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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| FDFLPENE | PEG | O-(N-acetyl-4,7,8,9-tetra-O-acetyl-1-methyl-α-neuraminosyl)-(2→3)-O-2,4-di-O-acetyl-6-O-(phenylmethyl)-β-D-galactopyranosyl-(1→4)-O-[6-deoxy-2,3,4-tris-O-(phenylmethyl)-α-L-galactopyranosyl-(1→3)]-2-(acetylamino)-2-deoxy-6-O-(phenylmethyl)-β-D-glucopyranosylamine |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01152 |
| Smiles | |
| Molecular weight | 3360.38 |
| Molecular formula | C174H209N13O53S |
| Chemical name | Peptide information |
| Sequence (one letter) | FDFLPENE |
| Length | 8 |
| Peptide name | N/A |
| External ID | |
|---|---|
| CAS number | 945245-56-7 |
| Other information | |
|---|---|
| Application | Synthesis |
| Additional function | anti-inflammatory ativity |
| Pharmacological class | Anti-inflammatory |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | PEG |
| Small molecule | O-(N-acetyl-4,7,8,9-tetra-O-acetyl-1-methyl-α-neuraminosyl)-(2→3)-O-2,4-di-O-acetyl-6-O-(phenylmethyl)-β-D-galactopyranosyl-(1→4)-O-[6-deoxy-2,3,4-tris-O-(phenylmethyl)-α-L-galactopyranosyl-(1→3)]-2-(acetylamino)-2-deoxy-6-O-(phenylmethyl)-β-D-glucopyranosylamine |
| Small molecule CAS | 930806-14-7 |
| Structure method | 1H and 13C NMR, RP-HPLC |
| NMR solvent | CD3OD |
| Calculated properties | |
|---|---|
| LogP | 11.27860 |
| Rotatable bonds | 103 |
| H bond donor | 13 |
| H bond acceptor | 42 |
| Polar surface area (PSA) | 857.78000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
(p-Sulfomethyl)phenylalanine as a mimic of O-sulfatyl-tyrosine in synthetic partial sequences of P-Selectin glycoprotein ligand 1 (PSGL-1) | 2007 | Herzner, Holger; Kunz, Horst | Tetrahedron | ||
