MF231
compound 7i of Alisi et al. With spacer n=10 human AChE IC50 0.04 microM. 7-fold greater inhibitor with respect to heptylphysostigmin
General
Type : Derivative of physostigmine-eserine, Stigmine, Carbamate, Morpholine, Indole
Chemical_Nomenclature : [(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-(10-morpholin-4-yldecyl)carbamate
Canonical SMILES : C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NCCCCCCCCCCN4CCOCC4)C)C
InChI : InChI=1S\/C28H46N4O3\/c1-28-14-17-30(2)26(28)31(3)25-13-12-23(22-24(25)28)35-27(33)29-15-10-8-6-4-5-7-9-11-16-32-18-20-34-21-19-32\/h12-13,22,26H,4-11,14-21H2,1-3H3,(H,29,33)\/t26-,28+\/m1\/s1
InChIKey : VUNAAQIKHSGPRS-IAPPQJPRSA-N
Other name(s) : DTXSID20935027 || 1,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo(2,3-b)indol-5-yl hydrogen (10-(morpholin-4-yl)decyl)carbonimidate || RefChem:1053113 || MF 231 || CHEMBL431519
MW : 486.7
Formula : C28H46N4O3
CAS_number : 154619-64-4
PubChem : 3074016
UniChem : VUNAAQIKHSGPRS-IAPPQJPRSA-N
Target
Families : MF231 ligand of proteins in family
ACHE
References (3)
| Title : Synthesis and structure-activity relationships of new acetylcholinesterase inhibitors: Morpholinoalkylcarbamoyloxyeseroline derivatives - Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| Author(s) : Alisi MA , Brufani M , Filocamo L , Gostoli G , Licandro E , Cesta MC , Lappa S , Marchesini D , Pagella P |
| Ref : Bioorganic & Medicinal Chemistry Lett , 5 :2077 , 1995 |
| Abstract : |
| PubMedSearch : Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| PubMedID: |
| Title : Synthesis and structure-activity relationships of new acetylcholinesterase inhibitors: Morpholinoalkylcarbamoyloxyeseroline derivatives - Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| Author(s) : Alisi MA , Brufani M , Filocamo L , Gostoli G , Licandro E , Cesta MC , Lappa S , Marchesini D , Pagella P |
| Ref : Bioorganic & Medicinal Chemistry Lett , 5 :2077 , 1995 |
| Abstract : |
| PubMedSearch : Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| PubMedID: |
| Title : Synthesis and structure-activity relationships of new acetylcholinesterase inhibitors: Morpholinoalkylcarbamoyloxyeseroline derivatives - Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| Author(s) : Alisi MA , Brufani M , Filocamo L , Gostoli G , Licandro E , Cesta MC , Lappa S , Marchesini D , Pagella P |
| Ref : Bioorganic & Medicinal Chemistry Lett , 5 :2077 , 1995 |
| Abstract : |
| PubMedSearch : Alisi_1995_Bioorg.Med.Chem.Lett_5_2077 |
| PubMedID: |