3D model is for representation purpose only.
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PI | Vinblastine |
Identification | |
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ConjuPepDB ID | cpd01059 |
Smiles | |
Molecular weight | 1047.54 |
Molecular formula | C58H75N6O12 |
Chemical name | Peptide information |
Sequence (one letter) | PI |
Length | 2 |
Peptide name | dipeptide |
External ID | |
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CAS number | 1097833-57-2 |
Other information | |
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Application | Anticancer, antimitotic |
Pharmacological class | anticancer |
Conjugate type | amide |
Linker | no |
Small molecule | Vinblastine |
Small molecule CAS | 865-21-4 |
Small molecule structure | |
Structure method | 1H and 13C NMR, COSY |
NMR solvent | CDCl5 |
Calculated properties | |
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LogP | -1.28107 |
Rotatable bonds | 17 |
H bond donor | 4 |
H bond acceptor | 11 |
Polar surface area (PSA) | 217.34000 |
Citations | |||||
---|---|---|---|---|---|
ID | Title | Year | Authors | Journal | DOI |
Synthesis and Biological Evaluation of Vinca Alkaloids and Phomopsin Hybrids | 2009 | Ngo, Quoc Anh; Roussi, Fanny; Cormier, Anthony; Thoret, Sylviane; Knossow, Marcel; Guenard, Daniel; Gueritte, Francoise | Journal of Medicinal Chemistry |