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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| XGXPAK | b-carboline alkaloid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00798 |
| Smiles | |
| Inchi Key | InChIKey=XNBPNYNRKIJLSA-KZNPPGLNSA-N |
| Molecular weight | 1295.57 |
| Molecular formula | C67H81N11O14S |
| Chemical name | Peptide information |
| Sequence (one letter) | XGXPAK |
| Length | 6 |
| Peptide name | pentapeptide generated by plasmin degradation from the fibrinogen beta chain |
| External ID | |
|---|---|
| CAS number | 1305118-81-3 |
| Other information | |
|---|---|
| Application | Anti-thrombolytic therapy |
| Additional function | Free radical scavenging and thrombolitic activity, protective effect against organ injury induced by I/R in rat |
| Conjugate type | amide |
| Linker | no |
| Small molecule | b-carboline alkaloid |
| Small molecule CAS | 519032-21-4 |
| Small molecule structure | |
| Small molecule 2 | p-Toluenesulfonamide |
| Small molecule CAS 2 | 70-55-3 |
| Small molecule structure 2 | |
| NMR solvent | CD3OD + TFA |
| Calculated properties | |
|---|---|
| LogP | 5.96852 |
| Rotatable bonds | 29 |
| H bond donor | 9 |
| H bond acceptor | 13 |
| Polar surface area (PSA) | 351.45000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
A new class of β-carboline alkaloid-peptide conjugates with therapeutic efficacy in acute limb ischemia/reperfusion injury | 2011 | Bi, Wei; Bi, Yue; Xue, Ping; Zhang, Yanrong; Gao, Xiang; Wang, Zhibo; Li, Meng; Baudy-Floc'h, Michele; Ngerebara, Nathaniel; Michael Gibson, K.; Bi, Lanrong | European Journal of Medicinal Chemistry | ||
