ritonavir_m10
- Other Name: Thiazol-5-ylmethyl N-((1S,2S,4S)-1-benzyl-2-hydroxy-4-(((2S)-2-((hydroxymethyl-((2-isopropylthiazol-4-yl)methyl)carbamoyl)amino)-3-methyl-butanoyl)amino)-5-phenyl-pentyl)carbamate
- InChIKey: CYQJXDGHGQCURZ-XGKFQTDJSA-N
- InChI: InChI=1S/C37H48N6O6S2/c1-24(2)33(42-36(47)43(23-44)19-29-21-50-35(40-29)25(3)4)34(46)39-28(15-26-11-7-5-8-12-26)17-32(45)31(16-27-13-9-6-10-14-27)41-37(48)49-20-30-18-38-22-51-30/h5-14,18,21-22,24-25,28,31-33,44-45H,15-17,19-20,23H2,1-4H3,(H,39,46)(H,41,48)(H,42,47)/t28-,31-,32-,33-/m0/s1
- SMILES: CC(C)C1=NC(=CS1)CN(CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O
- Exact Mass: 736.30768
- Molecular Formula: C37H48N6O6S2
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Compound CID:
86278281
86278281
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.