BIOPEP-UWM: Report

ID 9606
Name HMG-CoA reductase inhibitor
sequence
IAVPGEVA
Function:
Inhibitor of HMG-CoA reductase (EC 1.1.1.34)
 
Number of residues
8
Activity code
HMGi
Activity :
HMG-CoA reductase inhibitor
Chemical mass 754.8690 Monoisotopic mass 754.4211
IC50 :
210.00 µM


Bibliographic data:
Authors
Pak V. V., Koo M., Lee N., Lee J. S., Kasimova T. D., Kwon D. Y.
Title
Isolation and identification of hypocholesterolemic peptide from 11S globulin of soy protein. Chem. Nat. Comp., 41, 710–714, 2005
Year Source
2005 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides

SMILES: N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(C(C)C)C(=O)N1[C@@]([H])(CCC1)C(=O)NCC(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(C)C(=O)O

InChI=1S/C34H58N8O11/c1-9-18(6)25(35)31(49)37-19(7)28(46)41-27(17(4)5)33(51)42-14-10-11-22(42)30(48)36-15-23(43)39-21(12-13-24(44)45)29(47)40-26(16(2)3)32(50)38-20(8)34(52)53/h16-22,25-27H,9-15,35H2,1-8H3,(H,36,48)(H,37,49)(H,38,50)(H,39,43)(H,40,47)(H,41,46)(H,44,45)(H,52,53)/t18-,19-,20-,21-,22-,25-,26-,27-/m0/s1

InChIKey: ODFBVPAGBMWODF-INBFODARSA-N


HMG-CoA reductase (EC 1.1.1.34) is involved in cholesterol biosynthesis.


Database reference:
BindingDB: ID 50226173

BRENDA: Ligand IAVPGEVA

ChEMBL: ID CHEMBL260510

ChemSpider: ID 23319355

J-GLOBAL: ID 201707017433445336

Nikkaji: ID J3.595.386H

PubChem: CID 44451948

ZINC: ID ZINC000095607838