(r)-2-{(s)-6-hydroxy-7-methoxy-1-[2-(4-trifluoromethyl-phenyl)-ethyl]-3,4-dihydro-1h-isoquinolin-2-yl}-n-methyl-2-phenyl-acetamide
- Other Name: (2R)-2-[(1S)-6-hydroxy-7-methoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-2-phenylacetamide
- InChIKey: IBGXKVPJPLLVKU-JYFHCDHNSA-N
- InChI: InChI=1S/C28H29F3N2O3/c1-32-27(35)26(19-6-4-3-5-7-19)33-15-14-20-16-24(34)25(36-2)17-22(20)23(33)13-10-18-8-11-21(12-9-18)28(29,30)31/h3-9,11-12,16-17,23,26,34H,10,13-15H2,1-2H3,(H,32,35)/t23-,26+/m0/s1
- SMILES: CNC(=O)[C@@H](C1=CC=CC=C1)N2CCC3=CC(=C(C=C3[C@@H]2CCC4=CC=C(C=C4)C(F)(F)F)OC)O
- Exact Mass: 498.21303
- Molecular Formula: C28H29F3N2O3
-
Compound CID:
102128902
102128902
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.