(2s,3s,4s,5r)-6-(5-chloro-2-(3-(3,4-dichlorophenyl)ureido)phenoxy)-3,4,5-trihydroxytetrahydro-2h-pyran-2-carboxylic acid
- Other Name: (2S,3S,4S,5R)-6-[5-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: XCQBQJHEPXUNPG-PDHYLSHYSA-N
- InChI: InChI=1S/C19H17Cl3N2O8/c20-7-1-4-11(24-19(30)23-8-2-3-9(21)10(22)6-8)12(5-7)31-18-15(27)13(25)14(26)16(32-18)17(28)29/h1-6,13-16,18,25-27H,(H,28,29)(H2,23,24,30)/t13-,14-,15+,16-,18?/m0/s1
- SMILES: C1=CC(=C(C=C1NC(=O)NC2=C(C=C(C=C2)Cl)OC3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)Cl)Cl
- Exact Mass: 506.00505
- Molecular Formula: C19H17Cl3N2O8
-
Compound CID:
118753036
118753036
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.