1-(8-(2-chlorophenyl)-9-(4-chlorophenyl)-9h-purin-6-yl)-4-((3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-ylamino)piperidine-4-carboxamide
- Other Name: 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]-4-[[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]amino]piperidine-4-carboxamide
- InChIKey: WSMPIMHVJVXWPW-QQVVVCQFSA-N
- InChI: InChI=1S/C28H29Cl2N7O5/c29-15-5-7-16(8-6-15)37-23(17-3-1-2-4-18(17)30)34-20-24(32-14-33-25(20)37)36-11-9-28(10-12-36,27(31)41)35-26-22(40)21(39)19(13-38)42-26/h1-8,14,19,21-22,26,35,38-40H,9-13H2,(H2,31,41)/t19-,21-,22-,26?/m1/s1
- SMILES: C1CN(CCC1(C(=O)N)NC2[C@@H]([C@@H]([C@H](O2)CO)O)O)C3=NC=NC4=C3N=C(N4C5=CC=C(C=C5)Cl)C6=CC=CC=C6Cl
- Exact Mass: 613.16072
- Molecular Formula: C28H29Cl2N7O5
-
Compound CID:
118753067
118753067
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.