1-DNJ-Cpd11e
1-deoxynojirimycin derivative. beta-Glucosidase IC50 = 14 microM Kia = 15 +/- 3 microM (Competitive); AChE IC50 = 5.8 microM Kia = 9.3 +/- 1.2 microM Kib = 5.2 +/- 0.5 microM (Mixed); BChE IC50 = 1.9 microM Kia = 1.4 +/- 0.4 microM Kib = 4.5 +/- 1.4 microM (Mixed)
General
Type : Piperidine, Carbohydrate, Glycoside
Chemical_Nomenclature : (2R,3R,4R,5S)-1-[6-[2-(3,4-dimethoxyphenyl)ethoxy]hexyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
Canonical SMILES : COC1=C(C=C(C=C1)CCOCCCCCCN2C[C@@H]([C@H]([C@@H]([C@H]2CO)O)O)O)OC
InChI : InChI=1S\/C22H37NO7\/c1-28-19-8-7-16(13-20(19)29-2)9-12-30-11-6-4-3-5-10-23-14-18(25)22(27)21(26)17(23)15-24\/h7-8,13,17-18,21-22,24-27H,3-6,9-12,14-15H2,1-2H3\/t17-,18+,21-,22-\/m1\/s1
InChIKey : NLRSNKAPKGHQQO-GMQQQROESA-N
Other name(s) : Compound 11e || CHEMBL5290892 || BDBM50608261
MW : 427.5
Formula : C22H37NO7
CAS_number :
PubChem : 171358502
UniChem : NLRSNKAPKGHQQO-GMQQQROESA-N
Target
References (2)
| Title : An overview on the synthesis of carbohydrate-based molecules with biological activity related to neurodegenerative diseases - Lopes_2021_RSC.Med.Chem_12_2001 |
| Author(s) : Lopes JPB , Silva L , Ludtke DS |
| Ref : RSC Med Chem , 12 :2001 , 2021 |
| Abstract : |
| PubMedSearch : Lopes_2021_RSC.Med.Chem_12_2001 |
| PubMedID: 35028560 |
| Title : Tuning the activity of iminosugars: novel N-alkylated deoxynojirimycin derivatives as strong BuChE inhibitors - Ahuja-Casarin_2021_J.Enzyme.Inhib.Med.Chem_36_138 |
| Author(s) : Ahuja-Casarin AI , Merino-Montiel P , Vega-Baez JL , Montiel-Smith S , Fernandes MX , Lagunes I , Maya I , Padron JM , Lopez O , Fernandez-Bolanos JG |
| Ref : J Enzyme Inhib Med Chem , 36 :138 , 2021 |
| Abstract : |
| PubMedSearch : Ahuja-Casarin_2021_J.Enzyme.Inhib.Med.Chem_36_138 |
| PubMedID: 33228403 |