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The details of FoldDB ID: fd1323
Chemical diagram
molecule
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Identification
FoldDB ID

fd1323

Smiles
Inchi Key

ZZKYQKDXLNEVEB-HBGWOWRRSA-N

Molecular weight

1009.38

Molecular formula

C52H96N8O11

Chemical Name Help Icon Chemical name

Boc-[(beta3(R)Val)3-Aib-(beta3(R)Val)4]-OMe

Note

Aib=2-aminoisobutyric acid

Source

synthetic construct

External ID
Reaxys ID

30890353

Structural Information
Structure reported

yes

Method

NMR

NMR Solvent

chloroform-d1

Other information
Foldamer type

α/β Peptide

Other type

β3-Aib peptide

Structure Type

helical

Calculated properties
LogP

4.63500

Rotatable Bonds

53

H Bond Donor

8

H Bond Acceptor

19

Polar Surface Area (PSA)

268.33000

Activity
Activity not reported
Citations
ID Title Year Authors Journal DOI

fdart0165

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

..