Biotin-Teg-amine TFA - CAS 1334172-59-6

Biotin-C1-PEG3-C3-amine TFA is a polyethylene glycol (PEG)-based PROTAC linker. Biotin-C1-PEG3-C3-amine TFA can be used in the synthesis of a series of PROTACs.

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Molecular Formula
C₂₂H₃₉F₃N₄O₇S
Molecular Weight
560.63

Biotin-Teg-amine TFA

    • Specification
      • Appearance
        Liquid
        Storage
        Please store the product under the recommended conditions in the Certificate of Analysis.
        Shipping
        Room temperature in continental US; may vary elsewhere.
        IUPAC Name
        N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide
        Synonyms
        Biotin-Teg-NH2 TFA
    • Properties
      • InChI Key
        XNGTVIOREZIKAE-UHFFFAOYSA-N
        InChI
        InChI=1S/C20H38N4O5S/c21-7-3-9-27-11-13-29-14-12-28-10-4-8-22-18(25)6-2-1-5-17-19-16(15-30-17)23-20(26)24-19/h16-17,19H,1-15,21H2,(H,22,25)(H2,23,24,26)
        Canonical SMILES
        C1C2C(C(S1)CCCCC(=O)NCCCOCCOCCOCCCN)NC(=O)N2
    • Reference Reading
      • 1. Remarkable amine-TFA self assembly
        Chagit Denekamp, Eisaam Egbaria J Am Soc Mass Spectrom. 2004 Mar;15(3):356-62.doi: 10.1016/j.jasms.2003.11.009.
        Supramolecular assemblies that are formed between amines and trifluoroacetic acid were studied using electrospray ionization mass spectrometry. Distinctive association behavior of primary, secondary, and tertiary amines with trifluoroacetic acid upon identical experimental conditions is observed and indicates that steric effects dominate in the formation of these protonated clusters. Extraordinary complexation behavior is observed in the case of R-(+)-alpha-methylbenzylamine and 4-tert-butyl-cyclohexylamine that form high-order clusters. The strong relation between stereochemistry and assembly results in the specific association characteristics of trans 4-tert-butyl-1-phenylcyclohexylamine when compared with the cis isomer. The cis isomer gives rise to a highly abundant [M(4)TFA(3) + H](+) ion (M = amine molecule, TFA = trifluoroacetic acid), as observed for other primary amines. However, the trans isomer generates higher [M(n)TFA(m) + H](+) cluster ions, the largest and most abundant being an [M(7)TFA(6) + H](+) ion. Collision induced dissociation spectra that were recorded for several [M(n)TFA(m) + H](+) cluster ions typically show the consecutive losses of M.TFA moieties. Density functional theory calculations indicate that the highly abundant [M(4)TFA(3) + H](+) clusters are macrocycles and support the formation of these structures with TFA and not with acetic acid.
        2. Global Surveillance of trans-Fatty Acids
        Chaoyang Li, Laura K Cobb, Hubert W Vesper, Samira Asma Prev Chronic Dis. 2019 Oct 31;16:E147.doi: 10.5888/pcd16.190121.
        Trans-fatty acid (TFA) intake can increase the risk of coronary heart disease (CHD) morbidity and mortality and all-cause mortality. Industrially produced TFAs and ruminant TFAs are the major sources in foods. TFA intake and TFA-attributed CHD mortality vary widely worldwide. Excessive TFA intake is a health threat in high-income countries; however, it is also a threat in low- and middle-income countries (LMICs). Data on TFA intake are scarce in many LMICs and an urgent need exists to monitor TFAs globally. We reviewed global TFA intake and TFA-attributed CHD mortality and current progress toward policy or regulation on elimination of industrially produced TFAs in foods worldwide. Human biological tissues can be used as biomarkers of TFAs because they reflect actual intake from various foods. Measuring blood TFA levels is a direct and reliable method to quantify TFA intake.
        3. Development of a theory-informed questionnaire to assess the acceptability of healthcare interventions
        Mandeep Sekhon, Martin Cartwright, Jill J Francis BMC Health Serv Res. 2022 Mar 1;22(1):279.doi: 10.1186/s12913-022-07577-3.
        Background:The theoretical framework of acceptability (TFA) was developed in response to recommendations that acceptability should be assessed in the design, evaluation and implementation phases of healthcare interventions. The TFA consists of seven component constructs (affective attitude, burden, ethicality, intervention coherence, opportunity costs, perceived effectiveness, and self-efficacy) that can help to identify characteristics of interventions that may be improved. The aim of this study was to develop a generic TFA questionnaire that can be adapted to assess acceptability of any healthcare intervention.
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