methylpropoxy)carbonyl-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid
- InChIKey: MISIVWJIYYKBHA-UHFFFAOYSA-N
- InChI: InChI=1S/C19H22N2O8/c1-10-14(18(25)29-9-19(2,3)26)15(16(17(23)24)12(8-22)20-10)11-6-4-5-7-13(11)21(27)28/h4-7,15,20,22,26H,8-9H2,1-3H3,(H,23,24)
- SMILES: CC1=C(C(C(=C(N1)CO)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC(C)(C)O
- Exact Mass: 406.13762
- Molecular Formula: C19H22N2O8
-
Compound CID:
118753600
118753600
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.