3D model is for representation purpose only.
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PYAX | triazole | Mestranol |
Identification | |
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ConjuPepDB ID | cpd00674 |
Smiles | |
Inchi Key | InChIKey=AEOKLVSSBGZELK-SBRVWINHSA-N |
Molecular weight | 888.515 |
Molecular formula | C52H68N6O7 |
Chemical name | Peptide information |
Sequence (one letter) | PYAX |
Length | 4 |
Peptide name | oligopeptide |
External ID | |
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CAS number | 1412911-29-5 |
Other information | |
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Application | Synthesis |
Additional function | Convenient method for decoration of biologically active molecules with peptide residues |
Conjugate type | amide |
Linker | N/A |
Linker Type | triazole |
Small molecule | Mestranol |
Small molecule CAS | 72-33-3 |
Small molecule structure | |
Structure method | 1H- and 13C-NMR |
NMR solvent | CDCl3 |
Calculated properties | |
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LogP | 8.16336 |
Rotatable bonds | 15 |
H bond donor | 2 |
H bond acceptor | 8 |
Polar surface area (PSA) | 148.35000 |
Citations | |||||
---|---|---|---|---|---|
ID | Title | Year | Authors | Journal | DOI |
Synthesis of peptide conjugates of mestranol by a 1,3-dipolar cycloaddition click reaction | 2012 | Sokolova, N. V.; Nenajdenko, V. G. | Chemistry of Heterocyclic Compounds |