(s)-2-amino-5-((r)-3-(6-carbamoyl-7-methoxyquinolin-4-ylthio)-1-(carboxymethylamino)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
- Other Name: (2S)-2-amino-5-[[(2R)-3-(6-carbamoyl-7-methoxyquinolin-4-yl)sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
- InChIKey: ISCLPTLEFCRHEZ-JSGCOSHPSA-N
- InChI: InChI=1S/C21H25N5O8S/c1-34-15-7-13-10(6-11(15)19(23)30)16(4-5-24-13)35-9-14(20(31)25-8-18(28)29)26-17(27)3-2-12(22)21(32)33/h4-7,12,14H,2-3,8-9,22H2,1H3,(H2,23,30)(H,25,31)(H,26,27)(H,28,29)(H,32,33)/t12-,14-/m0/s1
- SMILES: COC1=CC2=NC=CC(=C2C=C1C(=O)N)SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N
- Exact Mass: 507.14238
- Molecular Formula: C21H25N5O8S
-
Compound CID:
118753336
118753336
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.