atazanavir metabolite m3
- Other Name: p-Hydroxyatazanavir
- InChIKey: IZMDNYHPQLUEFK-GASGPIRDSA-N
- InChI: InChI=1S/C38H52N6O8/c1-37(2,3)31(41-35(49)51-7)33(47)40-29(21-24-14-18-27(45)19-15-24)30(46)23-44(43-34(48)32(38(4,5)6)42-36(50)52-8)22-25-12-16-26(17-13-25)28-11-9-10-20-39-28/h9-20,29-32,45-46H,21-23H2,1-8H3,(H,40,47)(H,41,49)(H,42,50)(H,43,48)/t29-,30-,31+,32+/m0/s1
- SMILES: CC(C)(C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)[C@H](CN(CC2=CC=C(C=C2)C3=CC=CC=N3)NC(=O)[C@H](C(C)(C)C)NC(=O)OC)O)NC(=O)OC
- Exact Mass: 720.38466
- Molecular Formula: C38H52N6O8
-
Compound CID:
169501922
169501922
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.