apremilast metabolite m22
- Other Name: Apremilast metabolite M22
- InChIKey: OQNVKSUIWXLRJM-OAHLLOKOSA-N
- InChI: InChI=1S/C20H22N2O8S/c1-11(23)21-14-6-4-5-13(18(14)20(26)27)19(25)22-15(10-31(3,28)29)12-7-8-17(30-2)16(24)9-12/h4-9,15,24H,10H2,1-3H3,(H,21,23)(H,22,25)(H,26,27)/t15-/m1/s1
- SMILES: CC(=O)NC1=CC=CC(=C1C(=O)O)C(=O)N[C@H](CS(=O)(=O)C)C2=CC(=C(C=C2)OC)O
- Exact Mass: 450.10969
- Molecular Formula: C20H22N2O8S
-
Compound CID:
169502036
169502036
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.