(2s,3s,4s,5r,6r)-6-((1-carboxy-2-(4-((6-hydroxy-1-methyl-1h-benzo[d]imidazol-2-yl)methoxy)phenyl)ethylthio)carbonylamino)-3,4,5-trihydroxytetrahydro-2h-pyran-2-carboxylic acid
- Other Name: (2S,3S,4S,5R,6R)-6-[[1-carboxy-2-[4-[(6-hydroxy-1-methylbenzimidazol-2-yl)methoxy]phenyl]ethyl]sulfanylcarbonylamino]-3,4,5-trihydroxyoxane-2-carboxylic acid
- InChIKey: UGKRAHNGTWJBTF-BXLZEGBGSA-N
- InChI: InChI=1S/C25H27N3O11S/c1-28-15-9-12(29)4-7-14(15)26-17(28)10-38-13-5-2-11(3-6-13)8-16(23(33)34)40-25(37)27-22-20(32)18(30)19(31)21(39-22)24(35)36/h2-7,9,16,18-22,29-32H,8,10H2,1H3,(H,27,37)(H,33,34)(H,35,36)/t16?,18-,19-,20+,21-,22+/m0/s1
- SMILES: CN1C2=C(C=CC(=C2)O)N=C1COC3=CC=C(C=C3)CC(C(=O)O)SC(=O)N[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O
- Exact Mass: 577.13663
- Molecular Formula: C25H27N3O11S
-
Compound CID:
118753195
118753195
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.