THL-10d
Compound THL(Orlistat)alpha-chain modified intermediate for Orlistat synthesis. Modest inhibitore of Ag85A (34+/- 22 microM) and Ag85C (66+/-8 microM).
General
Type : Oxooxetan,Lipase inhibitor,Benzyloxycarbonyl
Chemical_Nomenclature : (2S)-1-((2S)-3-isopropyl-4-oxooxetan-2-yl)tridecan-2-yl ((benzyloxy)carbonyl)-L-leucinate
Canonical SMILES : C(CCCCCCCCCC(CC1C(C(O1)=O)C(C)C)OC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C
InChI : InChI=1S\/C33H53NO6\/c1-6-7-8-9-10-11-12-13-17-20-27(22-29-30(25(4)5)32(36)40-29)39-31(35)28(21-24(2)3)34-33(37)38-23-26-18-15-14-16-19-26\/h14-16,18-19,24-25,27-30H,6-13,17,20-23H2,1-5H3,(H,34,37)
InChIKey : FKTDDZMNPSGCRY-UHFFFAOYSA-N
Other name(s) :
MW : 559.78
Formula : C33H53NO6
CAS_number :
PubChem :
UniChem : FKTDDZMNPSGCRY-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : THL-10d ligand of proteins in family: A85-Mycolyl-transferase
Stucture : 7MYG Crystal structure of Ag85C modified by THL-10d
Protein : myctu-a85c
References (1)
| Title : Total Synthesis of Tetrahydrolipstatin, Its Derivatives, and Evaluation of Their Ability to Potentiate Multiple Antibiotic Classes against Mycobacterium Species - Khan_2021_ACS.Infect.Dis_7_2876 |
| Author(s) : Khan SS , Sudasinghe TD , Landgraf AD , Ronning DR , Sucheck SJ |
| Ref : ACS Infect Dis , 7 :2876 , 2021 |
| Abstract : Khan_2021_ACS.Infect.Dis_7_2876 |
| ESTHER : Khan_2021_ACS.Infect.Dis_7_2876 |
| PubMedSearch : Khan_2021_ACS.Infect.Dis_7_2876 |
| PubMedID: 34478259 |
| Gene_locus related to this paper: myctu-a85c |