N-acyl-prolylpyrrolidine-inhibitor-1
General
Type : Pyrrolidine,Azido
Chemical_Nomenclature : 1-[(2S,4S)-4-azido-2-[(2S)-2-methanimidoylpyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-phenylbutan-1-one
Canonical SMILES : C1CC(N(C1)C(=O)C2CC(CN2C(=O)CCCC3=CC=CC=C3)N=[N+]=[N-])C=N || C1CC(N(C1)C(=O)C2CC(CN2C(=O)CCCC3=CC=CC=C3)N=[N+]=N)C(N)O
InChI : InChI=1S\/C20H26N6O2\/c21-13-17-9-5-11-25(17)20(28)18-12-16(23-24-22)14-26(18)19(27)10-4-8-15-6-2-1-3-7-15\/h1-3,6-7,13,16-18,21H,4-5,8-12,14H2\/t16-,17-,18-\/m0\/s1
InChIKey : RQLBORLYVYBGHJ-BZSNNMDCSA-N || YQKXZNKBYWGJBN-LSTDLKDCSA-N
Other name(s) : (5r,6r,8s)-8-(3-{[amino(Imino)methyl]amino} Phenyl)-5-Cyclohexyl-6-Hydroxy-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide,4I4
MW : 382.46
Formula : C20H26N6O2
CAS_number :
UniChem : RQLBORLYVYBGHJ-BZSNNMDCSA-N || YQKXZNKBYWGJBN-LSTDLKDCSA-N
IUPHAR :
Wikipedia :
Target
Families : N-acyl-prolylpyrrolidine-inhibitor-1 ligand of proteins in family: S9N_PPCE_Peptidase_S9
Stucture : 4BCB Prolyl Oligopeptidase from porcine brain with a covalently bound P2- substituted N-acyl-prolylpyrrolidine inhibitor 1
Protein : pig-ppce
References (1)
| Title : P2-substituted N-acylprolylpyrrolidine inhibitors of prolyl oligopeptidase: biochemical evaluation, binding mode determination, and assessment in a cellular model of synucleinopathy - Van der Veken_2012_J.Med.Chem_55_9856 |
| Author(s) : Van der Veken P , Fulop V , Rea D , Gerard M , Van Elzen R , Joossens J , Cheng JD , Baekelandt V , De Meester I , Lambeir AM , Augustyns K |
| Ref : Journal of Medicinal Chemistry , 55 :9856 , 2012 |
| Abstract : Van der Veken_2012_J.Med.Chem_55_9856 |
| ESTHER : Van der Veken_2012_J.Med.Chem_55_9856 |
| PubMedSearch : Van der Veken_2012_J.Med.Chem_55_9856 |
| PubMedID: 23121075 |
| Gene_locus related to this paper: pig-ppce |