BIOPEP-UWM: Report

ID 10498
Name Acetylcholinesterase inhibitor
sequence
HPVAINA

Function:
Inhibitor of Acetylcholinesterase (EC 3.1.1.7)
 
Number of residues
7
Activity code
ache
Activity :
AChE inhibitor
Chemical mass 720.8148 Monoisotopic mass 720.3907
IC50 :
589.00 µM



Bibliographic data:
Authors
Asen N.D., Okagu O.D., Udenigwe C.C., Aluko R.E.
Title
In vitro inhibition of acetylcholinesterase activity by yellow field pea (Pisum sativum) protein-derived peptides as revealed by kinetics and molecular docking. Front. Nutr., 9, 2022
Year Source
2022 Journal



Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@H](CC1=CN=C[NH]1)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(C)C(=O)O

InChI=1S/C32H52N10O9/c1-7-16(4)25(30(48)39-21(12-23(34)43)27(45)38-18(6)32(50)51)41-26(44)17(5)37-29(47)24(15(2)3)40-28(46)22-9-8-10-42(22)31(49)20(33)11-19-13-35-14-36-19/h13-18,20-22,24-25H,7-12,33H2,1-6H3,(H2,34,43)(H,35,36)(H,37,47)(H,38,45)(H,39,48)(H,40,46)(H,41,44)(H,50,51)/t16-,17-,18-,20-,21-,22-,24-,25-/m0/s1

InChIKey=BBKXAVRFWBDRNC-YEKOUOQGSA-N

The IC50 value was calculated in μmol/L.



Database reference: