n-(3-chloro-4-(5-hydroxy-10,11-dihydro-5h-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10-carbonyl)phenyl)-5-fluoro-2-methylbenzamide
- Other Name: N-[3-chloro-4-(11-hydroxy-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl)phenyl]-5-fluoro-2-methylbenzamide
- InChIKey: UNYQXQUVEHPPBK-UHFFFAOYSA-N
- InChI: InChI=1S/C27H21ClFN3O3/c1-16-8-9-17(29)13-22(16)25(33)30-18-10-11-20(23(28)14-18)26(34)32-15-19-5-4-12-31(19)27(35)21-6-2-3-7-24(21)32/h2-14,27,35H,15H2,1H3,(H,30,33)
- SMILES: CC1=C(C=C(C=C1)F)C(=O)NC2=CC(=C(C=C2)C(=O)N3CC4=CC=CN4C(C5=CC=CC=C53)O)Cl
- Exact Mass: 489.12555
- Molecular Formula: C27H21ClFN3O3
-
Compound CID:
118753196
118753196
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.