BIOPEP-UWM: Report

ID 10704
Name ACE inhibitor
sequence
VKF

Function:
Inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
3
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 392.4912 Monoisotopic mass 392.2416
IC50 :
11.00 µM



Bibliographic data:
Authors
Qi C., Lin G., Zhang R., Wu W.
Title
Studies on the bioactivities of ACE-inhibitory Peptides with phenylalanine C-terminus Using 3D-QSAR, molecular docking and in vitro evaluation. Mol Inform. 36, 1600157, 2017
Year Source
2017 Journal



Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)O

InChI=1S/C20H32N4O4/c1-13(2)17(22)19(26)23-15(10-6-7-11-21)18(25)24-16(20(27)28)12-14-8-4-3-5-9-14/h3-5,8-9,13,15-17H,6-7,10-12,21-22H2,1-2H3,(H,23,26)(H,24,25)(H,27,28)/t15-,16-,17-/m0/s1

InChIKey=HPANGHISDXDUQY-ULQDDVLXSA-N


Information concerning Angiotensin-Converting Enzyme (ACE) is available in MEROPS database of proteolytic enzymes (http://merops.sanger.ac.uk/); ID: M02-001



Database reference:
ChEBI: ID 166288

DFBP: ID DFBPACEI1080; DFBPACEI1975

Metabolomics Workbench: ID 86889

PubChem: CID 145458983