(2s,3s,4s,5r,6s)-6-(2-amino-5-(2-(2-hydroxy-2-phenylethylamino)ethyl)phenoxy)-3,4,5-trihydroxytetrahydro-2h-pyran-2-carboxylic acid
- Other Name: (2S,3S,4S,5R,6S)-6-[2-amino-5-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: RTUDXGJPMYKMKG-VLUVEEBQSA-N
- InChI: InChI=1S/C22H28N2O8/c23-14-7-6-12(8-9-24-11-15(25)13-4-2-1-3-5-13)10-16(14)31-22-19(28)17(26)18(27)20(32-22)21(29)30/h1-7,10,15,17-20,22,24-28H,8-9,11,23H2,(H,29,30)/t15?,17-,18-,19+,20-,22+/m0/s1
- SMILES: C1=CC=C(C=C1)C(CNCCC2=CC(=C(C=C2)N)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O
- Exact Mass: 448.18457
- Molecular Formula: C22H28N2O8
-
Compound CID:
118753476
118753476
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.