The details of FoldDB ID: fd1325 |
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| Identification | |
|---|---|
| FoldDB ID | fd1325 |
| Smiles | |
| Inchi Key | UFEHMWVLEMOTPZ-ACRUOGEOSA-N |
| Molecular weight | 429.557 |
| Molecular formula | C21H39N3O6 |
| Other Name
Since there is no uniform representation for the non-natural peptides. This is the name as it is mentioned in the original article and/or the external database. | Boc-[(S)-Iva]3-OMe |
| Note | |
| Source | synthetic construct |
| External ID | |||||
|---|---|---|---|---|---|
| Reaxys ID | 7724788 | ||||
| CAS Number | 194727-36-1 | ||||
| Structural Information | |
|---|---|
| Structure reported | yes |
| Method | NMR, X-ray |
| NMR Solvent | CDCl3 |
| CCDC Number (solvent) | 1250058(EtOH) |
| Other information | |
|---|---|
| Foldamer type | α Peptide |
| Structure Type | helical |
| Calculated properties | |
|---|---|
| LogP | 2.21000 |
| Rotatable Bonds | 15 |
| H Bond Donor | 3 |
| H Bond Acceptor | 9 |
| Polar Surface Area (PSA) | 122.83000 |
| Activity |
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| Activity not reported |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Studies on the Conformation of Boc-Protected (S)-(+)-Isovaline Homopeptide Methyl Esters in the Solid State and in Solution | 1997 | Jaun, Bernhard., Tanaka, Masakazu., Seiler, Paul., Kühnle, Florian N. M., Braun, Christine., Seebach, Dieter | Liebigs Ann.lRecuei | ||
