(r)-2-(6-carbamoyl-7-methoxyquinolin-4-ylamino)-3-(((r)-2-(6-carbamoyl-7-methoxyquinolin-4-ylamino)-3-(carboxymethylamino)-3-oxopropyl)disulfanyl)propanoic acid
- Other Name: (2R)-2-[(6-carbamoyl-7-methoxyquinolin-4-yl)amino]-3-[[(2R)-2-[(6-carbamoyl-7-methoxyquinolin-4-yl)amino]-3-(carboxymethylamino)-3-oxopropyl]disulfanyl]propanoic acid
- InChIKey: GSFKJDJKGPMLTE-GOTSBHOMSA-N
- InChI: InChI=1S/C30H31N7O9S2/c1-45-24-9-20-14(7-16(24)27(31)40)18(3-5-33-20)36-22(29(42)35-11-26(38)39)12-47-48-13-23(30(43)44)37-19-4-6-34-21-10-25(46-2)17(28(32)41)8-15(19)21/h3-10,22-23H,11-13H2,1-2H3,(H2,31,40)(H2,32,41)(H,33,36)(H,34,37)(H,35,42)(H,38,39)(H,43,44)/t22-,23-/m0/s1
- SMILES: COC1=CC2=NC=CC(=C2C=C1C(=O)N)N[C@@H](CSSC[C@@H](C(=O)O)NC3=C4C=C(C(=CC4=NC=C3)OC)C(=O)N)C(=O)NCC(=O)O
- Exact Mass: 697.16247
- Molecular Formula: C30H31N7O9S2
-
Compound CID:
118753323
118753323
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.