The details of FoldDB ID: fd1323 |
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Identification | |
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FoldDB ID | fd1323 |
Smiles | |
Inchi Key | ZZKYQKDXLNEVEB-HBGWOWRRSA-N |
Molecular weight | 1009.38 |
Molecular formula | C52H96N8O11 |
Chemical Name Chemical name | Boc-[(beta3(R)Val)3-Aib-(beta3(R)Val)4]-OMe |
Note | Aib=2-aminoisobutyric acid |
Source | synthetic construct |
External ID | |||||
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Reaxys ID | 30890353 |
Structural Information | |
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Structure reported | yes |
Method | NMR |
NMR Solvent | chloroform-d1 |
Other information | |
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Foldamer type | α/β Peptide |
Other type | β3-Aib peptide |
Structure Type | helical |
Calculated properties | |
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LogP | 4.63500 |
Rotatable Bonds | 53 |
H Bond Donor | 8 |
H Bond Acceptor | 19 |
Polar Surface Area (PSA) | 268.33000 |
Activity |
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Activity not reported |
Citations | |||||
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ID | Title | Year | Authors | Journal | DOI |
Homooligomeric β3(R)-valine peptides: Transformation between C14 and C12 helical structures induced by a guest Aib residue | 2017 | Vasantha, Basavalingappa., George, Gijo., Raghothama, Srinivasarao., Balaram, Padmanabhan | Peptide Science |