 Use the buttons at the bottom of Jsmol viewer to see different representations, ON/OFF Hydrogens, and ON/OFF rotation.
                        Use the buttons at the bottom of Jsmol viewer to see different representations, ON/OFF Hydrogens, and ON/OFF rotation.
                      
                      3D model is for representation purpose only.
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 Schematic representation of peptide, linker and drug in the peptide-drug conjugates
                        Schematic representation of peptide, linker and drug in the peptide-drug conjugates
                      
                      |  |  |  |  |  | 
|---|---|---|---|---|
| XGV | Vitamin H (biotin) | 
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00673 | 
| Smiles | |
| Inchi Key | InChIKey=UOVXMHQNPWWJSF-GVARAGBVSA-N | 
| Molecular weight | 400.178 | 
| Molecular formula | C17H28N4O5S | 
| Chemical name | Peptide information | 
| Sequence (one letter) | XGV | 
| Length | 3 | 
| Peptide name | dipeptide | 
| External ID | |
|---|---|
| CAS number | 1403487-35-3 | 
| Other information | |
|---|---|
| Application | Synthesis | 
| Additional function | Microwave-assister formation of peptide–vitamin conjugates | 
| Conjugate type | amide | 
| Linker | no | 
| Small molecule | Vitamin H (biotin) | 
| Small molecule CAS | 58-85-5 | 
| Small molecule structure |  | 
| Structure method | 1H-NMR | 
| NMR solvent | CDCl3, (CD3)CO or DMSO-d6 | 
| Calculated properties | |
|---|---|
| LogP | -0.43488 | 
| Rotatable bonds | 10 | 
| H bond donor | 5 | 
| H bond acceptor | 5 | 
| Polar surface area (PSA) | 136.63000 | 
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI | 
| Microwave-assisted formation of peptide-vitamin conjugates | 2012 | El-Nachef, Claudia; Bajaj, Kiran; Koblick, Jacqueline; Katritzky, Alan R. | European Journal of Organic Chemistry | ||