Desthiobiotin-PEG3-Azide
Not really an inhibitor but reacts as substrate of click chemistry together with an alkine compound inside the active site of an enzyme
General
Type : Azido,ABPP-Probe,Biotin derivative
Chemical_Nomenclature : N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
Canonical SMILES : CC1C(NC(=O)N1)CCCCCC(=O)NCCOCCOCCOCCN=[N+]=[N-]
InChI : InChI=1S\/C18H34N6O5\/c1-15-16(23-18(26)22-15)5-3-2-4-6-17(25)20-7-9-27-11-13-29-14-12-28-10-8-21-24-19\/h15-16H,2-14H2,1H3,(H,20,25)(H2,22,23,26)
InChIKey : JIQVKRRASYKCEL-UHFFFAOYSA-N
Other name(s) : Desthiobiotin PEG3 Azide,MFCD28334534,Azide-PEG3-Desthiobiotin,HY-W096120,BP-22473,CS-0147748
MW : 414.5
Formula : C18H34N6O5
CAS_number : 1426828-06-9
PubChem : 121486730
UniChem : JIQVKRRASYKCEL-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Desthiobiotin-PEG3-Azide ligand of proteins in family: Carbon-carbon_bond_hydrolase
Stucture :
Protein : myctu-Rv3569c
References (1)
| Title : Direct capture, inhibition and crystal structure of HsaD (Rv3569c) from M. tuberculosis - Barelier_2022_FEBS.J__ |
| Author(s) : Barelier S , Avellan R , Gnawali GR , Fourquet P , Roig-Zamboni V , Poncin I , Point V , Bourne Y , Audebert S , Camoin L , Spilling CD , Canaan S , Cavalier JF , Sulzenbacher G |
| Ref : Febs J , : , 2022 |
| Abstract : Barelier_2022_FEBS.J__ |
| ESTHER : Barelier_2022_FEBS.J__ |
| PubMedSearch : Barelier_2022_FEBS.J__ |
| PubMedID: 36197115 |
| Gene_locus related to this paper: myctu-Rv3569c |