(r)-2-(6-carbamoyl-7-methoxyquinolin-4-ylamino)-3-(6-carbamoyl-7-methoxyquinolin-4-ylthio)propanoic acid
- Other Name: (2R)-2-[(6-carbamoyl-7-methoxyquinolin-4-yl)amino]-3-(6-carbamoyl-7-methoxyquinolin-4-yl)sulfanylpropanoic acid
- InChIKey: KCWOKPSYUUGOBQ-IBGZPJMESA-N
- InChI: InChI=1S/C25H23N5O6S/c1-35-20-9-17-12(7-14(20)23(26)31)16(3-5-28-17)30-19(25(33)34)11-37-22-4-6-29-18-10-21(36-2)15(24(27)32)8-13(18)22/h3-10,19H,11H2,1-2H3,(H2,26,31)(H2,27,32)(H,28,30)(H,33,34)/t19-/m0/s1
- SMILES: COC1=CC2=NC=CC(=C2C=C1C(=O)N)N[C@@H](CSC3=C4C=C(C(=CC4=NC=C3)OC)C(=O)N)C(=O)O
- Exact Mass: 521.13690
- Molecular Formula: C25H23N5O6S
-
Compound CID:
118753341
118753341
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.