Cpd17-Pyrrolidine-THL-derivative
General
Type : Oxooxetan,Lipase inhibitor,Pyrrolidine
Chemical_Nomenclature : (S)-((S)-1-((2S,3S)-3-hexyl-4-oxooxetan-2-yl)tridecan-2-yl)1-acetylpyrrolidine-2-carboxylate
Canonical SMILES : CCCCCCCCCCCC(CC1OC(C1CCCCCC)=O)OC(=O)C2CCCN2C(=O)C
InChI : InChI=1S\/C29H51NO5\/c1-4-6-8-10-11-12-13-14-15-18-24(34-29(33)26-20-17-21-30(26)23(3)31)22-27-25(28(32)35-27)19-16-9-7-5-2\/h24-27H,4-22H2,1-3H3
InChIKey : REKDUIKHBRMXTD-UHFFFAOYSA-N
Other name(s) :
MW : 493.72
Formula : C29H51NO5
CAS_number :
PubChem :
UniChem : REKDUIKHBRMXTD-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Cpd17-Pyrrolidine-THL-derivative ligand of proteins in family: Cutinase
Stucture :
Protein : myctu-Rv3802c
References (1)
| Title : Inhibitors of an essential mycobacterial cell wall lipase (Rv3802c) as tuberculosis drug leads - West_2011_Chem.Commun.(Camb)_47_5166 |
| Author(s) : West NP , Cergol KM , Xue M , Randall EJ , Britton WJ , Payne RJ |
| Ref : Chem Commun (Camb) , 47 :5166 , 2011 |
| Abstract : West_2011_Chem.Commun.(Camb)_47_5166 |
| ESTHER : West_2011_Chem.Commun.(Camb)_47_5166 |
| PubMedSearch : West_2011_Chem.Commun.(Camb)_47_5166 |
| PubMedID: 21384024 |
| Gene_locus related to this paper: myctu-Rv3802c |