chembl3706523
- Other Name: (2S)-N-[(2S,3S)-3-hydroxy-4-oxo-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide
- InChIKey: LKXMNSKLVUAOEW-PCCBWWKXSA-N
- InChI: InChI=1S/C24H24N4O5/c25-22(31)13-20(28-23(32)18-11-10-16-8-4-5-9-17(16)26-18)24(33)27-19(21(30)14-29)12-15-6-2-1-3-7-15/h1-11,14,19-21,30H,12-13H2,(H2,25,31)(H,27,33)(H,28,32)/t19-,20-,21+/m0/s1
- SMILES: C1=CC=C(C=C1)C[C@@H]([C@@H](C=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)C2=NC3=CC=CC=C3C=C2
- Exact Mass: 448.17467
- Molecular Formula: C24H24N4O5
-
Compound CID:
122197278
122197278
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.